*HEADER   DNA-BINDING PROTEIN                     26-JUL-98   2EZY    
*TITLE    SOLUTION STRUCTURE OF HUMAN BARRIER-TO-AUTOINTEGRATION      
*TITLE   2 FACTOR BAF, NMR, ENSEMBLE OF 20 SIMULATED ANNEALING        
*TITLE   3 STRUCTURES                                                 
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: BARRIER-TO-AUTOINTEGRATION FACTOR;               
*COMPND  3 CHAIN: A, B;                                               
*COMPND  4 ENGINEERED: YES;                                           
*COMPND  5 BIOLOGICAL_UNIT: DIMER                                     
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                         
*SOURCE  3 ORGANISM_COMMON: HUMAN;                                    
*SOURCE  4 EXPRESSION_SYSTEM: ESCHERICHIA COLI                        
*KEYWDS   DNA-BINDING PROTEIN, INTEGRATION, AIDS, RETROVIRUSES        
*EXPDTA   NMR, 20 STRUCTURES                                          
*AUTHOR   G.M.CLORE,M.CAI,A.M.GRONENBORN                              
*REVDAT  1   13-JAN-99 2EZY    0                                      
 
EXPERIMENTAL RESTRAINTS FOR 2EZX and 2EZY



HEADER    DNA-BINDING PROTEIN   
TITLE     SOLUTION STRUCTURE OF HUMAN BARRIER-TO-AUTOINTEGRATION FACTOR BAF
TITLE    2 NMR, MINIMIZED AVERAGE STRUCTURE                          
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: BARRIER-To-AUTOINTEGRATION FACTOR
COMPND   3 CHAIN: NULL                                                          
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: HUMAN 
SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI 
KEYWDS    DNA-BINDING PROTEIN, INTEGRATION, AIDS, RETROVIRUSES
EXPDTA    NMR, REGULARIZED MEAN STRUCTURE                                       
AUTHOR    G.M. CLORE, M. CAI, A.M.GRONENBORN
JRNL        AUTH   M. CAI, Y. HUANG, R. ZHENG, S.Q. WEI, R. GHIRLANDO
JRNL        AUTH 2 M.S. LEE, R. CRAIGIE, A.M. GRONENBORN, G.M. CLORE
JRNL        TITL   SOLUTION STRUCTURE OF THE CELLULAR FACTOR BAF RESPONSIBLE
JRNL        TITL 2 FOR PROTECTING RETROVIRAL DNA FROM AUTOINTEGRATION
JRNL        NATURE STRUCTURAL BIOLOGY SUBMITTED
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CNS
REMARK   3   AUTHORS     : BRUNGER, ADAMS, CLORE, DELANO, GROS, GROSSE-KUNSTLEVE,
REMARK   3                 JIANG, KUSZEWSKI, NILGES, PANNU, READ, RICE, SIMONSON, WARREN                                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS:                                           
REMARK   3  THE STRUCTURES WERE CALCULATED USING THE SIMULATED                  
REMARK   3  ANNEALING PROTOCOL OF NILGES ET AL.  (1988) FEBS LETT.              
REMARK   3  229, 129 - 136 USING THE PROGRAM XPLOR 3.1 (BRUNGER)                
REMARK   3  MODIFIED TO INCORPORATE COUPLING CONSTANT (GARRETT ET AL.           
REMARK   3  (1984) J.  MAGN RESON.  SERIES B 104, 99 - 103), CARBON             
REMARK   3  CHEMICAL SHIFT (KUSZEWSKI ET AL.  (1995) J.  MAGN.  RESON.          
REMARK   3  SERIES B 106, 92 - 96) RESTRAINTS, 1H CHEMICAL SHIFT
REMARK   3  RESTRAINTS (KUSZEWSKI ET AL. (1995) J. MAGN. RESON. SERIES B 
REMARK   3  107, 293-297; (1996) J. MAGN. RESON. SERIES B 112, 79-81),
REMARK   3  AND A CONFORMATIONAL DATABASE
REMARK   3  POTENTIAL (KUSZWESKI ET AL. (1996) PROTEIN SCI 5, 1067 - 1080
REMARK   3  AND (1997) J. MAGN. RESON. 125, 171-177)
REMARK   3                                                                      
REMARK   3  THE 3D STRUCTURE OF THE 21 KDA BAF DIMER WAS SOLVED
REMARK   3  MULTI-DIMENSIONAL HETERONUCLEAR-EDITED AND -FILTERED NMR            
REMARK   3  IS BASED ON 1655 EXPERIMENTAL RESTRAINTS (PER MONOMER):           
REMARK   3  (A) INTRASUBUNIT:  288 SEQUENTIAL (|I-J|=1), 267 MEDIUM             
REMARK   3  RANGE (1 < |I-J| >=5) AND 190 LONG RANGE (|I-J| >5)                 
REMARK   3  INTERRESIDUE, AND 7 INTRARESIDUE APPROXIMATE INTERPROTON              
REMARK   3  DISTANCE RESTRAINTS; 64 DISTANCE RESTRAINTS FOR 32                  
REMARK   3  HYDROGEN BONDS; 257 TORSION ANGLE (84 PHI, 78 PSI, 60 CHI1,          
REMARK   3  29 CHI2 AND 6 CHI3) RESTRAINTS; 66 THREE-BOND HN-HA COUPLING               
REMARK   3  CONSTANT RESTRAINTS; 165 (87 CALPHA AND 78 CBETA) 13C              
REMARK   3  SHIFT RESTRAINTS; 44 1H METHYL PROTON CHEMICAL SHIFTS;
REMARK   3  259 DIPOLAR COUPLINGS (76 N-H, 76 Calpha-C', 55 N-C'
REMARK   3  AND 52 HN-C'). 
REMARK   3  (B) 48 INTERSUBUNIT INTERPROTON DISTANCE RESTRAINTS.           
REMARK   4                                                                      
REMARK   6                                                                      
REMARK   6 THE STRUCTURE IN THIS ENTRY IS THE RESTRAINED REGULARIZED            
REMARK   6 MEAN STRUCTURE AND THE LAST NUMERIC COLUMN REPRESENTS THE RMS OF             
REMARK   6 THE 40 INDIVIDUAL SIMULATED ANNEALING STRUCTURES FOUND IN            
REMARK   6 PDB ENTRY 2EZY ABOUT THE MEAN COORDINATE POSITIONS.  THE             
REMARK   6 LAST NUMERIC COLUMN IN THE INDIVIDUAL SA STRUCTURES HAS NO MEANING.          
REMARK   6 THE LAST LETTER COLUMN SIGNIFIES THE SUBUNIT (A OR B)
REMARK   7
REMARK   7 RESIDUE 500 with ATOMS OO, X, Y AND Z REPRESENTS THE MOLECULAR
REMARK   7 ALIGNMEMENT TENSOR FOR THE DIPOLAR COUPLINGS MEASURED IN A
REMARK   7 DILUTE LIQUID CRYSTAL.
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 40C                               
REMARK 210  PH                             : 6.5
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : NULL                               
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 and 600 MHZ                               
REMARK 210  SPECTROMETER MODEL             : DMX600, DMX500
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                               
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : CNS MODIFIED
REMARK 210   METHOD USED                   : SIMULATED ANNEALING                               
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 40                               
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1  (RESTRAINED MINIMIZED MEAN IN THIS ENTRY)      
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 211 RELATED ENTRIES: 2EZY, ENSEMBLE OF 40 SIMULATED ANNEALING STRUCTURES
REMARK 211                  2EZX, RESTRAINED REGULARIZED MEAN STRUCTURE
REMARK 215                                                                      


A. Interproton distance restraints

!intrasubunit

assign (resid 10 and name HD# and segid A)(resid 10 and name HN and segid A) 4.0 2.2 1.0
assign (resid 39 and name HD# and segid A)(resid 39 and name HN and segid A) 3.0 1.2 0.5
assign (resid 43 and name HE# and segid A)(resid 43 and name HN and segid A) 4.0 2.2 3.0
assign (resid 43 and name HD# and segid A)(resid 43 and name HN and segid A) 4.0 2.2 1.0
assign (resid 59 and name HD# and segid A)(resid 59 and name HN and segid A) 4.0 2.2 1.0
assign (resid 62 and name HA and segid A)(resid 62 and name HE1 and segid A) 4.0 2.2 2.0
assign (resid 84 and name HD1 and segid A)(resid 84 and name HN and segid A) 4.0 2.2 2.0
assign (resid 10 and name HD# and segid B)(resid 10 and name HN and segid B) 4.0 2.2 1.0
assign (resid 39 and name HD# and segid B)(resid 39 and name HN and segid B) 3.0 1.2 0.5
assign (resid 43 and name HE# and segid B)(resid 43 and name HN and segid B) 4.0 2.2 3.0
assign (resid 43 and name HD# and segid B)(resid 43 and name HN and segid B) 4.0 2.2 1.0
assign (resid 59 and name HD# and segid B)(resid 59 and name HN and segid B) 4.0 2.2 1.0
assign (resid 62 and name HA and segid B)(resid 62 and name HE1 and segid B) 4.0 2.2 2.0
assign (resid 84 and name HD1 and segid B)(resid 84 and name HN and segid B) 4.0 2.2 2.0


assign (resid 2 and name HA and segid A)(resid 3 and name HN and segid A) 4.0 2.2 2.0
assign (resid 3 and name HA and segid A)(resid 4 and name HN and segid A) 4.0 2.2 2.0
assign (resid 3 and name HB and segid A)(resid 4 and name HN and segid A) 4.0 2.2 2.0
assign (resid 5 and name HB# and segid A)(resid 6 and name HN and segid A) 4.0 2.2 1.0
assign (resid 5 and name HA and segid A)(resid 6 and name HN and segid A) 4.0 2.2 1.0
assign (resid 5 and name HG# and segid A)(resid 6 and name HN and segid A) 4.0 2.2 2.0
assign (resid 6 and name HB# and segid A)(resid 7 and name HN and segid A) 3.0 1.2 0.5
assign (resid 6 and name HA and segid A)(resid 7 and name HN and segid A) 4.0 2.2 1.0
assign (resid 7 and name HD2 and segid A)(resid 8 and name HN and segid A) 4.0 2.2 2.0
assign (resid 7 and name HB# and segid A)(resid 8 and name HN and segid A) 4.0 2.2 1.0
assign (resid 7 and name HA and segid A)(resid 8 and name HN and segid A) 4.0 2.2 2.0
assign (resid 8 and name HN and segid A)(resid 9 and name HN and segid A) 4.0 2.2 1.0
assign (resid 8 and name HA and segid A)(resid 9 and name HN and segid A) 3.0 1.2 0.5
assign (resid 8 and name HB# and segid A)(resid 9 and name HN and segid A) 2.5 0.7 0.9
assign (resid 9 and name HB# and segid A)(resid 10 and name HN and segid A) 3.0 1.2 0.5
assign (resid 9 and name HN and segid A)(resid 10 and name HN and segid A) 2.5 0.7 0.4
assign (resid 9 and name HA and segid A)(resid 10 and name HN and segid A) 3.0 1.2 0.5
assign (resid 10 and name HN and segid A)(resid 11 and name HN and segid A) 2.5 0.7 0.4
assign (resid 10 and name HN and segid A)(resid 11 and name HG* and segid A) 4.0 2.2 2.5
assign (resid 10 and name HB# and segid A)(resid 11 and name HN and segid A) 3.0 1.2 0.5
assign (resid 11 and name HB# and segid A)(resid 12 and name HN and segid A) 4.0 2.2 1.0
assign (resid 11 and name HN and segid A)(resid 12 and name HN and segid A) 2.5 0.7 0.4
assign (resid 11 and name HN and segid A)(resid 12 and name HB# and segid A) 4.0 2.2 2.5
assign (resid 11 and name HA and segid A)(resid 12 and name HN and segid A) 4.0 2.2 1.0
assign (resid 12 and name HA and segid A)(resid 13 and name HN and segid A) 3.0 1.2 0.5
assign (resid 12 and name HB# and segid A)(resid 13 and name HN and segid A) 2.5 0.7 1.5
assign (resid 12 and name HN and segid A)(resid 13 and name HN and segid A) 2.5 0.7 0.4
assign (resid 14 and name HB# and segid A)(resid 15 and name HN and segid A) 4.0 2.2 1.0
assign (resid 14 and name HA and segid A)(resid 15 and name HN and segid A) 3.0 1.2 0.5
assign (resid 15 and name HN and segid A)(resid 16 and name HN and segid A) 2.5 0.7 0.4
assign (resid 15 and name HA and segid A)(resid 16 and name HN and segid A) 4.0 2.2 2.0
assign (resid 15 and name HB# and segid A)(resid 16 and name HN and segid A) 4.0 2.2 2.0
assign (resid 15 and name HG# and segid A)(resid 16 and name HN and segid A) 4.0 2.2 1.0
assign (resid 16 and name HN and segid A)(resid 17 and name HN and segid A) 4.0 2.2 2.0
assign (resid 16 and name HA# and segid A)(resid 17 and name HN and segid A) 3.0 1.2 0.5
assign (resid 17 and name HN and segid A)(resid 18 and name HN and segid A) 4.0 2.2 1.0
assign (resid 18 and name HN and segid A)(resid 19 and name HD# and segid A) 4.0 2.2 2.0
assign (resid 19 and name HA and segid A)(resid 20 and name HN and segid A) 2.5 0.7 0.4
assign (resid 19 and name HB# and segid A)(resid 20 and name HN and segid A) 3.0 1.2 0.5
assign (resid 20 and name HA and segid A)(resid 21 and name HN and segid A) 4.0 2.2 2.0
assign (resid 20 and name HB and segid A)(resid 21 and name HN and segid A) 4.0 2.2 2.0
assign (resid 20 and name HG* and segid A)(resid 21 and name HN and segid A) 2.5 0.7 1.5
assign (resid 21 and name HA# and segid A)(resid 22 and name HN and segid A) 4.0 2.2 1.0
assign (resid 21 and name HN and segid A)(resid 22 and name HN and segid A) 2.5 0.7 0.4
assign (resid 22 and name HA and segid A)(resid 23 and name HN and segid A) 3.0 1.2 0.5
assign (resid 22 and name HN and segid A)(resid 23 and name HN and segid A) 2.5 0.7 0.4
assign (resid 22 and name HB# and segid A)(resid 23 and name HN and segid A) 2.5 0.7 0.8
assign (resid 23 and name HB# and segid A)(resid 24 and name HN and segid A) 4.0 2.2 2.0
assign (resid 23 and name HA and segid A)(resid 24 and name HN and segid A) 2.5 0.7 0.4
assign (resid 23 and name HD* and segid A)(resid 24 and name HN and segid A) 4.0 2.2 1.0
assign (resid 23 and name HN and segid A)(resid 24 and name HN and segid A) 4.0 2.2 3.0
assign (resid 24 and name HN and segid A)(resid 25 and name HN and segid A) 4.0 2.2 3.0
assign (resid 24 and name HA and segid A)(resid 25 and name HN and segid A) 2.5 0.7 0.4
assign (resid 24 and name HB# and segid A)(resid 25 and name HN and segid A) 4.0 2.2 1.5
assign (resid 25 and name HN and segid A)(resid 26 and name HN and segid A) 2.5 0.7 0.4
assign (resid 25 and name HA# and segid A)(resid 26 and name HN and segid A) 4.0 2.2 2.0
assign (resid 26 and name HN and segid A)(resid 27 and name HN and segid A) 4.0 2.2 2.0
assign (resid 26 and name HA and segid A)(resid 27 and name HN and segid A) 2.5 0.7 0.4
assign (resid 26 and name HG2# and segid A)(resid 27 and name HN and segid A) 2.5 0.7 1.5
assign (resid 26 and name HD# and segid A)(resid 27 and name HN and segid A) 2.5 0.7 1.5
assign (resid 27 and name HA# and segid A)(resid 28 and name HN and segid A) 4.0 2.2 2.0
assign (resid 28 and name HB# and segid A)(resid 29 and name HN and segid A) 3.0 1.2 0.5
assign (resid 29 and name HG* and segid A)(resid 30 and name HN and segid A) 4.0 2.2 1.5
assign (resid 29 and name HB and segid A)(resid 30 and name HN and segid A) 2.5 0.7 0.4
assign (resid 29 and name HA and segid A)(resid 30 and name HN and segid A) 3.0 1.2 0.5
assign (resid 29 and name HN and segid A)(resid 30 and name HN and segid A) 2.5 0.7 0.4
assign (resid 30 and name HN and segid A)(resid 31 and name HN and segid A) 2.5 0.7 0.4
assign (resid 30 and name HB# and segid A)(resid 31 and name HN and segid A) 4.0 2.2 1.0
assign (resid 30 and name HD* and segid A)(resid 31 and name HN and segid A) 4.0 2.2 2.5
assign (resid 31 and name HN and segid A)(resid 32 and name HN and segid A) 2.5 0.7 0.4
assign (resid 31 and name HA# and segid A)(resid 32 and name HN and segid A) 3.0 1.2 0.5
assign (resid 32 and name HN and segid A)(resid 33 and name HN and segid A) 2.5 0.7 0.4
assign (resid 32 and name HB# and segid A)(resid 33 and name HN and segid A) 3.0 1.2 0.5
assign (resid 32 and name HG# and segid A)(resid 33 and name HN and segid A) 4.0 2.2 2.0
assign (resid 33 and name HN and segid A)(resid 34 and name HN and segid A) 2.5 0.7 0.4
assign (resid 33 and name HB# and segid A)(resid 34 and name HN and segid A) 2.5 0.7 0.4
assign (resid 34 and name HB# and segid A)(resid 35 and name HN and segid A) 2.5 0.7 0.4
assign (resid 34 and name HA and segid A)(resid 35 and name HN and segid A) 3.0 1.2 0.5
assign (resid 34 and name HN and segid A)(resid 35 and name HN and segid A) 2.5 0.7 0.4
assign (resid 34 and name HD# and segid A)(resid 35 and name HN and segid A) 4.0 2.2 1.5
assign (resid 34 and name HG and segid A)(resid 35 and name HN and segid A) 4.0 2.2 2.0
assign (resid 35 and name HN and segid A)(resid 36 and name HN and segid A) 2.5 0.7 0.4
assign (resid 36 and name HN and segid A)(resid 37 and name HN and segid A) 2.5 0.7 0.4
assign (resid 36 and name HB# and segid A)(resid 37 and name HN and segid A) 3.0 1.2 0.5
assign (resid 36 and name HA and segid A)(resid 37 and name HN and segid A) 3.0 1.2 0.5
assign (resid 37 and name HN and segid A)(resid 38 and name HA# and segid A) 4.0 2.2 2.0
assign (resid 37 and name HN and segid A)(resid 38 and name HN and segid A) 2.5 0.7 0.4
assign (resid 37 and name HA and segid A)(resid 38 and name HN and segid A) 3.0 1.2 0.5
assign (resid 37 and name HB# and segid A)(resid 38 and name HN and segid A) 4.0 2.2 1.0
assign (resid 38 and name HA# and segid A)(resid 39 and name HN and segid A) 3.0 1.2 0.5
assign (resid 38 and name HN and segid A)(resid 39 and name HN and segid A) 2.5 0.7 0.4
assign (resid 39 and name HB# and segid A)(resid 40 and name HN and segid A) 4.0 2.2 1.0
assign (resid 39 and name HN and segid A)(resid 40 and name HN and segid A) 4.0 2.2 1.0
assign (resid 39 and name HA and segid A)(resid 40 and name HN and segid A) 2.5 0.7 0.4
assign (resid 40 and name HN and segid A)(resid 41 and name HN and segid A) 2.5 0.7 0.4
assign (resid 40 and name HA and segid A)(resid 41 and name HN and segid A) 4.0 2.2 1.0
assign (resid 41 and name HN and segid A)(resid 42 and name HN and segid A) 4.0 2.2 2.0
assign (resid 41 and name HB# and segid A)(resid 42 and name HN and segid A) 3.0 1.2 0.5
assign (resid 41 and name HA and segid A)(resid 42 and name HN and segid A) 2.5 0.7 0.4
assign (resid 42 and name HN and segid A)(resid 43 and name HN and segid A) 3.0 1.2 0.5
assign (resid 42 and name HA and segid A)(resid 43 and name HN and segid A) 4.0 2.2 2.0
assign (resid 42 and name HB# and segid A)(resid 43 and name HN and segid A) 2.5 0.7 1.5
assign (resid 43 and name HN and segid A)(resid 44 and name HN and segid A) 4.0 2.2 1.0
assign (resid 43 and name HD# and segid A)(resid 44 and name HN and segid A) 4.0 2.2 2.0
assign (resid 43 and name HN and segid A)(resid 44 and name HG* and segid A) 4.0 2.2 2.5
assign (resid 44 and name HN and segid A)(resid 45 and name HN and segid A) 2.5 0.7 0.4
assign (resid 44 and name HN and segid A)(resid 45 and name HB and segid A) 4.0 2.2 2.0
assign (resid 44 and name HA and segid A)(resid 45 and name HN and segid A) 4.0 2.2 2.0
assign (resid 44 and name HB and segid A)(resid 45 and name HN and segid A) 3.0 1.2 0.5
assign (resid 44 and name HG* and segid A)(resid 45 and name HN and segid A) 4.0 2.2 1.5
assign (resid 45 and name HN and segid A)(resid 46 and name HN and segid A) 2.5 0.7 0.4
assign (resid 46 and name HB# and segid A)(resid 47 and name HN and segid A) 2.5 0.7 0.4
assign (resid 46 and name HN and segid A)(resid 47 and name HN and segid A) 2.5 0.7 0.4
assign (resid 46 and name HD* and segid A)(resid 47 and name HN and segid A) 4.0 2.2 2.5
assign (resid 47 and name HN and segid A)(resid 48 and name HN and segid A) 2.5 0.7 0.4
assign (resid 48 and name HN and segid A)(resid 49 and name HN and segid A) 2.5 0.7 0.4
assign (resid 49 and name HN and segid A)(resid 50 and name HN and segid A) 2.5 0.7 0.4
assign (resid 49 and name HB# and segid A)(resid 50 and name HN and segid A) 4.0 2.2 1.0
assign (resid 49 and name HD# and segid A)(resid 50 and name HN and segid A) 4.0 2.2 1.0
assign (resid 50 and name HB# and segid A)(resid 51 and name HN and segid A) 3.0 1.2 0.5
assign (resid 50 and name HN and segid A)(resid 51 and name HN and segid A) 2.5 0.7 0.4
assign (resid 50 and name HD* and segid A)(resid 51 and name HN and segid A) 4.0 2.2 2.5
assign (resid 50 and name HA and segid A)(resid 51 and name HN and segid A) 3.0 1.2 0.5
assign (resid 51 and name HN and segid A)(resid 52 and name HN and segid A) 2.5 0.7 0.4
assign (resid 51 and name HG* and segid A)(resid 52 and name HN and segid A) 2.5 0.7 1.5
assign (resid 51 and name HB and segid A)(resid 52 and name HN and segid A) 3.0 1.2 0.5
assign (resid 52 and name HN and segid A)(resid 53 and name HN and segid A) 2.5 0.7 0.4
assign (resid 52 and name HA and segid A)(resid 53 and name HN and segid A) 3.0 1.2 0.5
assign (resid 52 and name HD* and segid A)(resid 53 and name HN and segid A) 4.0 2.2 2.5
assign (resid 53 and name HA and segid A)(resid 54 and name HN and segid A) 3.0 1.2 0.5
assign (resid 54 and name HN and segid A)(resid 55 and name HN and segid A) 2.5 0.7 0.4
assign (resid 55 and name HA and segid A)(resid 56 and name HN and segid A) 2.5 0.7 0.4
assign (resid 55 and name HB1 and segid A)(resid 56 and name HN and segid A) 4.0 2.2 1.0
assign (resid 55 and name HB2 and segid A)(resid 56 and name HN and segid A) 4.0 2.2 1.0
assign (resid 55 and name HN and segid A)(resid 56 and name HN and segid A) 4.0 2.2 2.0
assign (resid 56 and name HN and segid A)(resid 57 and name HN and segid A) 2.5 0.7 0.4
assign (resid 56 and name HB# and segid A)(resid 57 and name HN and segid A) 3.0 1.2 0.5
assign (resid 56 and name HA and segid A)(resid 57 and name HN and segid A) 4.0 2.2 1.0
assign (resid 56 and name HG# and segid A)(resid 57 and name HN and segid A) 4.0 2.2 2.0
assign (resid 57 and name HA and segid A)(resid 58 and name HN and segid A) 3.0 1.2 0.5
assign (resid 57 and name HN and segid A)(resid 58 and name HN and segid A) 2.5 0.7 0.4
assign (resid 57 and name HB# and segid A)(resid 58 and name HN and segid A) 3.0 1.2 0.5
assign (resid 57 and name HN and segid A)(resid 58 and name HG and segid A) 4.0 2.2 2.0
assign (resid 58 and name HB# and segid A)(resid 59 and name HN and segid A) 3.0 1.2 0.5
assign (resid 58 and name HN and segid A)(resid 59 and name HN and segid A) 2.5 0.7 0.4
assign (resid 59 and name HN and segid A)(resid 60 and name HN and segid A) 2.5 0.7 0.4
assign (resid 59 and name HB# and segid A)(resid 60 and name HN and segid A) 3.0 1.2 0.5
assign (resid 60 and name HN and segid A)(resid 61 and name HN and segid A) 2.5 0.7 0.4
assign (resid 60 and name HA and segid A)(resid 61 and name HN and segid A) 4.0 2.2 1.0
assign (resid 61 and name HN and segid A)(resid 62 and name HN and segid A) 2.5 0.7 0.4
assign (resid 61 and name HG# and segid A)(resid 62 and name HN and segid A) 4.0 2.2 1.0
assign (resid 61 and name HB# and segid A)(resid 62 and name HN and segid A) 2.5 0.7 0.4
assign (resid 61 and name HA and segid A)(resid 62 and name HN and segid A) 3.0 1.2 0.5
assign (resid 61 and name HN and segid A)(resid 62 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 62 and name HE3 and segid A)(resid 63 and name HN and segid A) 3.0 1.2 0.5
assign (resid 62 and name HA and segid A)(resid 63 and name HN and segid A) 3.0 1.2 0.5
assign (resid 62 and name HN and segid A)(resid 63 and name HN and segid A) 2.5 0.7 0.4
assign (resid 62 and name HB# and segid A)(resid 63 and name HN and segid A) 3.0 1.2 0.5
assign (resid 63 and name HN and segid A)(resid 64 and name HN and segid A) 2.5 0.7 0.5
assign (resid 63 and name HN and segid A)(resid 64 and name HA and segid A) 4.0 2.2 2.0
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assign (resid 63 and name HB# and segid A)(resid 64 and name HN and segid A) 2.5 0.7 0.4
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assign (resid 64 and name HG# and segid A)(resid 65 and name HN and segid A) 4.0 2.2 1.0
assign (resid 64 and name HB# and segid A)(resid 65 and name HN and segid A) 2.5 0.7 0.4
assign (resid 64 and name HA and segid A)(resid 65 and name HN and segid A) 3.0 1.2 0.5
assign (resid 65 and name HN and segid A)(resid 66 and name HN and segid A) 2.5 0.7 0.4
assign (resid 65 and name HB# and segid A)(resid 66 and name HN and segid A) 3.0 1.2 0.5
assign (resid 65 and name HA and segid A)(resid 66 and name HN and segid A) 3.0 1.2 0.5
assign (resid 66 and name HG2# and segid A)(resid 67 and name HN and segid A) 2.5 0.7 1.5
assign (resid 66 and name HA and segid A)(resid 67 and name HN and segid A) 4.0 2.2 1.0
assign (resid 66 and name HB and segid A)(resid 67 and name HN and segid A) 3.0 1.2 0.5
assign (resid 67 and name HB# and segid A)(resid 68 and name HN and segid A) 3.0 1.2 0.5
assign (resid 68 and name HN and segid A)(resid 69 and name HN and segid A) 2.5 0.7 0.4
assign (resid 69 and name HN and segid A)(resid 70 and name HN and segid A) 4.0 2.2 2.0
assign (resid 69 and name HB# and segid A)(resid 70 and name HN and segid A) 2.5 0.7 1.5
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assign (resid 72 and name HN and segid A)(resid 73 and name HN and segid A) 2.5 0.7 0.4
assign (resid 72 and name HG# and segid A)(resid 73 and name HN and segid A) 4.0 2.2 1.0
assign (resid 72 and name HB# and segid A)(resid 73 and name HN and segid A) 3.0 1.2 0.5
assign (resid 72 and name HA and segid A)(resid 73 and name HN and segid A) 4.0 2.2 1.0
assign (resid 73 and name HN and segid A)(resid 74 and name HN and segid A) 2.5 0.7 0.4
assign (resid 73 and name HB# and segid A)(resid 74 and name HN and segid A) 3.0 1.2 0.5
assign (resid 74 and name HB# and segid A)(resid 75 and name HN and segid A) 4.0 2.2 2.0
assign (resid 74 and name HN and segid A)(resid 75 and name HN and segid A) 2.5 0.7 0.4
assign (resid 75 and name HN and segid A)(resid 76 and name HN and segid A) 2.5 0.7 0.4
assign (resid 75 and name HB# and segid A)(resid 76 and name HN and segid A) 2.5 0.7 0.4
assign (resid 75 and name HG# and segid A)(resid 76 and name HN and segid A) 4.0 2.2 2.0
assign (resid 76 and name HB# and segid A)(resid 77 and name HN and segid A) 3.0 1.2 0.5
assign (resid 76 and name HN and segid A)(resid 77 and name HN and segid A) 3.0 1.2 0.5
assign (resid 77 and name HN and segid A)(resid 78 and name HN and segid A) 2.5 0.7 0.4
assign (resid 77 and name HB# and segid A)(resid 78 and name HN and segid A) 4.0 2.2 1.0
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assign (resid 78 and name HD# and segid A)(resid 79 and name HN and segid A) 3.0 1.2 0.5
assign (resid 78 and name HB# and segid A)(resid 79 and name HN and segid A) 4.0 2.2 2.0
assign (resid 79 and name HA# and segid A)(resid 80 and name HN and segid A) 3.0 1.2 0.5
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assign (resid 80 and name HN and segid A)(resid 81 and name HN and segid A) 2.5 0.7 0.4
assign (resid 80 and name HB# and segid A)(resid 81 and name HN and segid A) 3.0 1.2 0.5
assign (resid 80 and name HA and segid A)(resid 81 and name HN and segid A) 4.0 2.2 2.0
assign (resid 81 and name HN and segid A)(resid 82 and name HN and segid A) 2.5 0.7 0.4
assign (resid 81 and name HG and segid A)(resid 82 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 82 and name HB# and segid A)(resid 83 and name HN and segid A) 2.5 0.7 0.4
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assign (resid 84 and name HB# and segid A)(resid 85 and name HN and segid A) 3.0 1.2 0.5
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assign (resid 85 and name HB# and segid A)(resid 86 and name HN and segid A) 3.0 1.2 0.5
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assign (resid 87 and name HN and segid A)(resid 88 and name HD# and segid A) 4.0 2.2 2.0
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assign (resid 87 and name HB# and segid A)(resid 88 and name HN and segid A) 2.5 0.7 0.9
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assign (resid 88 and name HB# and segid A)(resid 89 and name HN and segid A) 4.0 2.2 1.0
assign (resid 88 and name HA and segid A)(resid 89 and name HN and segid A) 4.0 2.2 1.0
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assign (resid 3 and name HA and segid B)(resid 4 and name HN and segid B) 4.0 2.2 2.0
assign (resid 3 and name HB and segid B)(resid 4 and name HN and segid B) 4.0 2.2 2.0
assign (resid 5 and name HB# and segid B)(resid 6 and name HN and segid B) 4.0 2.2 1.0
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assign (resid 7 and name HB# and segid B)(resid 8 and name HN and segid B) 4.0 2.2 1.0
assign (resid 7 and name HA and segid B)(resid 8 and name HN and segid B) 4.0 2.2 2.0
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assign (resid 8 and name HA and segid B)(resid 9 and name HN and segid B) 3.0 1.2 0.5
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assign (resid 12 and name HB# and segid B)(resid 13 and name HN and segid B) 2.5 0.7 1.5
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assign (resid 24 and name HA and segid B)(resid 25 and name HN and segid B) 2.5 0.7 0.4
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assign (resid 25 and name HA# and segid B)(resid 26 and name HN and segid B) 4.0 2.2 2.0
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assign (resid 27 and name HA# and segid B)(resid 28 and name HN and segid B) 4.0 2.2 2.0
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assign (resid 30 and name HB# and segid B)(resid 31 and name HN and segid B) 4.0 2.2 1.0
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assign (resid 72 and name HB# and segid B)(resid 73 and name HN and segid B) 3.0 1.2 0.5
assign (resid 72 and name HA and segid B)(resid 73 and name HN and segid B) 4.0 2.2 1.0
assign (resid 73 and name HN and segid B)(resid 74 and name HN and segid B) 2.5 0.7 0.4
assign (resid 73 and name HB# and segid B)(resid 74 and name HN and segid B) 3.0 1.2 0.5
assign (resid 74 and name HB# and segid B)(resid 75 and name HN and segid B) 4.0 2.2 2.0
assign (resid 74 and name HN and segid B)(resid 75 and name HN and segid B) 2.5 0.7 0.4
assign (resid 75 and name HN and segid B)(resid 76 and name HN and segid B) 2.5 0.7 0.4
assign (resid 75 and name HB# and segid B)(resid 76 and name HN and segid B) 2.5 0.7 0.4
assign (resid 75 and name HG# and segid B)(resid 76 and name HN and segid B) 4.0 2.2 2.0
assign (resid 76 and name HB# and segid B)(resid 77 and name HN and segid B) 3.0 1.2 0.5
assign (resid 76 and name HN and segid B)(resid 77 and name HN and segid B) 3.0 1.2 0.5
assign (resid 77 and name HN and segid B)(resid 78 and name HN and segid B) 2.5 0.7 0.4
assign (resid 77 and name HB# and segid B)(resid 78 and name HN and segid B) 4.0 2.2 1.0
assign (resid 78 and name HN and segid B)(resid 79 and name HN and segid B) 2.5 0.7 0.4
assign (resid 78 and name HD# and segid B)(resid 79 and name HN and segid B) 3.0 1.2 0.5
assign (resid 78 and name HB# and segid B)(resid 79 and name HN and segid B) 4.0 2.2 2.0
assign (resid 79 and name HA# and segid B)(resid 80 and name HN and segid B) 3.0 1.2 0.5
assign (resid 79 and name HN and segid B)(resid 80 and name HN and segid B) 2.5 0.7 0.4
assign (resid 80 and name HN and segid B)(resid 81 and name HN and segid B) 2.5 0.7 0.4
assign (resid 80 and name HB# and segid B)(resid 81 and name HN and segid B) 3.0 1.2 0.5
assign (resid 80 and name HA and segid B)(resid 81 and name HN and segid B) 4.0 2.2 2.0
assign (resid 81 and name HN and segid B)(resid 82 and name HN and segid B) 2.5 0.7 0.4
assign (resid 81 and name HG and segid B)(resid 82 and name HN and segid B) 4.0 2.2 2.0
assign (resid 81 and name HB# and segid B)(resid 82 and name HN and segid B) 3.0 1.2 0.5
assign (resid 82 and name HN and segid B)(resid 83 and name HN and segid B) 3.0 1.2 0.5
assign (resid 82 and name HA and segid B)(resid 83 and name HN and segid B) 3.0 1.2 0.5
assign (resid 82 and name HB# and segid B)(resid 83 and name HN and segid B) 2.5 0.7 0.4
assign (resid 83 and name HB# and segid B)(resid 84 and name HN and segid B) 3.0 1.2 0.5
assign (resid 83 and name HN and segid B)(resid 84 and name HN and segid B) 2.5 0.7 0.4
assign (resid 84 and name HN and segid B)(resid 85 and name HN and segid B) 2.5 0.7 0.4
assign (resid 84 and name HB# and segid B)(resid 85 and name HN and segid B) 3.0 1.2 0.5
assign (resid 84 and name HE3 and segid B)(resid 85 and name HN and segid B) 4.0 2.2 1.0
assign (resid 85 and name HN and segid B)(resid 86 and name HN and segid B) 2.5 0.7 0.4
assign (resid 85 and name HB# and segid B)(resid 86 and name HN and segid B) 3.0 1.2 0.5
assign (resid 86 and name HB# and segid B)(resid 87 and name HN and segid B) 3.0 1.2 0.5
assign (resid 86 and name HN and segid B)(resid 87 and name HN and segid B) 2.5 0.7 0.4
assign (resid 87 and name HN and segid B)(resid 88 and name HN and segid B) 2.5 0.7 0.4
assign (resid 87 and name HN and segid B)(resid 88 and name HD# and segid B) 4.0 2.2 2.0
assign (resid 87 and name HA and segid B)(resid 88 and name HN and segid B) 3.0 1.2 0.5
assign (resid 87 and name HB# and segid B)(resid 88 and name HN and segid B) 2.5 0.7 0.9
assign (resid 88 and name HN and segid B)(resid 89 and name HN and segid B) 2.5 0.7 0.4
assign (resid 88 and name HB# and segid B)(resid 89 and name HN and segid B) 4.0 2.2 1.0
assign (resid 88 and name HA and segid B)(resid 89 and name HN and segid B) 4.0 2.2 1.0
assign (resid 3 and name HG# and segid A)(resid 4 and name HA and segid A) 4.0 2.2 2.0
assign (resid 4 and name HA and segid A)(resid 5 and name HB# and segid A) 4.0 2.2 2.0
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assign (resid 7 and name HD2 and segid A)(resid 8 and name HG# and segid A) 4.0 2.2 2.0
assign (resid 10 and name HA and segid A)(resid 11 and name HA and segid A) 4.0 2.2 2.0
assign (resid 10 and name HD# and segid A)(resid 11 and name HA and segid A) 4.0 2.2 2.0
assign (resid 10 and name HD# and segid A)(resid 11 and name HG# and segid A) 4.0 2.2 1.5
assign (resid 11 and name HG* and segid A)(resid 12 and name HB# and segid A) 2.5 0.7 1.8
assign (resid 11 and name HG* and segid A)(resid 12 and name HA and segid A) 4.0 2.2 1.5
assign (resid 13 and name HA and segid A)(resid 14 and name HD# and segid A) 2.5 0.7 0.2
assign (resid 18 and name HA and segid A)(resid 19 and name HD# and segid A) 2.5 0.7 0.2
assign (resid 18 and name HA and segid A)(resid 19 and name HG# and segid A) 4.0 2.2 1.0
assign (resid 19 and name HA and segid A)(resid 20 and name HG# and segid A) 4.0 2.2 1.5
assign (resid 20 and name HG# and segid A)(resid 21 and name HA# and segid A) 4.0 2.2 2.0
assign (resid 23 and name HD* and segid A)(resid 24 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 23 and name HA and segid A)(resid 24 and name HB# and segid A) 4.0 2.2 1.5
assign (resid 24 and name HA and segid A)(resid 25 and name HA# and segid A) 4.0 2.2 1.0
assign (resid 24 and name HB# and segid A)(resid 25 and name HA# and segid A) 4.0 2.2 2.5
assign (resid 26 and name HA and segid A)(resid 27 and name HA# and segid A) 4.0 2.2 2.0
assign (resid 26 and name HB# and segid A)(resid 27 and name HA# and segid A) 4.0 2.2 2.0
assign (resid 26 and name HG2# and segid A)(resid 27 and name HA# and segid A) 4.0 2.2 2.5
assign (resid 28 and name HA and segid A)(resid 29 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 28 and name HB# and segid A)(resid 29 and name HG# and segid A) 3.0 1.2 0.8
assign (resid 28 and name HG# and segid A)(resid 29 and name HG# and segid A) 4.0 2.2 2.5
assign (resid 29 and name HB# and segid A)(resid 30 and name HG and segid A) 4.0 2.2 2.0
assign (resid 29 and name HB# and segid A)(resid 30 and name HD# and segid A) 3.0 1.2 0.8
assign (resid 30 and name HD* and segid A)(resid 31 and name HA# and segid A) 4.0 2.2 1.5
assign (resid 34 and name HB* and segid A)(resid 35 and name HG# and segid A) 4.0 2.2 3.0
assign (resid 38 and name HA# and segid A)(resid 39 and name HD# and segid A) 4.0 2.2 2.0
assign (resid 40 and name HA and segid A)(resid 41 and name Hg# and segid A) 4.0 2.2 2.5
assign (resid 41 and name HA and segid A)(resid 42 and name HB# and segid A) 4.0 2.2 1.5
assign (resid 41 and name HB# and segid A)(resid 42 and name HB# and segid A) 4.0 2.2 1.5
assign (resid 42 and name HB# and segid A)(resid 43 and name HA and segid A) 4.0 2.2 2.5
assign (resid 43 and name HE# and segid A)(resid 44 and name HG# and segid A) 3.0 1.2 0.8
assign (resid 43 and name HD# and segid A)(resid 44 and name HG# and segid A) 4.0 2.2 1.5
assign (resid 43 and name HD# and segid A)(resid 44 and name HA and segid A) 4.0 2.2 2.5
assign (resid 44 and name HB and segid A)(resid 45 and name HA and segid A) 4.0 2.2 1.0
assign (resid 45 and name HG* and segid A)(resid 46 and name HA and segid A) 4.0 2.2 1.5
assign (resid 45 and name HG* and segid A)(resid 46 and name HB# and segid A) 4.0 2.2 1.5
assign (resid 46 and name HG and segid A)(resid 47 and name HA* and segid A) 4.0 2.2 2.0
assign (resid 48 and name HA and segid A)(resid 49 and name HA and segid A) 4.0 2.2 1.0
assign (resid 49 and name HD# and segid A)(resid 50 and name HD* and segid A) 3.0 1.2 0.8
assign (resid 55 and name HA and segid A)(resid 56 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 61 and name HB# and segid A)(resid 62 and name HA and segid A) 4.0 2.2 1.0
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assign (resid 62 and name HZ3 and segid A)(resid 63 and name HD* and segid A) 4.0 2.2 1.5
assign (resid 62 and name HE3 and segid A)(resid 63 and name HA and segid A) 4.0 2.2 1.5
assign (resid 62 and name HE3 and segid A)(resid 63 and name HG and segid A) 4.0 2.2 1.0
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assign (resid 65 and name HB# and segid A)(resid 66 and name HA and segid A) 4.0 2.2 2.0
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assign (resid 71 and name HB# and segid A)(resid 72 and name HA and segid A) 3.0 1.2 0.8
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assign (resid 86 and name HB# and segid A)(resid 87 and name HB# and segid A) 4.0 2.2 1.5
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assign (resid 87 and name HB# and segid A)(resid 88 and name HA and segid A) 4.0 2.2 1.5
assign (resid 87 and name HB# and segid A)(resid 88 and name HB# and segid A) 4.0 2.2 1.5
assign (resid 87 and name HB# and segid A)(resid 88 and name HD# and segid A) 2.5 0.7 0.7
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assign (resid 87 and name HB# and segid A)(resid 88 and name HZ and segid A) 4.0 2.2 2.5
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assign (resid 10 and name HD# and segid B)(resid 11 and name HG# and segid B) 4.0 2.2 1.5
assign (resid 11 and name HG* and segid B)(resid 12 and name HB# and segid B) 2.5 0.7 1.8
assign (resid 11 and name HG* and segid B)(resid 12 and name HA and segid B) 4.0 2.2 1.5
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assign (resid 18 and name HA and segid B)(resid 19 and name HG# and segid B) 4.0 2.2 1.0
assign (resid 19 and name HA and segid B)(resid 20 and name HG# and segid B) 4.0 2.2 1.5
assign (resid 20 and name HG# and segid B)(resid 21 and name HA# and segid B) 4.0 2.2 2.0
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assign (resid 24 and name HA and segid B)(resid 25 and name HA# and segid B) 4.0 2.2 1.0
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assign (resid 30 and name HD* and segid B)(resid 31 and name HA# and segid B) 4.0 2.2 1.5
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assign (resid 45 and name HG* and segid B)(resid 46 and name HB# and segid B) 4.0 2.2 1.5
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assign (resid 49 and name HD# and segid B)(resid 50 and name HD* and segid B) 3.0 1.2 0.8
assign (resid 55 and name HA and segid B)(resid 56 and name HB# and segid B) 4.0 2.2 2.0
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assign (resid 62 and name HZ3 and segid B)(resid 63 and name HD* and segid B) 4.0 2.2 1.5
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assign (resid 65 and name HB# and segid B)(resid 66 and name HA and segid B) 4.0 2.2 2.0
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assign (resid 71 and name HB# and segid B)(resid 72 and name HA and segid B) 3.0 1.2 0.8
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assign (resid 87 and name HB# and segid B)(resid 88 and name HA and segid B) 4.0 2.2 1.5
assign (resid 87 and name HB# and segid B)(resid 88 and name HB# and segid B) 4.0 2.2 1.5
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assign (resid 87 and name HB# and segid B)(resid 88 and name HE# and segid B) 3.0 1.2 0.8
assign (resid 87 and name HB# and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 2.5


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assign (resid 8 and name HA and segid A)(resid 11 and name HN and segid A) 3.0 1.2 0.5
assign (resid 9 and name HN and segid A)(resid 11 and name HG# and segid A) 4.0 2.2 2.5
assign (resid 9 and name HA and segid A)(resid 12 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 35 and name HA and segid A)(resid 37 and name HN and segid A) 4.0 2.2 2.0
assign (resid 35 and name HN and segid A)(resid 37 and name HN and segid A) 4.0 2.2 1.0
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assign (resid 35 and name HA and segid A)(resid 38 and name HN and segid A) 3.0 1.2 0.5
assign (resid 35 and name HA and segid A)(resid 39 and name HN and segid A) 3.0 1.2 0.5
assign (resid 35 and name HN and segid A)(resid 40 and name HA and segid A) 4.0 2.2 2.0
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assign (resid 36 and name HN and segid A)(resid 38 and name HN and segid A) 4.0 2.2 1.0
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assign (resid 42 and name HA and segid A)(resid 45 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 45 and name HN and segid A)(resid 47 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 46 and name HB# and segid A)(resid 48 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 46 and name HA and segid A)(resid 49 and name HN and segid A) 3.0 1.2 0.5
assign (resid 47 and name HA# and segid A)(resid 50 and name HN and segid A) 4.0 2.2 1.0
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assign (resid 48 and name HA and segid A)(resid 51 and name HN and segid A) 3.0 1.2 0.5
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assign (resid 51 and name HN and segid A)(resid 53 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 55 and name HA and segid A)(resid 57 and name HN and segid A) 4.0 2.2 1.0
assign (resid 55 and name HB# and segid A)(resid 58 and name HN and segid A) 4.0 2.2 1.0
assign (resid 56 and name HA and segid A)(resid 59 and name HN and segid A) 4.0 2.2 1.0
assign (resid 57 and name HA and segid A)(resid 60 and name HN and segid A) 3.0 1.2 0.5
assign (resid 58 and name HN and segid A)(resid 60 and name HN and segid A) 4.0 2.2 1.0
assign (resid 58 and name HA and segid A)(resid 61 and name HN and segid A) 3.0 1.2 0.5
assign (resid 59 and name HA and segid A)(resid 61 and name HN and segid A) 4.0 2.2 1.0
assign (resid 59 and name HA and segid A)(resid 62 and name HN and segid A) 3.0 1.2 0.5
assign (resid 59 and name HA and segid A)(resid 63 and name HN and segid A) 4.0 2.2 2.0
assign (resid 60 and name HN and segid A)(resid 62 and name HN and segid A) 4.0 2.2 1.0
assign (resid 60 and name HA and segid A)(resid 63 and name HN and segid A) 4.0 2.2 1.0
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assign (resid 64 and name HA and segid A)(resid 66 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 83 and name HA and segid A)(resid 85 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 32 and name HA and segid A)(resid 35 and name HB# and segid A) 3.0 1.2 0.3
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assign (resid 32 and name HB# and segid A)(resid 35 and name HG# and segid A) 4.0 2.2 2.0
assign (resid 33 and name HA and segid A)(resid 36 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 34 and name HD* and segid A)(resid 37 and name HD# and segid A) 4.0 2.2 1.5
assign (resid 34 and name HA and segid A)(resid 39 and name HB# and segid A) 4.0 2.2 2.5
assign (resid 34 and name HB* and segid A)(resid 39 and name HB# and segid A) 4.0 2.2 2.5
assign (resid 34 and name HB* and segid A)(resid 39 and name HD# and segid A) 3.0 1.2 0.3
assign (resid 34 and name HB* and segid A)(resid 39 and name HE# and segid A) 4.0 2.2 1.0
assign (resid 34 and name HD* and segid A)(resid 39 and name HB# and segid A) 3.0 1.2 0.8
assign (resid 34 and name HD* and segid A)(resid 39 and name HD# and segid A) 4.0 2.2 1.5
assign (resid 34 and name HD* and segid A)(resid 39 and name HE# and segid A) 4.0 2.2 1.5
assign (resid 35 and name HA and segid A)(resid 40 and name HA and segid A) 3.0 1.2 0.3
assign (resid 35 and name HB# and segid A)(resid 40 and name HA and segid A) 3.0 1.2 0.3
assign (resid 35 and name HG# and segid A)(resid 40 and name HA and segid A) 3.0 1.2 0.3
assign (resid 35 and name HG# and segid A)(resid 40 and name HB# and segid A) 4.0 2.2 1.0
assign (resid 37 and name HB# and segid A)(resid 39 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 37 and name HB# and segid A)(resid 39 and name HD# and segid A) 4.0 2.2 1.0
assign (resid 37 and name HB# and segid A)(resid 39 and name HE# and segid A) 4.0 2.2 1.0
assign (resid 37 and name HG# and segid A)(resid 39 and name HD# and segid A) 4.0 2.2 1.0
assign (resid 37 and name HG# and segid A)(resid 39 and name HE# and segid A) 4.0 2.2 2.0
assign (resid 39 and name HA and segid A)(resid 44 and name HB and segid A) 3.0 1.2 0.3
assign (resid 39 and name HD# and segid A)(resid 44 and name HG* and segid A) 2.5 0.7 0.7
assign (resid 39 and name HE# and segid A)(resid 44 and name HG* and segid A) 3.0 1.2 0.8
assign (resid 39 and name HA and segid A)(resid 44 and name HG* and segid A) 2.5 0.7 0.7
assign (resid 39 and name HB# and segid A)(resid 44 and name HG* and segid A) 3.0 1.2 0.8
assign (resid 39 and name HB# and segid A)(resid 44 and name HB and segid A) 4.0 2.2 1.0
assign (resid 41 and name HB# and segid A)(resid 44 and name HG# and segid A) 3.0 1.2 0.8
assign (resid 42 and name HA and segid A)(resid 44 and name HB and segid A) 4.0 2.2 2.0
assign (resid 42 and name HA and segid A)(resid 45 and name HB and segid A) 4.0 2.2 2.0
assign (resid 42 and name HA and segid A)(resid 45 and name HG# and segid A) 3.0 1.2 0.8
assign (resid 42 and name HB# and segid A)(resid 45 and name HG# and segid A) 4.0 2.2 2.5
assign (resid 43 and name HA and segid A)(resid 46 and name HD* and segid A) 3.0 1.2 0.8
assign (resid 43 and name HA and segid A)(resid 46 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 44 and name HA and segid A)(resid 47 and name HA# and segid A) 4.0 2.2 2.0
assign (resid 45 and name HG* and segid A)(resid 48 and name HA and segid A) 4.0 2.2 2.5
assign (resid 45 and name HA and segid A)(resid 48 and name HB# and segid A) 4.0 2.2 1.0
assign (resid 46 and name HD* and segid A)(resid 49 and name HE* and segid A) 2.5 0.7 1.8
assign (resid 46 and name HD* and segid A)(resid 49 and name HD* and segid A) 2.5 0.7 1.8
assign (resid 47 and name HA# and segid A)(resid 50 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 47 and name HA# and segid A)(resid 51 and name HG# and segid A) 4.0 2.2 1.5
assign (resid 48 and name HA and segid A)(resid 51 and name HA and segid A) 4.0 2.2 2.0
assign (resid 48 and name HA and segid A)(resid 51 and name HB# and segid A) 2.5 0.7 0.2
assign (resid 48 and name HA and segid A)(resid 51 and name HG# and segid A) 3.0 1.2 0.8
assign (resid 49 and name HA and segid A)(resid 52 and name HD* and segid A) 4.0 2.2 2.5
assign (resid 49 and name HD# and segid A)(resid 52 and name HD* and segid A) 4.0 2.2 2.5
assign (resid 49 and name HZ and segid A)(resid 54 and name HD# and segid A) 4.0 2.2 2.0
assign (resid 49 and name HZ and segid A)(resid 54 and name HA and segid A) 4.0 2.2 2.0
assign (resid 49 and name HZ and segid A)(resid 54 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 49 and name HE# and segid A)(resid 54 and name HA and segid A) 4.0 2.2 2.0
assign (resid 55 and name HB# and segid A)(resid 58 and name HD* and segid A) 3.0 1.2 0.8
assign (resid 55 and name HB# and segid A)(resid 58 and name HB* and segid A) 3.0 1.2 0.3
assign (resid 56 and name HA and segid A)(resid 59 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 57 and name HA and segid A)(resid 60 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 58 and name HA and segid A)(resid 61 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 59 and name HA and segid A)(resid 62 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 59 and name HA and segid A)(resid 62 and name HD1 and segid A) 4.0 2.2 2.0
assign (resid 59 and name HD# and segid A)(resid 63 and name HD# and segid A) 4.0 2.2 1.5
assign (resid 60 and name HA and segid A)(resid 63 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 60 and name HA and segid A)(resid 63 and name HD# and segid A) 4.0 2.2 1.5
assign (resid 61 and name HA and segid A)(resid 64 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 62 and name HA and segid A)(resid 65 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 62 and name HZ2 and segid A)(resid 66 and name HG2# and segid A) 3.0 1.2 0.8
assign (resid 62 and name HH2 and segid A)(resid 66 and name HG2# and segid A) 4.0 2.2 2.5
assign (resid 62 and name HD1 and segid A)(resid 66 and name HG2# and segid A) 4.0 2.2 2.5
assign (resid 63 and name HA and segid A)(resid 66 and name HB# and segid A) 4.0 2.2 1.0
assign (resid 63 and name HD* and segid A)(resid 66 and name HA and segid A) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid A)(resid 67 and name HA and segid A) 4.0 2.2 1.5
assign (resid 63 and name HD* and segid A)(resid 67 and name HB# and segid A) 4.0 2.2 1.5
assign (resid 64 and name HA and segid A)(resid 68 and name HA# and segid A) 4.0 2.2 1.0
assign (resid 64 and name HA and segid A)(resid 69 and name HB# and segid A) 3.0 1.2 0.8
assign (resid 69 and name HA and segid A)(resid 73 and name HB# and segid A) 4.0 2.2 1.0
assign (resid 69 and name HB# and segid A)(resid 73 and name HA and segid A) 4.0 2.2 1.5
assign (resid 69 AND NAME hb# and segid A)(RESID 73 AND NAME hb# and segid A) 4.0 2.2 1.0
assign (resid 69 AND NAME hb# and segid A)(RESID 74 AND NAME hb# and segid A) 4.0 2.2 1.0
assign (resid 71 and name HA and segid A)(resid 74 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 71 and name HB# and segid A)(resid 74 and name HN and segid A) 4.0 2.2 1.0
assign (resid 72 and name HA and segid A)(resid 75 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 72 and name HA and segid A)(resid 75 and name HD# and segid A) 4.0 2.2 1.0
assign (resid 73 and name HA and segid A)(resid 76 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 74 and name HA and segid A)(resid 77 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 75 and name HA and segid A)(resid 78 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 77 and name HA and segid A)(resid 80 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 78 and name HA and segid A)(resid 81 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 78 and name HA and segid A)(resid 81 and name HD# and segid A) 4.0 2.2 1.5
assign (resid 79 and name HA# and segid A)(resid 82 and name HG# and segid A) 4.0 2.2 2.0
assign (resid 79 and name HA# and segid A)(resid 82 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 80 and name HA and segid A)(resid 83 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 81 and name HA and segid A)(resid 84 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 81 and name HD# and segid A)(resid 84 and name HA and segid A) 4.0 2.2 2.5
assign (resid 82 and name HA and segid A)(resid 85 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 83 and name HA and segid A)(resid 86 and name HB# and segid A) 3.0 1.2 0.3
assign (resid 84 and name HA and segid A)(resid 87 and name HB# and segid A) 2.5 0.7 0.7
assign (resid 84 and name HA and segid A)(resid 88 and name HD# and segid A) 3.0 1.2 0.3
assign (resid 84 and name HD1 and segid A)(resid 88 and name HE# and segid A) 4.0 2.2 1.0
assign (resid 85 and name HA and segid A)(resid 88 and name HA and segid A) 4.0 2.2 2.0
assign (resid 85 and name HA and segid A)(resid 89 and name HB# and segid A) 3.0 1.2 0.3
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assign (resid 3 and name HB and segid B)(resid 7 and name HB# and segid B) 4.0 2.2 2.0
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assign (resid 4 and name HA and segid B)(resid 7 and name HB# and segid B) 4.0 2.2 2.0
assign (resid 5 and name HA and segid B)(resid 8 and name HB# and segid B) 2.5 0.7 0.7
assign (resid 6 and name HA and segid B)(resid 9 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 6 and name HG# and segid B)(resid 10 and name HD# and segid B) 4.0 2.2 2.5
assign (resid 7 and name HD2 and segid B)(resid 11 and name HG# and segid B) 3.0 1.2 0.8
assign (resid 7 and name HA and segid B)(resid 10 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 8 and name HA and segid B)(resid 11 and name HB# and segid B) 4.0 2.2 1.0
assign (resid 8 and name HA and segid B)(resid 11 and name HG# and segid B) 2.5 0.7 0.7
assign (resid 9 and name HA and segid B)(resid 12 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 10 and name HD# and segid B)(resid 15 and name HB# and segid B) 4.0 2.2 2.0
assign (resid 19 and name HA and segid B)(resid 21 and name HA# and segid B) 4.0 2.2 2.0
assign (resid 19 and name HG# and segid B)(resid 21 and name HA# and segid B) 4.0 2.2 2.5
assign (resid 20 and name HG# and segid B)(resid 23 and name HB# and segid B) 4.0 2.2 1.5
assign (resid 20 and name HG# and segid B)(resid 23 and name HG and segid B) 4.0 2.2 2.5
assign (resid 20 and name HB and segid B)(resid 23 and name HD* and segid B) 4.0 2.2 2.5
assign (resid 20 and name HA and segid B)(resid 23 and name HD* and segid B) 3.0 1.2 0.8
assign (resid 21 and name HA# and segid B)(resid 26 and name HG2* and segid B) 3.0 1.2 0.8
assign (resid 21 and name HA# and segid B)(resid 26 and name HD* and segid B) 4.0 2.2 2.5
assign (resid 21 and name HA# and segid B)(resid 26 and name HB and segid B) 4.0 2.2 1.0
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assign (resid 23 and name HB* and segid B)(resid 26 and name HG1# and segid B) 4.0 2.2 2.0
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assign (resid 23 and name HB* and segid B)(resid 26 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 23 and name HD* and segid B)(resid 26 and name HD# and segid B) 4.0 2.2 3.0
assign (resid 26 and name HG2# and segid B)(resid 30 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 26 and name HG2# and segid B)(resid 30 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 26 and name HD# and segid B)(resid 30 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 26 and name HD# and segid B)(resid 30 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 26 and name HG2# and segid B)(resid 31 and name HA# and segid B) 3.0 1.2 0.8
assign (resid 29 and name HG# and segid B)(resid 32 and name HB# and segid B) 4.0 2.2 1.0
assign (resid 29 and name HA and segid B)(resid 32 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 29 and name HA and segid B)(resid 32 and name HD# and segid B) 4.0 2.2 2.5
assign (resid 30 and name HA and segid B)(resid 33 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 31 and name HA# and segid B)(resid 34 and name HB# and segid B) 4.0 2.2 2.0
assign (resid 31 and name HA# and segid B)(resid 34 and name HD# and segid B) 3.0 1.2 0.8
assign (resid 32 and name HA and segid B)(resid 35 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 32 and name HA and segid B)(resid 35 and name HG# and segid B) 4.0 2.2 1.0
assign (resid 32 and name HB# and segid B)(resid 35 and name HG# and segid B) 4.0 2.2 2.0
assign (resid 33 and name HA and segid B)(resid 36 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 34 and name HD* and segid B)(resid 37 and name HD# and segid B) 4.0 2.2 1.5
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assign (resid 34 and name HD* and segid B)(resid 39 and name HD# and segid B) 4.0 2.2 1.5
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assign (resid 35 and name HA and segid B)(resid 40 and name HA and segid B) 3.0 1.2 0.3
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assign (resid 35 and name HG# and segid B)(resid 40 and name HA and segid B) 3.0 1.2 0.3
assign (resid 35 and name HG# and segid B)(resid 40 and name HB# and segid B) 4.0 2.2 1.0
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assign (resid 37 and name HB# and segid B)(resid 39 and name HD# and segid B) 4.0 2.2 1.0
assign (resid 37 and name HB# and segid B)(resid 39 and name HE# and segid B) 4.0 2.2 1.0
assign (resid 37 and name HG# and segid B)(resid 39 and name HD# and segid B) 4.0 2.2 1.0
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assign (resid 39 and name HA and segid B)(resid 44 and name HB and segid B) 3.0 1.2 0.3
assign (resid 39 and name HD# and segid B)(resid 44 and name HG* and segid B) 2.5 0.7 0.7
assign (resid 39 and name HE# and segid B)(resid 44 and name HG* and segid B) 3.0 1.2 0.8
assign (resid 39 and name HA and segid B)(resid 44 and name HG* and segid B) 2.5 0.7 0.7
assign (resid 39 and name HB# and segid B)(resid 44 and name HG* and segid B) 3.0 1.2 0.8
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assign (resid 42 and name HA and segid B)(resid 44 and name HB and segid B) 4.0 2.2 2.0
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assign (resid 43 and name HA and segid B)(resid 46 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 44 and name HA and segid B)(resid 47 and name HA# and segid B) 4.0 2.2 2.0
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assign (resid 45 and name HA and segid B)(resid 48 and name HB# and segid B) 4.0 2.2 1.0
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assign (resid 46 and name HD* and segid B)(resid 49 and name HD* and segid B) 2.5 0.7 1.8
assign (resid 47 and name HA# and segid B)(resid 50 and name HB# and segid B) 3.0 1.2 0.3
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assign (resid 48 and name HA and segid B)(resid 51 and name HA and segid B) 4.0 2.2 2.0
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assign (resid 49 and name HA and segid B)(resid 52 and name HD* and segid B) 4.0 2.2 2.5
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assign (resid 49 and name HZ and segid B)(resid 54 and name HB# and segid B) 4.0 2.2 2.0
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assign (resid 60 and name HA and segid B)(resid 63 and name HB# and segid B) 3.0 1.2 0.3
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assign (resid 61 and name HA and segid B)(resid 64 and name HB# and segid B) 3.0 1.2 0.3
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assign (resid 63 and name HD* and segid B)(resid 67 and name HA and segid B) 4.0 2.2 1.5
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assign (resid 64 and name HA and segid B)(resid 68 and name HA# and segid B) 4.0 2.2 1.0
assign (resid 64 and name HA and segid B)(resid 69 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 69 and name HA and segid B)(resid 73 and name HB# and segid B) 4.0 2.2 1.0
assign (resid 69 and name HB# and segid B)(resid 73 and name HA and segid B) 4.0 2.2 1.5
assign (resid 69 AND NAME hb# and segid B)(RESID 73 AND NAME hb# and segid B) 4.0 2.2 1.0
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assign (resid 73 and name HA and segid B)(resid 76 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 74 and name HA and segid B)(resid 77 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 75 and name HA and segid B)(resid 78 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 77 and name HA and segid B)(resid 80 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 78 and name HA and segid B)(resid 81 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 78 and name HA and segid B)(resid 81 and name HD# and segid B) 4.0 2.2 1.5
assign (resid 79 and name HA# and segid B)(resid 82 and name HG# and segid B) 4.0 2.2 2.0
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assign (resid 80 and name HA and segid B)(resid 83 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 81 and name HA and segid B)(resid 84 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 81 and name HD# and segid B)(resid 84 and name HA and segid B) 4.0 2.2 2.5
assign (resid 82 and name HA and segid B)(resid 85 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 83 and name HA and segid B)(resid 86 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 84 and name HA and segid B)(resid 87 and name HB# and segid B) 2.5 0.7 0.7
assign (resid 84 and name HA and segid B)(resid 88 and name HD# and segid B) 3.0 1.2 0.3
assign (resid 84 and name HD1 and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 1.0
assign (resid 85 and name HA and segid B)(resid 88 and name HA and segid B) 4.0 2.2 2.0
assign (resid 85 and name HA and segid B)(resid 89 and name HB# and segid B) 3.0 1.2 0.3


assign (resid 10 and name HD# and segid A)(resid 24 and name HN and segid A) 4.0 2.2 2.0
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assign (resid 11 and name HG* and segid A)(resid 84 and name HN and segid A) 2.5 0.7 1.0
assign (resid 13 and name HN and segid A)(resid 88 and name HZ and segid A) 4.0 2.2 2.0
assign (resid 13 and name HN and segid A)(resid 88 and name HE# and segid A) 4.0 2.2 1.0
assign (resid 15 and name HN and segid A)(resid 84 and name HE1 and segid A) 3.0 1.2 0.5
assign (resid 15 and name HE# and segid A)(resid 84 and name HE1 and segid A) 4.0 2.2 2.5
assign (resid 15 and name HB# and segid A)(resid 84 and name HE1 and segid A) 4.0 2.2 2.0
assign (resid 15 and name HN and segid A)(resid 84 and name HZ2 and segid A) 3.0 1.2 0.5
assign (resid 15 and name HN and segid A)(resid 84 and name HH2 and segid A) 4.0 2.2 2.0
assign (resid 19 and name HA and segid A)(resid 41 and name HN and segid A) 4.0 2.2 2.0
assign (resid 19 and name HA and segid A)(resid 42 and name HN and segid A) 3.0 1.2 0.5
assign (resid 20 and name HG* and segid A)(resid 35 and name HN and segid A) 4.0 2.2 2.5
assign (resid 20 and name HG* and segid A)(resid 41 and name HN and segid A) 4.0 2.2 2.5
assign (resid 20 and name HA and segid A)(resid 42 and name HN and segid A) 3.0 1.2 0.5
assign (resid 20 and name HN and segid A)(resid 41 and name HN and segid A) 4.0 2.2 2.0
assign (resid 20 and name HN and segid A)(resid 42 and name HN and segid A) 4.0 2.2 2.0
assign (resid 22 and name HN and segid A)(resid 42 and name HB# and segid A) 4.0 2.2 2.5
assign (resid 24 and name HB# and segid A)(resid 80 and name HN and segid A) 4.0 2.2 2.5
assign (resid 25 and name HN and segid A)(resid 76 and name HB# and segid A) 4.0 2.2 2.0
assign (resid 26 and name HG2# and segid A)(resid 32 and name HN and segid A) 4.0 2.2 2.5
assign (resid 30 and name HD* and segid A)(resid 69 and name HN and segid A) 2.5 0.7 1.5
assign (resid 39 and name HN and segid A)(resid 45 and name HG* and segid A) 4.0 2.2 2.0
assign (resid 39 and name HZ and segid A)(resid 62 and name HE1 and segid A) 4.0 2.2 2.0
assign (resid 49 and name HE# and segid A)(resid 82 and name HN and segid A) 4.0 2.2 2.0
assign (resid 49 and name HZ and segid A)(resid 82 and name HN and segid A) 4.0 2.2 1.0
assign (resid 52 and name HD* and segid A)(resid 62 and name HN and segid A) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid A)(resid 69 and name HN and segid A) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid A)(resid 74 and name HN and segid A) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid A)(resid 77 and name HN and segid A) 4.0 2.2 2.5
assign (resid 10 and name HD# and segid B)(resid 24 and name HN and segid B) 4.0 2.2 2.0
assign (resid 11 and name HG* and segid B)(resid 83 and name HN and segid B) 4.0 2.2 2.5
assign (resid 11 and name HA and segid B)(resid 84 and name HE1 and segid B) 4.0 2.2 2.0
assign (resid 11 and name HG* and segid B)(resid 84 and name HN and segid B) 2.5 0.7 1.0
assign (resid 13 and name HN and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 2.0
assign (resid 13 and name HN and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 1.0
assign (resid 15 and name HN and segid B)(resid 84 and name HE1 and segid B) 3.0 1.2 0.5
assign (resid 15 and name HE# and segid B)(resid 84 and name HE1 and segid B) 4.0 2.2 2.5
assign (resid 15 and name HB# and segid B)(resid 84 and name HE1 and segid B) 4.0 2.2 2.0
assign (resid 15 and name HN and segid B)(resid 84 and name HZ2 and segid B) 3.0 1.2 0.5
assign (resid 15 and name HN and segid B)(resid 84 and name HH2 and segid B) 4.0 2.2 2.0
assign (resid 19 and name HA and segid B)(resid 41 and name HN and segid B) 4.0 2.2 2.0
assign (resid 19 and name HA and segid B)(resid 42 and name HN and segid B) 3.0 1.2 0.5
assign (resid 20 and name HG* and segid B)(resid 35 and name HN and segid B) 4.0 2.2 2.5
assign (resid 20 and name HG* and segid B)(resid 41 and name HN and segid B) 4.0 2.2 2.5
assign (resid 20 and name HA and segid B)(resid 42 and name HN and segid B) 3.0 1.2 0.5
assign (resid 20 and name HN and segid B)(resid 41 and name HN and segid B) 4.0 2.2 2.0
assign (resid 20 and name HN and segid B)(resid 42 and name HN and segid B) 4.0 2.2 2.0
assign (resid 22 and name HN and segid B)(resid 42 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 24 and name HB# and segid B)(resid 80 and name HN and segid B) 4.0 2.2 2.5
assign (resid 25 and name HN and segid B)(resid 76 and name HB# and segid B) 4.0 2.2 2.0
assign (resid 26 and name HG2# and segid B)(resid 32 and name HN and segid B) 4.0 2.2 2.5
assign (resid 30 and name HD* and segid B)(resid 69 and name HN and segid B) 2.5 0.7 1.5
assign (resid 39 and name HN and segid B)(resid 45 and name HG* and segid B) 4.0 2.2 2.0
assign (resid 39 and name HZ and segid B)(resid 62 and name HE1 and segid B) 4.0 2.2 2.0
assign (resid 49 and name HE# and segid B)(resid 82 and name HN and segid B) 4.0 2.2 2.0
assign (resid 49 and name HZ and segid B)(resid 82 and name HN and segid B) 4.0 2.2 1.0
assign (resid 52 and name HD* and segid B)(resid 62 and name HN and segid B) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid B)(resid 69 and name HN and segid B) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid B)(resid 74 and name HN and segid B) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid B)(resid 77 and name HN and segid B) 4.0 2.2 2.5
assign (resid 6 and name HG# and segid A)(resid 24 and name HA and segid A) 4.0 2.2 2.0
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assign (resid 7 and name HA and segid A)(resid 24 and name HB# and segid A) 3.0 1.2 0.8
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assign (resid 7 and name HE1 and segid A)(resid 80 and name HA and segid A) 2.5 0.7 0.2
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assign (resid 11 and name HG# and segid A)(resid 80 and name HA and segid A) 2.5 0.7 0.7
assign (resid 11 and name HG# and segid A)(resid 80 and name HB# and segid A) 4.0 2.2 1.5
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assign (resid 11 and name HA and segid A)(resid 83 and name HB# and segid A) 4.0 2.2 1.0
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assign (resid 11 and name HA and segid A)(resid 84 and name HD1 and segid A) 3.0 1.2 0.3
assign (resid 11 and name HG* and segid A)(resid 84 and name HD1 and segid A) 4.0 2.2 1.5
assign (resid 11 and name HA and segid A)(resid 88 and name HE# and segid A) 4.0 2.2 2.0
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assign (resid 11 and name HG# and segid A)(resid 88 and name HZ and segid A) 4.0 2.2 2.5
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assign (resid 12 and name HB# and segid A)(resid 88 and name HE# and segid A) 4.0 2.2 1.5
assign (resid 13 and name HB# and segid A)(resid 88 and name HE# and segid A) 4.0 2.2 2.0
assign (resid 13 and name HB# and segid A)(resid 88 and name HZ and segid A) 4.0 2.2 1.0
assign (resid 13 and name HA and segid A)(resid 88 and name HE# and segid A) 4.0 2.2 2.0
assign (resid 13 and name HA and segid A)(resid 88 and name HZ and segid A) 3.0 1.2 0.3
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assign (resid 14 and name HD# and segid A)(resid 88 and name HZ and segid A) 4.0 2.2 1.0
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assign (resid 15 and name HG# and segid A)(resid 84 and name HZ2 and segid A) 4.0 2.2 2.0
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assign (resid 15 and name HB# and segid A)(resid 88 and name HE# and segid A) 4.0 2.2 2.0
assign (resid 15 and name HG# and segid A)(resid 88 and name HZ and segid A) 4.0 2.2 2.0
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assign (resid 19 and name HA and segid A)(resid 41 and name HD# and segid A) 4.0 2.2 1.0
assign (resid 19 and name HB# and segid A)(resid 41 and name HA and segid A) 4.0 2.2 2.0
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assign (resid 11 and name HG* and segid B)(resid 84 and name HD1 and segid B) 4.0 2.2 1.5
assign (resid 11 and name HA and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 11 and name HG# and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 1.5
assign (resid 11 and name HG# and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 2.5
assign (resid 11 and name HG# and segid B)(resid 88 and name HD# and segid B) 4.0 2.2 2.5
assign (resid 12 and name HA and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 1.0
assign (resid 12 and name HA and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 2.0
assign (resid 12 and name HB# and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 2.5
assign (resid 12 and name HB# and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 1.5
assign (resid 13 and name HB# and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 13 and name HB# and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 1.0
assign (resid 13 and name HA and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 13 and name HA and segid B)(resid 88 and name HZ and segid B) 3.0 1.2 0.3
assign (resid 14 and name HB# and segid B)(resid 84 and name HZ2 and segid B) 4.0 2.2 2.0
assign (resid 14 and name HA and segid B)(resid 84 and name HZ2 and segid B) 3.0 1.2 0.3
assign (resid 14 and name HB# and segid B)(resid 88 and name HD# and segid B) 4.0 2.2 2.0
assign (resid 14 and name HB# and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 14 and name HD# and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 1.0
assign (resid 14 and name HD# and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 15 and name HE# and segid B)(resid 43 and name HA and segid B) 4.0 2.2 2.5
assign (resid 15 and name HE# and segid B)(resid 46 and name HA and segid B) 4.0 2.2 2.5
assign (resid 15 and name HE# and segid B)(resid 46 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 15 and name HE# and segid B)(resid 46 and name HG and segid B) 3.0 1.2 0.8
assign (resid 15 and name HE# and segid B)(resid 46 and name HD# and segid B) 2.5 0.7 1.2
assign (resid 15 and name HE# and segid B)(resid 81 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 15 and name HE# and segid B)(resid 84 and name HD1 and segid B) 4.0 2.2 2.5
assign (resid 15 and name HG# and segid B)(resid 84 and name HZ2 and segid B) 4.0 2.2 2.0
assign (resid 15 and name HB# and segid B)(resid 84 and name HZ2 and segid B) 4.0 2.2 2.0
assign (resid 15 and name HE# and segid B)(resid 84 and name HZ2 and segid B) 4.0 2.2 1.5
assign (resid 15 and name HE# and segid B)(resid 84 and name HE3 and segid B) 4.0 2.2 2.5
assign (resid 15 and name HB# and segid B)(resid 88 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 15 and name HG# and segid B)(resid 88 and name HZ and segid B) 4.0 2.2 2.0
assign (resid 17 and name HB# and segid B)(resid 41 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 17 and name HG# and segid B)(resid 41 and name HE# and segid B) 4.0 2.2 2.0
assign (resid 19 and name HA and segid B)(resid 41 and name HA and segid B) 3.0 1.2 0.3
assign (resid 19 and name HA and segid B)(resid 41 and name HB# and segid B) 4.0 2.2 1.0
assign (resid 19 and name HA and segid B)(resid 41 and name HG# and segid B) 4.0 2.2 2.0
assign (resid 19 and name HA and segid B)(resid 41 and name HD# and segid B) 4.0 2.2 1.0
assign (resid 19 and name HB# and segid B)(resid 41 and name HA and segid B) 4.0 2.2 2.0
assign (resid 20 and name HG# and segid B)(resid 26 and name HG2# and segid B) 2.5 0.7 1.8
assign (resid 20 and name HG# and segid B)(resid 26 and name HD# and segid B) 4.0 2.2 3.0
assign (resid 20 and name HG# and segid B)(resid 31 and name HA# and segid B) 3.0 1.2 0.8
assign (resid 20 and name HG# and segid B)(resid 34 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 20 and name HG# and segid B)(resid 34 and name HD# and segid B) 4.0 2.2 2.0
assign (resid 20 and name HG# and segid B)(resid 35 and name HG# and segid B) 4.0 2.2 2.5
assign (resid 20 and name HG# and segid B)(resid 39 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 20 and name HG# and segid B)(resid 40 and name HA and segid B) 4.0 2.2 2.5
assign (resid 20 and name HA and segid B)(resid 41 and name HA and segid B) 4.0 2.2 2.0
assign (resid 20 and name HA and segid B)(resid 42 and name HA and segid B) 3.0 1.2 0.3
assign (resid 20 and name HA and segid B)(resid 42 and name HB# and segid B) 2.5 0.7 0.7
assign (resid 20 and name HG* and segid B)(resid 42 and name HA and segid B) 3.0 1.2 0.8
assign (resid 23 and name HB* and segid B)(resid 42 and name HB# and segid B) 4.0 2.2 1.0
assign (resid 23 and name HG* and segid B)(resid 42 and name HB# and segid B) 4.0 2.2 1.5
assign (resid 23 and name HD* and segid B)(resid 42 and name HA and segid B) 3.0 1.2 0.8
assign (resid 23 and name HD* and segid B)(resid 42 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 23 and name HA and segid B)(resid 42 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 23 and name HD* and segid B)(resid 45 and name HB and segid B) 3.0 1.2 0.8
assign (resid 23 and name HG and segid B)(resid 45 and name HG# and segid B) 4.0 2.2 1.5
assign (resid 23 and name HD* and segid B)(resid 81 and name HD* and segid B) 2.5 0.7 1.2
assign (resid 24 and name HB# and segid B)(resid 76 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 24 and name HB# and segid B)(resid 76 and name HA and segid B) 4.0 2.2 1.5
assign (resid 24 and name HB# and segid B)(resid 77 and name HA and segid B) 4.0 2.2 1.5
assign (resid 24 and name HB# and segid B)(resid 80 and name HB# and segid B) 2.5 0.7 0.7
assign (resid 24 and name HB# and segid B)(resid 80 and name HA and segid B) 4.0 2.2 1.5
assign (resid 24 and name HB# and segid B)(resid 84 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 25 and name HA# and segid B)(resid 73 and name HA and segid B) 3.0 1.2 0.3
assign (resid 25 and name HA# and segid B)(resid 76 and name HB# and segid B) 4.0 2.2 1.0
assign (resid 26 and name HG2# and segid B)(resid 34 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 26 and name HD# and segid B)(resid 34 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 26 and name HG2# and segid B)(resid 69 and name HB# and segid B) 4.0 2.2 1.5
assign (resid 26 and name HD# and segid B)(resid 63 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 26 and name HD# and segid B)(resid 63 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 26 and name HG2# and segid B)(resid 63 and name HG and segid B) 4.0 2.2 2.5
assign (resid 26 and name HG2# and segid B)(resid 63 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 26 and name HG2# and segid B)(resid 77 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 30 and name HD* and segid B)(resid 69 and name HA and segid B) 3.0 1.2 0.8
assign (resid 30 and name HD* and segid B)(resid 69 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 33 and name HB* and segid B)(resid 67 and name HA and segid B) 3.0 1.2 0.8
assign (resid 33 and name HD* and segid B)(resid 67 and name HA and segid B) 3.0 1.2 0.8
assign (resid 33 and name HE* and segid B)(resid 67 and name HA and segid B) 4.0 2.2 1.0
assign (resid 34 and name HD* and segid B)(resid 62 and name HZ2 and segid B) 2.5 0.7 0.7
assign (resid 34 and name HD* and segid B)(resid 62 and name HH2 and segid B) 4.0 2.2 1.5
assign (resid 34 and name HD* and segid B)(resid 62 and name HE3 and segid B) 4.0 2.2 2.5
assign (resid 34 and name HD# and segid B)(resid 63 and name HD# and segid B) 2.5 0.7 1.8
assign (resid 34 and name HD* and segid B)(resid 66 and name HB# and segid B) 4.0 2.2 1.5
assign (resid 34 and name HG and segid B)(resid 66 and name HB# and segid B) 4.0 2.2 2.5
assign (resid 34 and name HA and segid B)(resid 66 and name HG2# and segid B) 3.0 1.2 0.8
assign (resid 34 and name HD# and segid B)(resid 66 and name HG2# and segid B) 2.5 0.7 1.2
assign (resid 34 and name HD* and segid B)(resid 67 and name HA and segid B) 4.0 2.2 1.5
assign (resid 34 and name HD* and segid B)(resid 67 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 37 and name HD# and segid B)(resid 66 and name HG2# and segid B) 3.0 1.2 0.8
assign (resid 37 and name HE# and segid B)(resid 66 and name HG2# and segid B) 3.0 1.2 0.8
assign (resid 39 and name HB# and segid B)(resid 45 and name HG* and segid B) 3.0 1.2 0.8
assign (resid 39 and name HD# and segid B)(resid 45 and name HA and segid B) 4.0 2.2 2.0
assign (resid 39 and name HD# and segid B)(resid 45 and name HG* and segid B) 3.0 1.2 0.8
assign (resid 39 and name HE# and segid B)(resid 45 and name HA and segid B) 4.0 2.2 2.0
assign (resid 39 and name HE# and segid B)(resid 45 and name HA and segid B) 4.0 2.2 2.0
assign (resid 39 and name HZ and segid B)(resid 51 and name HG# and segid B) 4.0 2.2 2.5
assign (resid 39 and name HZ and segid B)(resid 51 and name HG# and segid B) 4.0 2.2 2.5
assign (resid 39 and name HZ and segid B)(resid 62 and name HZ2 and segid B) 3.0 1.2 0.3
assign (resid 39 and name HD# and segid B)(resid 62 and name HZ2 and segid B) 4.0 2.2 1.0
assign (resid 39 and name HE# and segid B)(resid 62 and name HZ2 and segid B) 4.0 2.2 1.0
assign (resid 39 and name HD# and segid B)(resid 66 and name HG2# and segid B) 4.0 2.2 1.5
assign (resid 39 and name HE# and segid B)(resid 66 and name HG2# and segid B) 4.0 2.2 2.5
assign (resid 45 and name HG* and segid B)(resid 62 and name HZ2 and segid B) 4.0 2.2 1.5
assign (resid 45 and name HG* and segid B)(resid 62 and name HZ3 and segid B) 4.0 2.2 1.5
assign (resid 45 and name HG* and segid B)(resid 62 and name HE3 and segid B) 4.0 2.2 2.5
assign (resid 45 and name HA and segid B)(resid 62 and name HH2 and segid B) 4.0 2.2 1.0
assign (resid 45 and name HG* and segid B)(resid 62 and name HH2 and segid B) 3.0 1.2 0.8
assign (resid 45 and name HG* and segid B)(resid 62 and name HZ3 and segid B) 4.0 2.2 1.5
assign (resid 45 and name HG# and segid B)(resid 81 and name HD# and segid B) 2.5 0.7 1.2
assign (resid 46 and name HA and segid B)(resid 81 and name HD* and segid B) 3.0 1.2 0.8
assign (resid 46 and name HD* and segid B)(resid 81 and name HD* and segid B) 2.5 0.7 1.8
assign (resid 46 and name HD* and segid B)(resid 81 and name HB# and segid B) 4.0 2.2 1.5
assign (resid 46 and name HB# and segid B)(resid 81 and name HD* and segid B) 3.0 1.2 0.8
assign (resid 46 and name HD* and segid B)(resid 84 and name HZ2 and segid B) 4.0 2.2 2.5
assign (resid 46 and name HD* and segid B)(resid 84 and name HZ3 and segid B) 4.0 2.2 1.5
assign (resid 46 and name HD* and segid B)(resid 84 and name HE3 and segid B) 4.0 2.2 1.5
assign (resid 46 and name HD* and segid B)(resid 84 and name HH2 and segid B) 4.0 2.2 2.5
assign (resid 49 and name HE# and segid B)(resid 59 and name HD* and segid B) 4.0 2.2 2.5
assign (resid 49 and name HA and segid B)(resid 59 and name HD# and segid B) 4.0 2.2 1.0
assign (resid 49 and name HE# and segid B)(resid 78 and name HD* and segid B) 4.0 2.2 1.0
assign (resid 49 and name HZ and segid B)(resid 78 and name HD* and segid B) 4.0 2.2 1.0
assign (resid 49 and name HE# and segid B)(resid 81 and name HD* and segid B) 4.0 2.2 2.5
assign (resid 49 and name HA and segid B)(resid 81 and name HD* and segid B) 4.0 2.2 2.5
assign (resid 49 and name HD# and segid B)(resid 81 and name HD* and segid B) 4.0 2.2 2.5
assign (resid 49 and name HB# and segid B)(resid 81 and name HD* and segid B) 3.0 1.2 0.8
assign (resid 49 and name HZ and segid B)(resid 82 and name HB# and segid B) 3.0 1.2 0.3
assign (resid 49 and name HE# and segid B)(resid 82 and name HA and segid B) 4.0 2.2 1.0
assign (resid 49 and name HZ and segid B)(resid 82 and name HG# and segid B) 4.0 2.2 2.0
assign (resid 49 and name HZ and segid B)(resid 82 and name HA and segid B) 3.0 1.2 0.3
assign (resid 49 and name HE# and segid B)(resid 85 and name HB# and segid B) 4.0 2.2 1.0
assign (resid 52 and name HB* and segid B)(resid 58 and name HB# and segid B) 4.0 2.2 2.0
assign (resid 52 and name HD* and segid B)(resid 58 and name HB# and segid B) 3.0 1.2 0.8
assign (resid 52 and name HD* and segid B)(resid 59 and name HA and segid B) 3.0 1.2 0.8
assign (resid 52 and name HD* and segid B)(resid 59 and name HD# and segid B) 3.0 1.2 0.8
assign (resid 56 and name HB# and segid B)(resid 78 and name HD# and segid B) 4.0 2.2 2.0
assign (resid 56 and name HG# and segid B)(resid 78 and name HD# and segid B) 4.0 2.2 2.0
assign (resid 59 and name HD# and segid B)(resid 78 and name HA and segid B) 4.0 2.2 2.0
assign (resid 59 and name HD# and segid B)(resid 81 and name HD# and segid B) 4.0 2.2 2.5
assign (resid 63 and name HD* and segid B)(resid 69 and name HB# and segid B) 2.5 0.7 1.2
assign (resid 63 and name HD* and segid B)(resid 74 and name HA and segid B) 3.0 1.2 0.8
assign (resid 63 and name HD* and segid B)(resid 74 and name HB# and segid B) 3.0 1.2 0.8


!Intersubunit


assign (resid  44 and name  HG# and segid A) (resid  53 and name   HN   and segid B)  4.0 2.2 1.5 
assign (resid  44 and name  HG# and segid B) (resid  53 and name   HN   and segid A)  4.0 2.2 1.5


assign (resid  15 and name  HE# and segid A) (resid  89 and name  HD#   and segid B)  3.0 1.2 0.8
assign (resid  15 and name  HE# and segid B) (resid  89 and name  HD#   and segid A)  3.0 1.2 0.8
assign (resid  15 and name  HG# and segid A) (resid  89 and name  HD#   and segid B)  4.0 2.2 1.5
assign (resid  15 and name  HG# and segid B) (resid  89 and name  HD#   and segid A)  4.0 2.2 1.5


assign (resid  16 and name   HN and segid A) (resid  89 and name  HD#   and segid B)  4.0 2.2 3.0
assign (resid  16 and name   HN and segid B) (resid  89 and name  HD#   and segid A)  4.0 2.2 3.0

assign (resid  43 and name   HA and segid A) (resid  50 and name  HD#   and segid B)  4.0 2.2 2.5 
assign (resid  43 and name   HA and segid B) (resid  50 and name  HD#   and segid A)  4.0 2.2 2.5
assign (resid  43 and name  HB# and segid A) (resid  50 and name  HD#   and segid B)  3.0 1.2 0.8 
assign (resid  43 and name  HB# and segid B) (resid  50 and name  HD#   and segid A)  3.0 1.2 0.8
assign (resid  43 and name  HD# and segid A) (resid  50 and name   HA   and segid B)  4.0 2.2 2.0 
assign (resid  43 and name  HD# and segid B) (resid  50 and name   HA   and segid A)  4.0 2.2 2.0
assign (resid  43 and name  HE# and segid A) (resid  50 and name   HA   and segid B)  4.0 2.2 2.0 
assign (resid  43 and name  HE# and segid B) (resid  50 and name   HA   and segid A)  4.0 2.2 2.0
assign (resid  43 and name  HD# and segid A) (resid  50 and name  HD#   and segid B)  3.0 1.2 0.8 
assign (resid  43 and name  HD# and segid B) (resid  50 and name  HD#   and segid A)  3.0 1.2 0.8
assign (resid  43 and name  HD# and segid A) (resid  50 and name  HB#   and segid B)  4.0 2.2 1.0
assign (resid  43 and name  HD# and segid B) (resid  50 and name  HB#   and segid A)  4.0 2.2 1.0
assign (resid  43 and name  HE# and segid A) (resid  50 and name  HB#   and segid B)  4.0 2.2 1.0
assign (resid  43 and name  HE# and segid B) (resid  50 and name  HB#   and segid A)  4.0 2.2 1.0
assign (resid  43 and name  HE# and segid A) (resid  50 and name  HD#   and segid B)  4.0 2.2 1.0
assign (resid  43 and name  HE# and segid B) (resid  50 and name  HD#   and segid A)  4.0 2.2 1.0

assign (resid  43 and name  HD# and segid A) (resid  53 and name   HA   and segid B)  4.0 2.2 2.0 
assign (resid  43 and name  HD# and segid B) (resid  53 and name   HA   and segid A)  4.0 2.2 2.0
assign (resid  43 and name  HE# and segid A) (resid  53 and name   HN   and segid B)  2.5  0.7  1.0 
assign (resid  43 and name  HE# and segid B) (resid  53 and name   HN   and segid A)  2.5  0.7  1.0
assign (resid  43 and name  HE# and segid A) (resid  53 and name   HA   and segid B)  2.5  0.7  0.2 
assign (resid  43 and name  HE# and segid B) (resid  53 and name   HA   and segid A)  2.5  0.7  0.2
assign (resid  43 and name  HE# and segid A) (resid  53 and name  HD#   and segid B)  4.0 2.2 1.0 
assign (resid  43 and name  HE# and segid B) (resid  53 and name  HD#   and segid A)  4.0 2.2 1.0
assign (resid  43 and name  HE# and segid A) (resid  53 and name  HG#   and segid B)  4.0 2.2 2.0 
assign (resid  43 and name  HE# and segid B) (resid  53 and name  HG#   and segid A)  4.0 2.2 2.0

assign (resid  43 and name  HE# and segid A) (resid  54 and name  HE#   and segid B)  4.0 2.2 1.0 
assign (resid  43 and name  HE# and segid B) (resid  54 and name  HE#   and segid A)  4.0 2.2 1.0

assign (resid  43 and name   HA and segid A) (resid  89 and name  HD#   and segid B)  3.0 1.2 0.8 
assign (resid  43 and name   HA and segid B) (resid  89 and name  HD#   and segid A)  3.0 1.2 0.8 
assign (resid  43 and name  HB# and segid A) (resid  89 and name  HD#   and segid B)  4.0 2.2 1.5 
assign (resid  43 and name  HB# and segid B) (resid  89 and name  HD#   and segid A)  4.0 2.2 1.5 
assign (resid  43 and name  HD# and segid A) (resid  89 and name  HD#   and segid B)  3.0 1.2 0.8 
assign (resid  43 and name  HD# and segid B) (resid  89 and name  HD#   and segid A)  3.0 1.2 0.8
assign (resid  43 and name   HN and segid A) (resid  89 and name  HD#   and segid B)  4.0 2.2 1.5 
assign (resid  43 and name   HN and segid B) (resid  89 and name  HD#   and segid A)  4.0 2.2 1.5

assign (resid  44 and name  HG# and segid A) (resid  47 and name  HA#   and segid B)  4.0 2.2 2.5
assign (resid  44 and name  HG# and segid B) (resid  47 and name  HA#   and segid A)  4.0 2.2 2.5
assign (resid  44 and name  HB# and segid A) (resid  50 and name  HB#   and segid B)  4.0 2.2 2.5
assign (resid  44 and name  HB# and segid B) (resid  50 and name  HB#   and segid A)  4.0 2.2 2.5
assign (resid  44 and name   HA and segid A) (resid  51 and name   HA   and segid B)  4.0 2.2 2.0
assign (resid  44 and name   HA and segid B) (resid  51 and name   HA   and segid A)  4.0 2.2 2.0
assign (resid  44 and name  HG# and segid A) (resid  51 and name   HA   and segid B)  3.0 1.2 0.8
assign (resid  44 and name  HG# and segid B) (resid  51 and name   HA   and segid A)  3.0 1.2 0.8
assign (resid  44 and name  HG# and segid A) (resid  51 and name   HN   and segid B)  4.0 2.2 2.5
assign (resid  44 and name  HG# and segid B) (resid  51 and name   HN   and segid A)  4.0 2.2 2.5
assign (resid  44 and name  HG# and segid A) (resid  51 and name   HB   and segid B)  4.0 2.2 1.5
assign (resid  44 and name  HG# and segid B) (resid  51 and name   HB   and segid A)  4.0 2.2 1.5

assign (resid  44 and name  HG# and segid A) (resid  53 and name   HN   and segid B)  4.0 2.2 2.5
assign (resid  44 and name  HG# and segid B) (resid  53 and name   HN   and segid A)  4.0 2.2 2.5
assign (resid  44 and name  HG# and segid A) (resid  53 and name  HD#   and segid B)  3.0 1.2 0.8
assign (resid  44 and name  HG# and segid B) (resid  53 and name  HD#   and segid A)  3.0 1.2 0.8
assign (resid  44 and name  HG# and segid A) (resid  53 and name  HG#   and segid B)  4.0 2.2 1.5
assign (resid  44 and name  HG# and segid B) (resid  53 and name  HG#   and segid A)  4.0 2.2 1.5
assign (resid  44 and name  HG# and segid A) (resid  53 and name  HE#   and segid B)  3.0 1.2 0.8
assign (resid  44 and name  HG# and segid B) (resid  53 and name  HE#   and segid A)  3.0 1.2 0.8

assign (resid  46 and name  HD# and segid A) (resid  50 and name  HD#   and segid B)  3.0 1.2 1.3
assign (resid  46 and name  HD# and segid B) (resid  50 and name  HD#   and segid A)  3.0 1.2 1.3
assign (resid  46 and name  HD# and segid A) (resid  89 and name  HD#   and segid B)  3.0 1.2 1.3
assign (resid  46 and name  HD# and segid B) (resid  89 and name  HD#   and segid A)  3.0 1.2 1.3
assign (resid  46 and name  HB# and segid A) (resid  89 and name  HD#   and segid B)  4.0 2.2 1.5
assign (resid  46 and name  HB# and segid B) (resid  89 and name  HD#   and segid A)  4.0 2.2 1.5

assign (resid  47 and name   HN and segid A) (resid  50 and name  HB#   and segid B)  4.0 2.2 2.0 
assign (resid  47 and name   HN and segid B) (resid  50 and name  HB#   and segid A)  4.0 2.2 2.0
assign (resid  47 and name   HN and segid A) (resid  50 and name  HD#   and segid B)  4.0 2.2 2.0 
assign (resid  47 and name   HN and segid B) (resid  50 and name  HD#   and segid A)  4.0 2.2 2.0
assign (resid  47 and name  HA# and segid A) (resid  50 and name   HN   and segid B)  4.0 2.2 3.0 
assign (resid  47 and name  HA# and segid B) (resid  50 and name   HN   and segid A)  4.0 2.2 3.0
assign (resid  47 and name  HA# and segid A) (resid  50 and name  HD#   and segid B)  4.0 2.2 1.5 
assign (resid  47 and name  HA# and segid B) (resid  50 and name  HD#   and segid A)  4.0 2.2 1.5
assign (resid  47 and name  HA# and segid A) (resid  51 and name   HA   and segid B)  4.0 2.2 1.0 
assign (resid  47 and name  HA# and segid B) (resid  51 and name   HA   and segid A)  4.0 2.2 1.0
assign (resid  47 and name  HA# and segid A) (resid  51 and name   HN   and segid B)  4.0 2.2 3.0 
assign (resid  47 and name  HA# and segid B) (resid  51 and name   HN   and segid A)  4.0 2.2 3.0
assign (resid  47 and name  HA# and segid A) (resid  51 and name  HG#   and segid B)  4.0 2.2 1.5 
assign (resid  47 and name  HA# and segid B) (resid  51 and name  HG#   and segid A)  4.0 2.2 1.5

assign (resid  48 and name   HN and segid A) (resid  51 and name  HG#   and segid B)  4.0 2.2 2.0 
assign (resid  48 and name   HN and segid B) (resid  51 and name  HG#   and segid A)  4.0 2.2 2.0
assign (resid  48 and name   HA and segid A) (resid  51 and name  HG#   and segid B)  4.0 2.2 1.0 
assign (resid  48 and name   HA and segid B) (resid  51 and name  HG#   and segid A)  4.0 2.2 1.0

assign (resid  50 and name  HD# and segid A) (resid  89 and name  HD#   and segid B)  3.0 1.2 0.8
assign (resid  50 and name  HD# and segid B) (resid  89 and name  HD#   and segid A)  3.0 1.2 0.8


assign (resid  84 and name  HH2 and segid A) (resid  89 and name   HA   and segid B)  3.0 1.2 0.3 
assign (resid  84 and name  HH2 and segid B) (resid  89 and name   HA   and segid A)  3.0 1.2 0.3
assign (resid  84 and name  HZ2 and segid A) (resid  89 and name   HA   and segid B)  4.0 2.2 1.0 
assign (resid  84 and name  HZ2 and segid B) (resid  89 and name   HA   and segid A)  4.0 2.2 1.0
assign (resid  84 and name  HH2 and segid A) (resid  89 and name  HD#   and segid B)  3.0 1.2 0.8 
assign (resid  84 and name  HH2 and segid B) (resid  89 and name  HD#   and segid A)  3.0 1.2 0.8


!!hbonds

ASSIGN (RESID  7 AND NAME O  and segid A)  (RESID 11 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  7 AND NAME O  and segid A)  (RESID 11 AND NAME HN  and segid A) 2.3 1.0 0.2          
 


ASSIGN (RESID  28 AND NAME O  and segid A)  (RESID 32 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  28 AND NAME O  and segid A)  (RESID 32 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  29 AND NAME O  and segid A)  (RESID 33 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  29 AND NAME O  and segid A)  (RESID 33 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  30 AND NAME O  and segid A)  (RESID 34 AND NAME N  and segid A) 3.3 1.0 0.2
ASSIGN (RESID  30 AND NAME O  and segid A)  (RESID 34 AND NAME HN  and segid A) 2.3 1.0 0.2
ASSIGN (RESID  31 AND NAME O  and segid A)  (RESID 35 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  31 AND NAME O  and segid A)  (RESID 35 AND NAME HN  and segid A) 2.3 1.0 0.2
ASSIGN (RESID  32 AND NAME O  and segid A)  (RESID 36 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  32 AND NAME O  and segid A)  (RESID 36 AND NAME HN  and segid A) 2.3 1.0 0.2


ASSIGN (RESID  42 AND NAME O  and segid A)  (RESID 46 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  42 AND NAME O  and segid A)  (RESID 46 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  43 AND NAME O  and segid A)  (RESID 47 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  43 AND NAME O  and segid A)  (RESID 47 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  44 AND NAME O  and segid A)  (RESID 48 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  44 AND NAME O  and segid A)  (RESID 48 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  45 AND NAME O  and segid A)  (RESID 49 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  45 AND NAME O  and segid A)  (RESID 49 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  46 AND NAME O  and segid A)  (RESID 50 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  46 AND NAME O  and segid A)  (RESID 50 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  47 AND NAME O  and segid A)  (RESID 51 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  47 AND NAME O  and segid A)  (RESID 51 AND NAME HN and segid A) 2.3 1.0 0.2

ASSIGN (RESID  56 AND NAME O  and segid A)  (RESID 60 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  56 AND NAME O  and segid A)  (RESID 60 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  57 AND NAME O  and segid A)  (RESID 61 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  57 AND NAME O  and segid A)  (RESID 61 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  58 AND NAME O  and segid A)  (RESID 62 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  58 AND NAME O  and segid A)  (RESID 62 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  59 AND NAME O  and segid A)  (RESID 63 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  59 AND NAME O  and segid A)  (RESID 63 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  60 AND NAME O  and segid A)  (RESID 64 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  60 AND NAME O  and segid A)  (RESID 64 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  61 AND NAME O  and segid A)  (RESID 65 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  61 AND NAME O  and segid A)  (RESID 65 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  62 AND NAME O  and segid A)  (RESID 66 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  62 AND NAME O  and segid A)  (RESID 66 AND NAME HN and segid A) 2.3 1.0 0.2

ASSIGN (RESID  72 AND NAME O  and segid A)  (RESID 76 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  72 AND NAME O  and segid A)  (RESID 76 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  73 AND NAME O  and segid A)  (RESID 77 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  73 AND NAME O  and segid A)  (RESID 77 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  74 AND NAME O  and segid A)  (RESID 78 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  74 AND NAME O  and segid A)  (RESID 78 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  75 AND NAME O  and segid A)  (RESID 79 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  75 AND NAME O  and segid A)  (RESID 79 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  76 AND NAME O  and segid A)  (RESID 80 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  76 AND NAME O  and segid A)  (RESID 80 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  77 AND NAME O  and segid A)  (RESID 81 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  77 AND NAME O  and segid A)  (RESID 81 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  78 AND NAME O  and segid A)  (RESID 82 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  78 AND NAME O  and segid A)  (RESID 82 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  79 AND NAME O  and segid A)  (RESID 83 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  79 AND NAME O  and segid A)  (RESID 83 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  80 AND NAME O  and segid A)  (RESID 84 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  80 AND NAME O  and segid A)  (RESID 84 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  81 AND NAME O  and segid A)  (RESID 85 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  81 AND NAME O  and segid A)  (RESID 85 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  82 AND NAME O  and segid A)  (RESID 86 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  82 AND NAME O  and segid A)  (RESID 86 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  83 AND NAME O  and segid A)  (RESID 87 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  83 AND NAME O  and segid A)  (RESID 87 AND NAME HN and segid A) 2.3 1.0 0.2
ASSIGN (RESID  84 AND NAME O  and segid A)  (RESID 88 AND NAME N  and segid A) 3.3 1.0 0.2          
ASSIGN (RESID  84 AND NAME O  and segid A)  (RESID 88 AND NAME HN and segid A) 2.3 1.0 0.2



ASSIGN (RESID  7 AND NAME O  and segid B)  (RESID 11 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  7 AND NAME O  and segid B)  (RESID 11 AND NAME HN  and segid B) 2.3 1.0 0.2          
 


ASSIGN (RESID  28 AND NAME O  and segid B)  (RESID 32 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  28 AND NAME O  and segid B)  (RESID 32 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  29 AND NAME O  and segid B)  (RESID 33 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  29 AND NAME O  and segid B)  (RESID 33 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  30 AND NAME O  and segid B)  (RESID 34 AND NAME N  and segid B) 3.3 1.0 0.2
ASSIGN (RESID  30 AND NAME O  and segid B)  (RESID 34 AND NAME HN  and segid B) 2.3 1.0 0.2
ASSIGN (RESID  31 AND NAME O  and segid B)  (RESID 35 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  31 AND NAME O  and segid B)  (RESID 35 AND NAME HN  and segid B) 2.3 1.0 0.2
ASSIGN (RESID  32 AND NAME O  and segid B)  (RESID 36 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  32 AND NAME O  and segid B)  (RESID 36 AND NAME HN  and segid B) 2.3 1.0 0.2


ASSIGN (RESID  42 AND NAME O  and segid B)  (RESID 46 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  42 AND NAME O  and segid B)  (RESID 46 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  43 AND NAME O  and segid B)  (RESID 47 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  43 AND NAME O  and segid B)  (RESID 47 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  44 AND NAME O  and segid B)  (RESID 48 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  44 AND NAME O  and segid B)  (RESID 48 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  45 AND NAME O  and segid B)  (RESID 49 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  45 AND NAME O  and segid B)  (RESID 49 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  46 AND NAME O  and segid B)  (RESID 50 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  46 AND NAME O  and segid B)  (RESID 50 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  47 AND NAME O  and segid B)  (RESID 51 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  47 AND NAME O  and segid B)  (RESID 51 AND NAME HN and segid B) 2.3 1.0 0.2

ASSIGN (RESID  56 AND NAME O  and segid B)  (RESID 60 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  56 AND NAME O  and segid B)  (RESID 60 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  57 AND NAME O  and segid B)  (RESID 61 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  57 AND NAME O  and segid B)  (RESID 61 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  58 AND NAME O  and segid B)  (RESID 62 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  58 AND NAME O  and segid B)  (RESID 62 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  59 AND NAME O  and segid B)  (RESID 63 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  59 AND NAME O  and segid B)  (RESID 63 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  60 AND NAME O  and segid B)  (RESID 64 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  60 AND NAME O  and segid B)  (RESID 64 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  61 AND NAME O  and segid B)  (RESID 65 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  61 AND NAME O  and segid B)  (RESID 65 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  62 AND NAME O  and segid B)  (RESID 66 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  62 AND NAME O  and segid B)  (RESID 66 AND NAME HN and segid B) 2.3 1.0 0.2

ASSIGN (RESID  72 AND NAME O  and segid B)  (RESID 76 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  72 AND NAME O  and segid B)  (RESID 76 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  73 AND NAME O  and segid B)  (RESID 77 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  73 AND NAME O  and segid B)  (RESID 77 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  74 AND NAME O  and segid B)  (RESID 78 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  74 AND NAME O  and segid B)  (RESID 78 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  75 AND NAME O  and segid B)  (RESID 79 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  75 AND NAME O  and segid B)  (RESID 79 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  76 AND NAME O  and segid B)  (RESID 80 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  76 AND NAME O  and segid B)  (RESID 80 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  77 AND NAME O  and segid B)  (RESID 81 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  77 AND NAME O  and segid B)  (RESID 81 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  78 AND NAME O  and segid B)  (RESID 82 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  78 AND NAME O  and segid B)  (RESID 82 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  79 AND NAME O  and segid B)  (RESID 83 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  79 AND NAME O  and segid B)  (RESID 83 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  80 AND NAME O  and segid B)  (RESID 84 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  80 AND NAME O  and segid B)  (RESID 84 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  81 AND NAME O  and segid B)  (RESID 85 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  81 AND NAME O  and segid B)  (RESID 85 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  82 AND NAME O  and segid B)  (RESID 86 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  82 AND NAME O  and segid B)  (RESID 86 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  83 AND NAME O  and segid B)  (RESID 87 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  83 AND NAME O  and segid B)  (RESID 87 AND NAME HN and segid B) 2.3 1.0 0.2
ASSIGN (RESID  84 AND NAME O  and segid B)  (RESID 88 AND NAME N  and segid B) 3.3 1.0 0.2          
ASSIGN (RESID  84 AND NAME O  and segid B)  (RESID 88 AND NAME HN and segid B) 2.3 1.0 0.2

2. Torsion angle restraints


assign (resid   2 and name c  and segid A) (resid   3 and name n  and segid A)
       (resid   3 and name ca and segid A) (resid   3 and name c  and segid A)     1.0 -90  30 2
assign (resid   3 and name n  and segid A) (resid   3 and name ca  and segid A)
       (resid   3 and name c and segid A) (resid   4 and name n  and segid A)     1.0  145 30 2
! S4
assign (resid   3 and name c  and segid A) (resid   4 and name n  and segid A)
       (resid   4 and name ca and segid A) (resid   4 and name c  and segid A)     1.0 -80  30 2
assign (resid   4 and name n  and segid A) (resid   4 and name ca  and segid A)
       (resid   4 and name c and segid A) (resid   5 and name n  and segid A)     1.0  140 40 2
! Q5 
assign (resid   4 and name c  and segid A) (resid   5 and name n  and segid A)
       (resid   5 and name ca and segid A) (resid   5 and name c  and segid A)     1.0 -60  20 2
assign (resid   5 and name n  and segid A) (resid   5 and name ca  and segid A)
       (resid   5 and name c and segid A) (resid   6 and name n  and segid A)     1.0  -40  20 2
! K6 
assign (resid   5 and name c  and segid A) (resid   6 and name n  and segid A)
       (resid   6 and name ca and segid A) (resid   6 and name c  and segid A)     1.0  -60  20 2
assign (resid   6 and name n  and segid A) (resid   6 and name ca  and segid A)
       (resid   6 and name c and segid A) (resid   7 and name n  and segid A)     1.0  -40  20 2
! H7 
assign (resid   6 and name c  and segid A) (resid   7 and name n  and segid A)
       (resid   7 and name ca and segid A) (resid   7 and name c  and segid A)     1.0 -60 20 2
assign (resid   7 and name n  and segid A) (resid   7 and name ca  and segid A)
       (resid   7 and name c and segid A) (resid   8 and name n  and segid A)     1.0 -40 20 2
! R8 
assign (resid   7 and name c  and segid A) (resid   8 and name n  and segid A)
       (resid   8 and name ca and segid A) (resid   8 and name c  and segid A)     1.0 -60 20 2
assign (resid   8 and name n  and segid A) (resid   8 and name ca  and segid A)
       (resid   8 and name c and segid A) (resid   9 and name n  and segid A)     1.0 -40 20 2
! D9 
assign (resid   8 and name c  and segid A) (resid   9 and name n  and segid A)
       (resid   9 and name ca and segid A) (resid   9 and name c  and segid A)     1.0 -60 20 2
assign (resid   9 and name n  and segid A) (resid   9 and name ca  and segid A)
       (resid   9 and name c and segid A) (resid  10 and name n  and segid A)     1.0 -40 20 2
! F10 
assign (resid   9 and name c  and segid A) (resid  10 and name n  and segid A)
       (resid  10 and name ca and segid A) (resid  10 and name c  and segid A)     1.0 -60 20 2
assign (resid  10 and name n  and segid A) (resid  10 and name ca  and segid A)
       (resid  10 and name c and segid A) (resid  11 and name n  and segid A)     1.0 -40 20 2
! V11 
assign (resid  10 and name c  and segid A) (resid  11 and name n  and segid A)
       (resid  11 and name ca and segid A) (resid  11 and name c  and segid A)     1.0 -80 30 2
assign (resid  11 and name n  and segid A) (resid  11 and name ca  and segid A)
       (resid  11 and name c and segid A) (resid  12 and name n  and segid A)     1.0 0 50 2
! A12 
assign (resid  11 and name c  and segid A) (resid  12 and name n  and segid A)
       (resid  12 and name ca and segid A) (resid  12 and name c  and segid A)     1.0 -50 70 2
! E13 
assign (resid  12 and name c  and segid A) (resid  13 and name n  and segid A)
       (resid  13 and name ca and segid A) (resid  13 and name c  and segid A)     1.0  -140 25 2
! P14
! M15           
assign (resid  14 and name c  and segid A) (resid  15 and name n  and segid A)
       (resid  15 and name ca and segid A) (resid  15 and name c  and segid A)     1.0  -100 25 2
assign (resid  15 and name n  and segid A) (resid  15 and name ca  and segid A)
       (resid  15 and name c and segid A) (resid  16 and name n  and segid A)     1.0  -0 60 2

!!G16
assign (resid  15 and name c  and segid A) (resid  16 and name n  and segid A)
       (resid  16 and name ca and segid A) (resid  16 and name c  and segid A)     1.0  50 30 2
assign (resid  16 and name n  and segid A) (resid  16 and name ca  and segid A)
       (resid  16 and name c and segid A) (resid  17 and name n  and segid A)     1.0  -140 60 2

! E17
assign (resid  16 and name c  and segid A) (resid  17 and name n  and segid A)
       (resid  17 and name ca and segid A) (resid  17 and name c  and segid A)     1.0   -90 25 2
assign (resid  17 and name n  and segid A) (resid  17 and name ca  and segid A)
       (resid  17 and name c and segid A) (resid  18 and name n  and segid A)     1.0   -45 100 2
! K18           

assign (resid  17 and name c  and segid A) (resid  18 and name n  and segid A)
       (resid  18 and name ca and segid A) (resid  18 and name c  and segid A)     1.0  -60 20 2

! P19
! V20           
assign (resid  19 and name c  and segid A) (resid  20 and name n  and segid A)
       (resid  20 and name ca and segid A) (resid  20 and name c  and segid A)     1.0  -40 30 2
assign (resid  20 and name n  and segid A) (resid  20 and name ca  and segid A)
       (resid  20 and name c and segid A) (resid  21 and name n  and segid A)     1.0   -40 30 2

! G21   
assign (resid  20 and name c  and segid A) (resid  21 and name n  and segid A)
       (resid  21 and name ca and segid A) (resid  21 and name c  and segid A)     1.0 -60 20 2
assign (resid  21 and name n  and segid A) (resid  21 and name ca  and segid A)
       (resid  21 and name c and segid A) (resid  22 and name n  and segid A)     1.0 -20 30 2
! S22   
assign (resid  21 and name c  and segid A) (resid  22 and name n  and segid A)
       (resid  22 and name ca and segid A) (resid  22 and name c  and segid A)     1.0 -65 20 2
assign (resid  22 and name n  and segid A) (resid  22 and name ca  and segid A)
       (resid  22 and name c and segid A) (resid  23 and name n  and segid A)     1.0 -20 50 2
! L23 
assign (resid  22 and name c  and segid A) (resid  23 and name n  and segid A)
       (resid  23 and name ca and segid A) (resid  23 and name c  and segid A)     1.0 -70 20 2
assign (resid  23 and name n  and segid A) (resid  23 and name ca  and segid A)
       (resid  23 and name c and segid A) (resid  24 and name n  and segid A)     1.0 135 30 2
! A24 
assign (resid  23 and name c  and segid A) (resid  24 and name n  and segid A)
       (resid  24 and name ca and segid A) (resid  24 and name c  and segid A)     1.0 -65 20 2
assign (resid  24 and name n  and segid A) (resid  24 and name ca  and segid A)
       (resid  24 and name c and segid A) (resid  25 and name n  and segid A)     1.0 140 20 2
! G25 
assign (resid  24 and name c  and segid A) (resid  25 and name n  and segid A)
       (resid  25 and name ca and segid A) (resid  25 and name c  and segid A)     1.0 90 20 2
assign (resid  25 and name n  and segid A) (resid  25 and name ca  and segid A)
       (resid  25 and name c and segid A) (resid  26 and name n  and segid A)     1.0 -20 20 2

! I26      
assign (resid  25 and name c  and segid A) (resid  26 and name n  and segid A)
       (resid  26 and name ca and segid A) (resid  26 and name c  and segid A)     1.0 -85 20 2
 
! E27
assign (resid  26 and name c  and segid A) (resid  27 and name n  and segid A)
       (resid  27 and name ca and segid A) (resid  27 and name c  and segid A)     1.0 -90 30 2
assign (resid  27 and name n  and segid A) (resid  27 and name ca  and segid A)
       (resid  27 and name c and segid A) (resid  28 and name n  and segid A)     1.0 170 50 2
 
! E28 
assign (resid  27 and name c  and segid A) (resid  28 and name n  and segid A)
       (resid  28 and name ca and segid A) (resid  28 and name c  and segid A)     1.0 -60 20 2
assign (resid  28 and name n  and segid A) (resid  28 and name ca  and segid A)
       (resid  28 and name c and segid A) (resid  29 and name n  and segid A)     1.0 -40 20 2
! V29 
assign (resid  28 and name c  and segid A) (resid  29 and name n  and segid A)
       (resid  29 and name ca and segid A) (resid  29 and name c  and segid A)     1.0 -60 20 2
assign (resid  29 and name n  and segid A) (resid  29 and name ca  and segid A)
       (resid  29 and name c and segid A) (resid  30 and name n  and segid A)     1.0 -40 20 2
! L30 
assign (resid  29 and name c  and segid A) (resid  30 and name n  and segid A)
       (resid  30 and name ca and segid A) (resid  30 and name c  and segid A)     1.0 -60 20 2
assign (resid  30 and name n  and segid A) (resid  30 and name ca  and segid A)
       (resid  30 and name c and segid A) (resid  31 and name n  and segid A)     1.0 -40 20 2
! G31 
assign (resid  30 and name c  and segid A) (resid  31 and name n  and segid A)
       (resid  31 and name ca and segid A) (resid  31 and name c  and segid A)     1.0 -60 20 2
assign (resid  31 and name n  and segid A) (resid  31 and name ca  and segid A)
       (resid  31 and name c and segid A) (resid  32 and name n  and segid A)     1.0 -40 20 2
! K32 
assign (resid  31 and name c  and segid A) (resid  32 and name n  and segid A)
       (resid  32 and name ca and segid A) (resid  32 and name c  and segid A)     1.0 -60 20 2
assign (resid  32 and name n  and segid A) (resid  32 and name ca  and segid A)
       (resid  32 and name c and segid A) (resid  33 and name n  and segid A)     1.0 -40 20 2
! K33 
assign (resid  32 and name c  and segid A) (resid  33 and name n  and segid A)
       (resid  33 and name ca and segid A) (resid  33 and name c  and segid A)     1.0 -60 20 2
assign (resid  33 and name n  and segid A) (resid  33 and name ca  and segid A)
       (resid  33 and name c and segid A) (resid  34 and name n  and segid A)     1.0 -40 20 2
! L34 
assign (resid  33 and name c  and segid A) (resid  34 and name n  and segid A)
       (resid  34 and name ca and segid A) (resid  34 and name c  and segid A)     1.0 -60 30 2
assign (resid  34 and name n  and segid A) (resid  34 and name ca  and segid A)
       (resid  34 and name c and segid A) (resid  35 and name n  and segid A)     1.0 -40 20 2
! E35 
assign (resid  34 and name c  and segid A) (resid  35 and name n  and segid A)
       (resid  35 and name ca and segid A) (resid  35 and name c  and segid A)     1.0 -60 20 2
assign (resid  35 and name n  and segid A) (resid  35 and name ca  and segid A)
       (resid  35 and name c and segid A) (resid  36 and name n  and segid A)     1.0 -40 20 2
! E36 
assign (resid  35 and name c  and segid A) (resid  36 and name n  and segid A)
       (resid  36 and name ca and segid A) (resid  36 and name c  and segid A)     1.0 -60 20 2
assign (resid  36 and name n  and segid A) (resid  36 and name ca  and segid A)
       (resid  36 and name c and segid A) (resid  37 and name n  and segid A)     1.0 -40 20 2
! R37 
assign (resid  36 and name c  and segid A) (resid  37 and name n  and segid A)
       (resid  37 and name ca and segid A) (resid  37 and name c  and segid A)     1.0 -80 20 2
assign (resid  37 and name n  and segid A) (resid  37 and name ca  and segid A)
       (resid  37 and name c and segid A) (resid  38 and name n  and segid A)     1.0 0 30 2
!G38
assign (resid  37 and name c  and segid A) (resid  38 and name n  and segid A)
       (resid  38 and name ca and segid A) (resid  38 and name c  and segid A)     1.0  100 30 2
assign (resid  38 and name n  and segid A) (resid  38 and name ca  and segid A)
       (resid  38 and name c and segid A) (resid  39 and name n  and segid A)     1.0 0 50 2
! F39 
assign (resid  38 and name c  and segid A) (resid  39 and name n  and segid A)
       (resid  39 and name ca and segid A) (resid  39 and name c  and segid A)     1.0 -85 45 2
assign (resid  39 and name n  and segid A) (resid  39 and name ca  and segid A)
       (resid  39 and name c and segid A) (resid  40 and name n  and segid A)     1.0  70 90 2
! D40 
assign (resid  39 and name c  and segid A) (resid  40 and name n  and segid A)
       (resid  40 and name ca and segid A) (resid  40 and name c  and segid A)     1.0 -80 20 2
assign (resid  40 and name n  and segid A) (resid  40 and name ca  and segid A)
       (resid  40 and name c and segid A) (resid  41 and name n  and segid A)     1.0 15 30 2
! K41 
assign (resid  40 and name c  and segid A) (resid  41 and name n  and segid A)
       (resid  41 and name ca and segid A) (resid  41 and name c  and segid A)     1.0 -140 20 2
assign (resid  41 and name n  and segid A) (resid  41 and name ca  and segid A)
       (resid  41 and name c and segid A) (resid  42 and name n  and segid A)     1.0 150 20 2
! A42 
assign (resid  41 and name c  and segid A) (resid  42 and name n  and segid A)
       (resid  42 and name ca and segid A) (resid  42 and name c  and segid A)     1.0 -60 20 2
assign (resid  42 and name n  and segid A) (resid  42 and name ca  and segid A)
       (resid  42 and name c and segid A) (resid  43 and name n  and segid A)     1.0 -40 20 2
! Y43 
assign (resid  42 and name c  and segid A) (resid  43 and name n  and segid A)
       (resid  43 and name ca and segid A) (resid  43 and name c  and segid A)     1.0 -60 20 2
assign (resid  43 and name n  and segid A) (resid  43 and name ca  and segid A)
       (resid  43 and name c and segid A) (resid  44 and name n  and segid A)     1.0 -40 20 2
! V44 
assign (resid  43 and name c  and segid A) (resid  44 and name n  and segid A)
       (resid  44 and name ca and segid A) (resid  44 and name c  and segid A)     1.0 -60 20 2
assign (resid  44 and name n  and segid A) (resid  44 and name ca  and segid A)
       (resid  44 and name c and segid A) (resid  45 and name n  and segid A)     1.0 -40 20 2
! V45 
assign (resid  44 and name c  and segid A) (resid  45 and name n  and segid A)
       (resid  45 and name ca and segid A) (resid  45 and name c  and segid A)     1.0 -60 20 2
assign (resid  45 and name n  and segid A) (resid  45 and name ca  and segid A)
       (resid  45 and name c and segid A) (resid  46 and name n  and segid A)     1.0 -40 20 2
! L46 
assign (resid  45 and name c  and segid A) (resid  46 and name n  and segid A)
       (resid  46 and name ca and segid A) (resid  46 and name c  and segid A)     1.0 -60 20 2
assign (resid  46 and name n  and segid A) (resid  46 and name ca  and segid A)
       (resid  46 and name c and segid A) (resid  47 and name n  and segid A)     1.0 -40 20 2
! G48
assign (resid  47 and name c  and segid A) (resid  48 and name n  and segid A)
       (resid  48 and name ca and segid A) (resid  48 and name c  and segid A)     1.0 -60 20 2
assign (resid  48 and name n  and segid A) (resid  48 and name ca  and segid A)
       (resid  48 and name c and segid A) (resid  49 and name n  and segid A)     1.0 -40 20 2
! F49 
assign (resid  48 and name c  and segid A) (resid  49 and name n  and segid A)
       (resid  49 and name ca and segid A) (resid  49 and name c  and segid A)     1.0 -60 20 2
assign (resid  49 and name n  and segid A) (resid  49 and name ca  and segid A)
       (resid  49 and name c and segid A) (resid  50 and name n  and segid A)     1.0 -40 20 2
! L50 
assign (resid  49 and name c  and segid A) (resid  50 and name n  and segid A)
       (resid  50 and name ca and segid A) (resid  50 and name c  and segid A)     1.0 -60 20 2
assign (resid  50 and name n  and segid A) (resid  50 and name ca  and segid A)
       (resid  50 and name c and segid A) (resid  51 and name n  and segid A)     1.0 -40 20 2
! V51 
assign (resid  50 and name c  and segid A) (resid  51 and name n  and segid A)
       (resid  51 and name ca and segid A) (resid  51 and name c  and segid A)     1.0 -60 20 2
assign (resid  51 and name n  and segid A) (resid  51 and name ca  and segid A)
       (resid  51 and name c and segid A) (resid  52 and name n  and segid A)     1.0 -40 20 2
! L52 
assign (resid  51 and name c  and segid A) (resid  52 and name n  and segid A)
       (resid  52 and name ca and segid A) (resid  52 and name c  and segid A)     1.0 -70 30 2
assign (resid  52 and name n  and segid A) (resid  52 and name ca  and segid A)
       (resid  52 and name c and segid A) (resid  53 and name n  and segid A)     1.0 0 50 2
! K53 
assign (resid  52 and name c  and segid A) (resid  53 and name n  and segid A)
       (resid  53 and name ca and segid A) (resid  53 and name c  and segid A)     1.0 40 20 2
assign (resid  53 and name n  and segid A) (resid  53 and name ca  and segid A)
       (resid  53 and name c and segid A) (resid  54 and name n  and segid A)     1.0  40 20 2
! K54 
assign (resid  53 and name c  and segid A) (resid  54 and name n  and segid A)
       (resid  54 and name ca and segid A) (resid  54 and name c  and segid A)     1.0 40 20 2
assign (resid  54 and name n  and segid A) (resid  54 and name ca  and segid A)
       (resid  54 and name c and segid A) (resid  55 and name n  and segid A)     1.0  40 20 2
! D55
assign (resid  54 and name c  and segid A) (resid  55 and name n  and segid A)
       (resid  55 and name ca and segid A) (resid  55 and name c  and segid A)     1.0 -60 30 2
! E56 
assign (resid  55 and name c  and segid A) (resid  56 and name n  and segid A)
       (resid  56 and name ca and segid A) (resid  56 and name c  and segid A)     1.0 -60 20 2
assign (resid  56 and name n  and segid A) (resid  56 and name ca  and segid A)
       (resid  56 and name c and segid A) (resid  57 and name n  and segid A)     1.0 -40 20 2
! D57  
assign (resid  56 and name c  and segid A) (resid  57 and name n  and segid A)
       (resid  57 and name ca and segid A) (resid  57 and name c  and segid A)     1.0 -60 20 2
assign (resid  57 and name n  and segid A) (resid  57 and name ca  and segid A)
       (resid  57 and name c and segid A) (resid  58 and name n  and segid A)     1.0 -40 20 2
! L58 
assign (resid  57 and name c  and segid A) (resid  58 and name n  and segid A)
       (resid  58 and name ca and segid A) (resid  58 and name c  and segid A)     1.0 -63 10 2
assign (resid  58 and name n  and segid A) (resid  58 and name ca  and segid A)
       (resid  58 and name c and segid A) (resid  59 and name n  and segid A)     1.0 -40 10 2
! F59 
assign (resid  58 and name c  and segid A) (resid  59 and name n  and segid A)
       (resid  59 and name ca and segid A) (resid  59 and name c  and segid A)     1.0 -60 20 2
assign (resid  59 and name n  and segid A) (resid  59 and name ca  and segid A)
       (resid  59 and name c and segid A) (resid  60 and name n  and segid A)     1.0 -40 20 2
! R60 
assign (resid  59 and name c  and segid A) (resid  60 and name n  and segid A)
       (resid  60 and name ca and segid A) (resid  60 and name c  and segid A)     1.0 -60 20 2
assign (resid  60 and name n  and segid A) (resid  60 and name ca  and segid A)
       (resid  60 and name c and segid A) (resid  61 and name n  and segid A)     1.0 -40 20 2
! E61 
assign (resid  60 and name c  and segid A) (resid  61 and name n  and segid A)
       (resid  61 and name ca and segid A) (resid  61 and name c  and segid A)     1.0 -60 20 2
assign (resid  61 and name n  and segid A) (resid  61 and name ca  and segid A)
       (resid  61 and name c and segid A) (resid  62 and name n  and segid A)     1.0 -40 20 2
! W62 
assign (resid  61 and name c  and segid A) (resid  62 and name n  and segid A)
       (resid  62 and name ca and segid A) (resid  62 and name c  and segid A)     1.0 -60 20 2
assign (resid  62 and name n  and segid A) (resid  62 and name ca  and segid A)
       (resid  62 and name c and segid A) (resid  63 and name n  and segid A)     1.0 -40 20 2
! L63 
assign (resid  62 and name c  and segid A) (resid  63 and name n  and segid A)
       (resid  63 and name ca and segid A) (resid  63 and name c  and segid A)     1.0 -60 20 2
assign (resid  63 and name n  and segid A) (resid  63 and name ca  and segid A)
       (resid  63 and name c and segid A) (resid  64 and name n  and segid A)     1.0 -40 20 2
! K64 
assign (resid  63 and name c  and segid A) (resid  64 and name n  and segid A)
       (resid  64 and name ca and segid A) (resid  64 and name c  and segid A)     1.0 -60 20 2
assign (resid  64 and name n  and segid A) (resid  64 and name ca  and segid A)
       (resid  64 and name c and segid A) (resid  65 and name n  and segid A)     1.0 -40 20 2
! D65 
assign (resid  64 and name c  and segid A) (resid  65 and name n  and segid A)
       (resid  65 and name ca and segid A) (resid  65 and name c  and segid A)     1.0 -60 20 2
assign (resid  65 and name n  and segid A) (resid  65 and name ca  and segid A)
       (resid  65 and name c and segid A) (resid  66 and name n  and segid A)     1.0 -40 20 2
! T66 
assign (resid  65 and name c  and segid A) (resid  66 and name n  and segid A)
       (resid  66 and name ca and segid A) (resid  66 and name c  and segid A)     1.0 -60 20 2
assign (resid  66 and name n  and segid A) (resid  66 and name ca  and segid A)
       (resid  66 and name c and segid A) (resid  67 and name n  and segid A)     1.0 -40 20 2
! C67 
assign (resid  66 and name c  and segid A) (resid  67 and name n  and segid A)
       (resid  67 and name ca and segid A) (resid  67 and name c  and segid A)     1.0 -120 50 2
assign (resid  67 and name n  and segid A) (resid  67 and name ca  and segid A)
       (resid  67 and name c and segid A) (resid  68 and name n  and segid A)     1.0  0 60 2
! G68
assign (resid  67 and name c  and segid A) (resid  68 and name n  and segid A)
       (resid  68 and name ca and segid A) (resid  68 and name c  and segid A)     1.0 100 30 2
assign (resid  68 and name n  and segid A) (resid  68 and name ca  and segid A)
       (resid  68 and name c and segid A) (resid  69 and name n  and segid A)     1.0  15 40 2
! A69  
assign (resid  68 and name c  and segid A) (resid  69 and name n  and segid A)
       (resid  69 and name ca and segid A) (resid  69 and name c  and segid A)     1.0 -50 20 2
! N70 
assign (resid  69 and name c  and segid A) (resid  70 and name n  and segid A)
       (resid  70 and name ca and segid A) (resid  70 and name c  and segid A)     1.0 -95 40 2
assign (resid  70 and name n  and segid A) (resid  70 and name ca  and segid A)
       (resid  70 and name c and segid A) (resid  71 and name n  and segid A)     1.0  160 30 2
! A71 
assign (resid  70 and name c  and segid A) (resid  71 and name n  and segid A)
       (resid  71 and name ca and segid A) (resid  71 and name c  and segid A)     1.0 -60 20 2
assign (resid  71 and name n  and segid A) (resid  71 and name ca  and segid A)
       (resid  71 and name c and segid A) (resid  72 and name n  and segid A)     1.0 -40 20 2
! K72 
assign (resid  71 and name c  and segid A) (resid  72 and name n  and segid A)
       (resid  72 and name ca and segid A) (resid  72 and name c  and segid A)     1.0 -60 20 2
assign (resid  72 and name n  and segid A) (resid  72 and name ca  and segid A)
       (resid  72 and name c and segid A) (resid  73 and name n  and segid A)     1.0 -40 20 2
! Q73 
assign (resid  72 and name c  and segid A) (resid  73 and name n  and segid A)
       (resid  73 and name ca and segid A) (resid  73 and name c  and segid A)     1.0 -60 20 2
assign (resid  73 and name n  and segid A) (resid  73 and name ca  and segid A)
       (resid  73 and name c and segid A) (resid  74 and name n  and segid A)     1.0 -40 20 2
! S74 
assign (resid  73 and name c  and segid A) (resid  74 and name n  and segid A)
       (resid  74 and name ca and segid A) (resid  74 and name c  and segid A)     1.0 -60 20 2
assign (resid  74 and name n  and segid A) (resid  74 and name ca  and segid A)
       (resid  74 and name c and segid A) (resid  75 and name n  and segid A)     1.0 -40 20 2
! R75 
assign (resid  74 and name c  and segid A) (resid  75 and name n  and segid A)
       (resid  75 and name ca and segid A) (resid  75 and name c  and segid A)     1.0 -60 20 2
assign (resid  75 and name n  and segid A) (resid  75 and name ca  and segid A)
       (resid  75 and name c and segid A) (resid  76 and name n  and segid A)     1.0 -40 20 2
! D76 
assign (resid  75 and name c  and segid A) (resid  76 and name n  and segid A)
       (resid  76 and name ca and segid A) (resid  76 and name c  and segid A)     1.0 -60 20 2
assign (resid  76 and name n  and segid A) (resid  76 and name ca  and segid A)
       (resid  76 and name c and segid A) (resid  77 and name n  and segid A)     1.0 -40 20 2
! C77 
assign (resid  76 and name c  and segid A) (resid  77 and name n  and segid A)
       (resid  77 and name ca and segid A) (resid  77 and name c  and segid A)     1.0 -60 20 2
assign (resid  77 and name n  and segid A) (resid  77 and name ca  and segid A)
       (resid  77 and name c and segid A) (resid  78 and name n  and segid A)     1.0 -40 20 2
! F78
assign (resid  78 and name c  and segid A) (resid  79 and name n  and segid A)
       (resid  79 and name ca and segid A) (resid  79 and name c  and segid A)     1.0 -60 20 2
assign (resid  79 and name n  and segid A) (resid  79 and name ca  and segid A)
       (resid  79 and name c and segid A) (resid  80 and name n  and segid A)     1.0 -40 20 2
! C80 
assign (resid  79 and name c  and segid A) (resid  80 and name n  and segid A)
       (resid  80 and name ca and segid A) (resid  80 and name c  and segid A)     1.0 -60 20 2
assign (resid  80 and name n  and segid A) (resid  80 and name ca  and segid A)
       (resid  80 and name c and segid A) (resid  81 and name n  and segid A)     1.0 -40 20 2
! L81 
assign (resid  80 and name c  and segid A) (resid  81 and name n  and segid A)
       (resid  81 and name ca and segid A) (resid  81 and name c  and segid A)     1.0 -60 20 2
assign (resid  81 and name n  and segid A) (resid  81 and name ca  and segid A)
       (resid  81 and name c and segid A) (resid  82 and name n  and segid A)     1.0 -40 20 2
! R82 
assign (resid  81 and name c  and segid A) (resid  82 and name n  and segid A)
       (resid  82 and name ca and segid A) (resid  82 and name c  and segid A)     1.0 -60 20 2
assign (resid  82 and name n  and segid A) (resid  82 and name ca  and segid A)
       (resid  82 and name c and segid A) (resid  83 and name n  and segid A)     1.0 -40 20 2
! E83 
assign (resid  82 and name c  and segid A) (resid  83 and name n  and segid A)
       (resid  83 and name ca and segid A) (resid  83 and name c  and segid A)     1.0 -60 20 2
assign (resid  83 and name n  and segid A) (resid  83 and name ca  and segid A)
       (resid  83 and name c and segid A) (resid  84 and name n  and segid A)     1.0 -40 20 2
! W84 
assign (resid  83 and name c  and segid A) (resid  84 and name n  and segid A)
       (resid  84 and name ca and segid A) (resid  84 and name c  and segid A)     1.0 -60 20 2
assign (resid  84 and name n  and segid A) (resid  84 and name ca  and segid A)
       (resid  84 and name c and segid A) (resid  85 and name n  and segid A)     1.0 -40 20 2
! C85 
assign (resid  84 and name c  and segid A) (resid  85 and name n  and segid A)
       (resid  85 and name ca and segid A) (resid  85 and name c  and segid A)     1.0 -60 20 2
assign (resid  85 and name n  and segid A) (resid  85 and name ca  and segid A)
       (resid  85 and name c and segid A) (resid  86 and name n  and segid A)     1.0 -40 20 2
! D86 
assign (resid  85 and name c  and segid A) (resid  86 and name n  and segid A)
       (resid  86 and name ca and segid A) (resid  86 and name c  and segid A)     1.0 -60 20 2
assign (resid  86 and name n  and segid A) (resid  86 and name ca  and segid A)
       (resid  86 and name c and segid A) (resid  87 and name n  and segid A)     1.0 -40 20 2
! A87 
assign (resid  86 and name c  and segid A) (resid  87 and name n  and segid A)
       (resid  87 and name ca and segid A) (resid  87 and name c  and segid A)     1.0 -75 20 2
assign (resid  87 and name n  and segid A) (resid  87 and name ca  and segid A)
       (resid  87 and name c and segid A) (resid  88 and name n  and segid A)     1.0 -40 20 2
! F88 
assign (resid  87 and name c  and segid A) (resid  88 and name n  and segid A)
       (resid  88 and name ca and segid A) (resid  88 and name c  and segid A)     1.0 -80 35 2
assign (resid  88 and name n  and segid A) (resid  88 and name ca  and segid A)
       (resid  88 and name c and segid A) (resid  89 and name n  and segid A)     1.0 -30 65 2
! L89  




assign (resid   2 and name c  and segid B) (resid   3 and name n  and segid B)
       (resid   3 and name ca and segid B) (resid   3 and name c  and segid B)     1.0 -90  30 2
assign (resid   3 and name n  and segid B) (resid   3 and name ca  and segid B)
       (resid   3 and name c and segid B) (resid   4 and name n  and segid B)     1.0  145 30 2
! S4
assign (resid   3 and name c  and segid B) (resid   4 and name n  and segid B)
       (resid   4 and name ca and segid B) (resid   4 and name c  and segid B)     1.0 -80  30 2
assign (resid   4 and name n  and segid B) (resid   4 and name ca  and segid B)
       (resid   4 and name c and segid B) (resid   5 and name n  and segid B)     1.0  140 40 2
! Q5 
assign (resid   4 and name c  and segid B) (resid   5 and name n  and segid B)
       (resid   5 and name ca and segid B) (resid   5 and name c  and segid B)     1.0 -60  20 2
assign (resid   5 and name n  and segid B) (resid   5 and name ca  and segid B)
       (resid   5 and name c and segid B) (resid   6 and name n  and segid B)     1.0  -40  20 2
! K6 
assign (resid   5 and name c  and segid B) (resid   6 and name n  and segid B)
       (resid   6 and name ca and segid B) (resid   6 and name c  and segid B)     1.0  -60  20 2
assign (resid   6 and name n  and segid B) (resid   6 and name ca  and segid B)
       (resid   6 and name c and segid B) (resid   7 and name n  and segid B)     1.0  -40  20 2
! H7 
assign (resid   6 and name c  and segid B) (resid   7 and name n  and segid B)
       (resid   7 and name ca and segid B) (resid   7 and name c  and segid B)     1.0 -60 20 2
assign (resid   7 and name n  and segid B) (resid   7 and name ca  and segid B)
       (resid   7 and name c and segid B) (resid   8 and name n  and segid B)     1.0 -40 20 2
! R8 
assign (resid   7 and name c  and segid B) (resid   8 and name n  and segid B)
       (resid   8 and name ca and segid B) (resid   8 and name c  and segid B)     1.0 -60 20 2
assign (resid   8 and name n  and segid B) (resid   8 and name ca  and segid B)
       (resid   8 and name c and segid B) (resid   9 and name n  and segid B)     1.0 -40 20 2
! D9 
assign (resid   8 and name c  and segid B) (resid   9 and name n  and segid B)
       (resid   9 and name ca and segid B) (resid   9 and name c  and segid B)     1.0 -60 20 2
assign (resid   9 and name n  and segid B) (resid   9 and name ca  and segid B)
       (resid   9 and name c and segid B) (resid  10 and name n  and segid B)     1.0 -40 20 2
! F10 
assign (resid   9 and name c  and segid B) (resid  10 and name n  and segid B)
       (resid  10 and name ca and segid B) (resid  10 and name c  and segid B)     1.0 -60 20 2
assign (resid  10 and name n  and segid B) (resid  10 and name ca  and segid B)
       (resid  10 and name c and segid B) (resid  11 and name n  and segid B)     1.0 -40 20 2
! V11 
assign (resid  10 and name c  and segid B) (resid  11 and name n  and segid B)
       (resid  11 and name ca and segid B) (resid  11 and name c  and segid B)     1.0 -80 30 2
assign (resid  11 and name n  and segid B) (resid  11 and name ca  and segid B)
       (resid  11 and name c and segid B) (resid  12 and name n  and segid B)     1.0 0 50 2
! A12 
assign (resid  11 and name c  and segid B) (resid  12 and name n  and segid B)
       (resid  12 and name ca and segid B) (resid  12 and name c  and segid B)     1.0 -50 70 2
! E13 
assign (resid  12 and name c  and segid B) (resid  13 and name n  and segid B)
       (resid  13 and name ca and segid B) (resid  13 and name c  and segid B)     1.0  -140 25 2
! P14
! M15           
assign (resid  14 and name c  and segid B) (resid  15 and name n  and segid B)
       (resid  15 and name ca and segid B) (resid  15 and name c  and segid B)     1.0  -100 25 2
assign (resid  15 and name n  and segid B) (resid  15 and name ca  and segid B)
       (resid  15 and name c and segid B) (resid  16 and name n  and segid B)     1.0  -0 60 2

!!G16
assign (resid  15 and name c  and segid B) (resid  16 and name n  and segid B)
       (resid  16 and name ca and segid B) (resid  16 and name c  and segid B)     1.0  50 30 2
assign (resid  16 and name n  and segid B) (resid  16 and name ca  and segid B)
       (resid  16 and name c and segid B) (resid  17 and name n  and segid B)     1.0  -140 60 2

! E17
assign (resid  16 and name c  and segid B) (resid  17 and name n  and segid B)
       (resid  17 and name ca and segid B) (resid  17 and name c  and segid B)     1.0   -90 25 2
assign (resid  17 and name n  and segid B) (resid  17 and name ca  and segid B)
       (resid  17 and name c and segid B) (resid  18 and name n  and segid B)     1.0   -45 100 2
! K18           

assign (resid  17 and name c  and segid B) (resid  18 and name n  and segid B)
       (resid  18 and name ca and segid B) (resid  18 and name c  and segid B)     1.0  -60 20 2

! P19
! V20           
assign (resid  19 and name c  and segid B) (resid  20 and name n  and segid B)
       (resid  20 and name ca and segid B) (resid  20 and name c  and segid B)     1.0  -40 30 2
assign (resid  20 and name n  and segid B) (resid  20 and name ca  and segid B)
       (resid  20 and name c and segid B) (resid  21 and name n  and segid B)     1.0   -40 30 2

! G21   
assign (resid  20 and name c  and segid B) (resid  21 and name n  and segid B)
       (resid  21 and name ca and segid B) (resid  21 and name c  and segid B)     1.0 -60 20 2
assign (resid  21 and name n  and segid B) (resid  21 and name ca  and segid B)
       (resid  21 and name c and segid B) (resid  22 and name n  and segid B)     1.0 -20 30 2
! S22   
assign (resid  21 and name c  and segid B) (resid  22 and name n  and segid B)
       (resid  22 and name ca and segid B) (resid  22 and name c  and segid B)     1.0 -65 20 2
assign (resid  22 and name n  and segid B) (resid  22 and name ca  and segid B)
       (resid  22 and name c and segid B) (resid  23 and name n  and segid B)     1.0 -20 50 2
! L23 
assign (resid  22 and name c  and segid B) (resid  23 and name n  and segid B)
       (resid  23 and name ca and segid B) (resid  23 and name c  and segid B)     1.0 -70 20 2
assign (resid  23 and name n  and segid B) (resid  23 and name ca  and segid B)
       (resid  23 and name c and segid B) (resid  24 and name n  and segid B)     1.0 135 30 2
! A24 
assign (resid  23 and name c  and segid B) (resid  24 and name n  and segid B)
       (resid  24 and name ca and segid B) (resid  24 and name c  and segid B)     1.0 -65 20 2
assign (resid  24 and name n  and segid B) (resid  24 and name ca  and segid B)
       (resid  24 and name c and segid B) (resid  25 and name n  and segid B)     1.0 140 20 2
! G25 
assign (resid  24 and name c  and segid B) (resid  25 and name n  and segid B)
       (resid  25 and name ca and segid B) (resid  25 and name c  and segid B)     1.0 90 20 2
assign (resid  25 and name n  and segid B) (resid  25 and name ca  and segid B)
       (resid  25 and name c and segid B) (resid  26 and name n  and segid B)     1.0 -20 20 2

! I26      
assign (resid  25 and name c  and segid B) (resid  26 and name n  and segid B)
       (resid  26 and name ca and segid B) (resid  26 and name c  and segid B)     1.0 -85 20 2
 
! E27
assign (resid  26 and name c  and segid B) (resid  27 and name n  and segid B)
       (resid  27 and name ca and segid B) (resid  27 and name c  and segid B)     1.0 -90 30 2
assign (resid  27 and name n  and segid B) (resid  27 and name ca  and segid B)
       (resid  27 and name c and segid B) (resid  28 and name n  and segid B)     1.0 170 50 2
 
! E28 
assign (resid  27 and name c  and segid B) (resid  28 and name n  and segid B)
       (resid  28 and name ca and segid B) (resid  28 and name c  and segid B)     1.0 -60 20 2
assign (resid  28 and name n  and segid B) (resid  28 and name ca  and segid B)
       (resid  28 and name c and segid B) (resid  29 and name n  and segid B)     1.0 -40 20 2
! V29 
assign (resid  28 and name c  and segid B) (resid  29 and name n  and segid B)
       (resid  29 and name ca and segid B) (resid  29 and name c  and segid B)     1.0 -60 20 2
assign (resid  29 and name n  and segid B) (resid  29 and name ca  and segid B)
       (resid  29 and name c and segid B) (resid  30 and name n  and segid B)     1.0 -40 20 2
! L30 
assign (resid  29 and name c  and segid B) (resid  30 and name n  and segid B)
       (resid  30 and name ca and segid B) (resid  30 and name c  and segid B)     1.0 -60 20 2
assign (resid  30 and name n  and segid B) (resid  30 and name ca  and segid B)
       (resid  30 and name c and segid B) (resid  31 and name n  and segid B)     1.0 -40 20 2
! G31 
assign (resid  30 and name c  and segid B) (resid  31 and name n  and segid B)
       (resid  31 and name ca and segid B) (resid  31 and name c  and segid B)     1.0 -60 20 2
assign (resid  31 and name n  and segid B) (resid  31 and name ca  and segid B)
       (resid  31 and name c and segid B) (resid  32 and name n  and segid B)     1.0 -40 20 2
! K32 
assign (resid  31 and name c  and segid B) (resid  32 and name n  and segid B)
       (resid  32 and name ca and segid B) (resid  32 and name c  and segid B)     1.0 -60 20 2
assign (resid  32 and name n  and segid B) (resid  32 and name ca  and segid B)
       (resid  32 and name c and segid B) (resid  33 and name n  and segid B)     1.0 -40 20 2
! K33 
assign (resid  32 and name c  and segid B) (resid  33 and name n  and segid B)
       (resid  33 and name ca and segid B) (resid  33 and name c  and segid B)     1.0 -60 20 2
assign (resid  33 and name n  and segid B) (resid  33 and name ca  and segid B)
       (resid  33 and name c and segid B) (resid  34 and name n  and segid B)     1.0 -40 20 2
! L34 
assign (resid  33 and name c  and segid B) (resid  34 and name n  and segid B)
       (resid  34 and name ca and segid B) (resid  34 and name c  and segid B)     1.0 -60 30 2
assign (resid  34 and name n  and segid B) (resid  34 and name ca  and segid B)
       (resid  34 and name c and segid B) (resid  35 and name n  and segid B)     1.0 -40 20 2
! E35 
assign (resid  34 and name c  and segid B) (resid  35 and name n  and segid B)
       (resid  35 and name ca and segid B) (resid  35 and name c  and segid B)     1.0 -60 20 2
assign (resid  35 and name n  and segid B) (resid  35 and name ca  and segid B)
       (resid  35 and name c and segid B) (resid  36 and name n  and segid B)     1.0 -40 20 2
! E36 
assign (resid  35 and name c  and segid B) (resid  36 and name n  and segid B)
       (resid  36 and name ca and segid B) (resid  36 and name c  and segid B)     1.0 -60 20 2
assign (resid  36 and name n  and segid B) (resid  36 and name ca  and segid B)
       (resid  36 and name c and segid B) (resid  37 and name n  and segid B)     1.0 -40 20 2
! R37 
assign (resid  36 and name c  and segid B) (resid  37 and name n  and segid B)
       (resid  37 and name ca and segid B) (resid  37 and name c  and segid B)     1.0 -80 20 2
assign (resid  37 and name n  and segid B) (resid  37 and name ca  and segid B)
       (resid  37 and name c and segid B) (resid  38 and name n  and segid B)     1.0 0 30 2
!G38
assign (resid  37 and name c  and segid B) (resid  38 and name n  and segid B)
       (resid  38 and name ca and segid B) (resid  38 and name c  and segid B)     1.0  100 30 2
assign (resid  38 and name n  and segid B) (resid  38 and name ca  and segid B)
       (resid  38 and name c and segid B) (resid  39 and name n  and segid B)     1.0 0 50 2
! F39 
assign (resid  38 and name c  and segid B) (resid  39 and name n  and segid B)
       (resid  39 and name ca and segid B) (resid  39 and name c  and segid B)     1.0 -85 45 2
assign (resid  39 and name n  and segid B) (resid  39 and name ca  and segid B)
       (resid  39 and name c and segid B) (resid  40 and name n  and segid B)     1.0  70 90 2
! D40 
assign (resid  39 and name c  and segid B) (resid  40 and name n  and segid B)
       (resid  40 and name ca and segid B) (resid  40 and name c  and segid B)     1.0 -80 20 2
assign (resid  40 and name n  and segid B) (resid  40 and name ca  and segid B)
       (resid  40 and name c and segid B) (resid  41 and name n  and segid B)     1.0 15 30 2
! K41 
assign (resid  40 and name c  and segid B) (resid  41 and name n  and segid B)
       (resid  41 and name ca and segid B) (resid  41 and name c  and segid B)     1.0 -140 20 2
assign (resid  41 and name n  and segid B) (resid  41 and name ca  and segid B)
       (resid  41 and name c and segid B) (resid  42 and name n  and segid B)     1.0 150 20 2
! A42 
assign (resid  41 and name c  and segid B) (resid  42 and name n  and segid B)
       (resid  42 and name ca and segid B) (resid  42 and name c  and segid B)     1.0 -60 20 2
assign (resid  42 and name n  and segid B) (resid  42 and name ca  and segid B)
       (resid  42 and name c and segid B) (resid  43 and name n  and segid B)     1.0 -40 20 2
! Y43 
assign (resid  42 and name c  and segid B) (resid  43 and name n  and segid B)
       (resid  43 and name ca and segid B) (resid  43 and name c  and segid B)     1.0 -60 20 2
assign (resid  43 and name n  and segid B) (resid  43 and name ca  and segid B)
       (resid  43 and name c and segid B) (resid  44 and name n  and segid B)     1.0 -40 20 2
! V44 
assign (resid  43 and name c  and segid B) (resid  44 and name n  and segid B)
       (resid  44 and name ca and segid B) (resid  44 and name c  and segid B)     1.0 -60 20 2
assign (resid  44 and name n  and segid B) (resid  44 and name ca  and segid B)
       (resid  44 and name c and segid B) (resid  45 and name n  and segid B)     1.0 -40 20 2
! V45 
assign (resid  44 and name c  and segid B) (resid  45 and name n  and segid B)
       (resid  45 and name ca and segid B) (resid  45 and name c  and segid B)     1.0 -60 20 2
assign (resid  45 and name n  and segid B) (resid  45 and name ca  and segid B)
       (resid  45 and name c and segid B) (resid  46 and name n  and segid B)     1.0 -40 20 2
! L46 
assign (resid  45 and name c  and segid B) (resid  46 and name n  and segid B)
       (resid  46 and name ca and segid B) (resid  46 and name c  and segid B)     1.0 -60 20 2
assign (resid  46 and name n  and segid B) (resid  46 and name ca  and segid B)
       (resid  46 and name c and segid B) (resid  47 and name n  and segid B)     1.0 -40 20 2
! G48
assign (resid  47 and name c  and segid B) (resid  48 and name n  and segid B)
       (resid  48 and name ca and segid B) (resid  48 and name c  and segid B)     1.0 -60 20 2
assign (resid  48 and name n  and segid B) (resid  48 and name ca  and segid B)
       (resid  48 and name c and segid B) (resid  49 and name n  and segid B)     1.0 -40 20 2
! F49 
assign (resid  48 and name c  and segid B) (resid  49 and name n  and segid B)
       (resid  49 and name ca and segid B) (resid  49 and name c  and segid B)     1.0 -60 20 2
assign (resid  49 and name n  and segid B) (resid  49 and name ca  and segid B)
       (resid  49 and name c and segid B) (resid  50 and name n  and segid B)     1.0 -40 20 2
! L50 
assign (resid  49 and name c  and segid B) (resid  50 and name n  and segid B)
       (resid  50 and name ca and segid B) (resid  50 and name c  and segid B)     1.0 -60 20 2
assign (resid  50 and name n  and segid B) (resid  50 and name ca  and segid B)
       (resid  50 and name c and segid B) (resid  51 and name n  and segid B)     1.0 -40 20 2
! V51 
assign (resid  50 and name c  and segid B) (resid  51 and name n  and segid B)
       (resid  51 and name ca and segid B) (resid  51 and name c  and segid B)     1.0 -60 20 2
assign (resid  51 and name n  and segid B) (resid  51 and name ca  and segid B)
       (resid  51 and name c and segid B) (resid  52 and name n  and segid B)     1.0 -40 20 2
! L52 
assign (resid  51 and name c  and segid B) (resid  52 and name n  and segid B)
       (resid  52 and name ca and segid B) (resid  52 and name c  and segid B)     1.0 -70 30 2
assign (resid  52 and name n  and segid B) (resid  52 and name ca  and segid B)
       (resid  52 and name c and segid B) (resid  53 and name n  and segid B)     1.0 0 50 2
! K53 
assign (resid  52 and name c  and segid B) (resid  53 and name n  and segid B)
       (resid  53 and name ca and segid B) (resid  53 and name c  and segid B)     1.0 40 20 2
assign (resid  53 and name n  and segid B) (resid  53 and name ca  and segid B)
       (resid  53 and name c and segid B) (resid  54 and name n  and segid B)     1.0  40 20 2
! K54 
assign (resid  53 and name c  and segid B) (resid  54 and name n  and segid B)
       (resid  54 and name ca and segid B) (resid  54 and name c  and segid B)     1.0 40 20 2
assign (resid  54 and name n  and segid B) (resid  54 and name ca  and segid B)
       (resid  54 and name c and segid B) (resid  55 and name n  and segid B)     1.0  40 20 2
! D55
assign (resid  54 and name c  and segid B) (resid  55 and name n  and segid B)
       (resid  55 and name ca and segid B) (resid  55 and name c  and segid B)     1.0 -60 30 2
! E56 
assign (resid  55 and name c  and segid B) (resid  56 and name n  and segid B)
       (resid  56 and name ca and segid B) (resid  56 and name c  and segid B)     1.0 -60 20 2
assign (resid  56 and name n  and segid B) (resid  56 and name ca  and segid B)
       (resid  56 and name c and segid B) (resid  57 and name n  and segid B)     1.0 -40 20 2
! D57  
assign (resid  56 and name c  and segid B) (resid  57 and name n  and segid B)
       (resid  57 and name ca and segid B) (resid  57 and name c  and segid B)     1.0 -60 20 2
assign (resid  57 and name n  and segid B) (resid  57 and name ca  and segid B)
       (resid  57 and name c and segid B) (resid  58 and name n  and segid B)     1.0 -40 20 2
! L58 
assign (resid  57 and name c  and segid B) (resid  58 and name n  and segid B)
       (resid  58 and name ca and segid B) (resid  58 and name c  and segid B)     1.0 -63 10 2
assign (resid  58 and name n  and segid B) (resid  58 and name ca  and segid B)
       (resid  58 and name c and segid B) (resid  59 and name n  and segid B)     1.0 -40 10 2
! F59 
assign (resid  58 and name c  and segid B) (resid  59 and name n  and segid B)
       (resid  59 and name ca and segid B) (resid  59 and name c  and segid B)     1.0 -60 20 2
assign (resid  59 and name n  and segid B) (resid  59 and name ca  and segid B)
       (resid  59 and name c and segid B) (resid  60 and name n  and segid B)     1.0 -40 20 2
! R60 
assign (resid  59 and name c  and segid B) (resid  60 and name n  and segid B)
       (resid  60 and name ca and segid B) (resid  60 and name c  and segid B)     1.0 -60 20 2
assign (resid  60 and name n  and segid B) (resid  60 and name ca  and segid B)
       (resid  60 and name c and segid B) (resid  61 and name n  and segid B)     1.0 -40 20 2
! E61 
assign (resid  60 and name c  and segid B) (resid  61 and name n  and segid B)
       (resid  61 and name ca and segid B) (resid  61 and name c  and segid B)     1.0 -60 20 2
assign (resid  61 and name n  and segid B) (resid  61 and name ca  and segid B)
       (resid  61 and name c and segid B) (resid  62 and name n  and segid B)     1.0 -40 20 2
! W62 
assign (resid  61 and name c  and segid B) (resid  62 and name n  and segid B)
       (resid  62 and name ca and segid B) (resid  62 and name c  and segid B)     1.0 -60 20 2
assign (resid  62 and name n  and segid B) (resid  62 and name ca  and segid B)
       (resid  62 and name c and segid B) (resid  63 and name n  and segid B)     1.0 -40 20 2
! L63 
assign (resid  62 and name c  and segid B) (resid  63 and name n  and segid B)
       (resid  63 and name ca and segid B) (resid  63 and name c  and segid B)     1.0 -60 20 2
assign (resid  63 and name n  and segid B) (resid  63 and name ca  and segid B)
       (resid  63 and name c and segid B) (resid  64 and name n  and segid B)     1.0 -40 20 2
! K64 
assign (resid  63 and name c  and segid B) (resid  64 and name n  and segid B)
       (resid  64 and name ca and segid B) (resid  64 and name c  and segid B)     1.0 -60 20 2
assign (resid  64 and name n  and segid B) (resid  64 and name ca  and segid B)
       (resid  64 and name c and segid B) (resid  65 and name n  and segid B)     1.0 -40 20 2
! D65 
assign (resid  64 and name c  and segid B) (resid  65 and name n  and segid B)
       (resid  65 and name ca and segid B) (resid  65 and name c  and segid B)     1.0 -60 20 2
assign (resid  65 and name n  and segid B) (resid  65 and name ca  and segid B)
       (resid  65 and name c and segid B) (resid  66 and name n  and segid B)     1.0 -40 20 2
! T66 
assign (resid  65 and name c  and segid B) (resid  66 and name n  and segid B)
       (resid  66 and name ca and segid B) (resid  66 and name c  and segid B)     1.0 -60 20 2
assign (resid  66 and name n  and segid B) (resid  66 and name ca  and segid B)
       (resid  66 and name c and segid B) (resid  67 and name n  and segid B)     1.0 -40 20 2
! C67 
assign (resid  66 and name c  and segid B) (resid  67 and name n  and segid B)
       (resid  67 and name ca and segid B) (resid  67 and name c  and segid B)     1.0 -120 50 2
assign (resid  67 and name n  and segid B) (resid  67 and name ca  and segid B)
       (resid  67 and name c and segid B) (resid  68 and name n  and segid B)     1.0  0 60 2
! G68
assign (resid  67 and name c  and segid B) (resid  68 and name n  and segid B)
       (resid  68 and name ca and segid B) (resid  68 and name c  and segid B)     1.0 100 30 2
assign (resid  68 and name n  and segid B) (resid  68 and name ca  and segid B)
       (resid  68 and name c and segid B) (resid  69 and name n  and segid B)     1.0  15 40 2
! A69  
assign (resid  68 and name c  and segid B) (resid  69 and name n  and segid B)
       (resid  69 and name ca and segid B) (resid  69 and name c  and segid B)     1.0 -50 20 2
! N70 
assign (resid  69 and name c  and segid B) (resid  70 and name n  and segid B)
       (resid  70 and name ca and segid B) (resid  70 and name c  and segid B)     1.0 -95 40 2
assign (resid  70 and name n  and segid B) (resid  70 and name ca  and segid B)
       (resid  70 and name c and segid B) (resid  71 and name n  and segid B)     1.0  160 30 2
! A71 
assign (resid  70 and name c  and segid B) (resid  71 and name n  and segid B)
       (resid  71 and name ca and segid B) (resid  71 and name c  and segid B)     1.0 -60 20 2
assign (resid  71 and name n  and segid B) (resid  71 and name ca  and segid B)
       (resid  71 and name c and segid B) (resid  72 and name n  and segid B)     1.0 -40 20 2
! K72 
assign (resid  71 and name c  and segid B) (resid  72 and name n  and segid B)
       (resid  72 and name ca and segid B) (resid  72 and name c  and segid B)     1.0 -60 20 2
assign (resid  72 and name n  and segid B) (resid  72 and name ca  and segid B)
       (resid  72 and name c and segid B) (resid  73 and name n  and segid B)     1.0 -40 20 2
! Q73 
assign (resid  72 and name c  and segid B) (resid  73 and name n  and segid B)
       (resid  73 and name ca and segid B) (resid  73 and name c  and segid B)     1.0 -60 20 2
assign (resid  73 and name n  and segid B) (resid  73 and name ca  and segid B)
       (resid  73 and name c and segid B) (resid  74 and name n  and segid B)     1.0 -40 20 2
! S74 
assign (resid  73 and name c  and segid B) (resid  74 and name n  and segid B)
       (resid  74 and name ca and segid B) (resid  74 and name c  and segid B)     1.0 -60 20 2
assign (resid  74 and name n  and segid B) (resid  74 and name ca  and segid B)
       (resid  74 and name c and segid B) (resid  75 and name n  and segid B)     1.0 -40 20 2
! R75 
assign (resid  74 and name c  and segid B) (resid  75 and name n  and segid B)
       (resid  75 and name ca and segid B) (resid  75 and name c  and segid B)     1.0 -60 20 2
assign (resid  75 and name n  and segid B) (resid  75 and name ca  and segid B)
       (resid  75 and name c and segid B) (resid  76 and name n  and segid B)     1.0 -40 20 2
! D76 
assign (resid  75 and name c  and segid B) (resid  76 and name n  and segid B)
       (resid  76 and name ca and segid B) (resid  76 and name c  and segid B)     1.0 -60 20 2
assign (resid  76 and name n  and segid B) (resid  76 and name ca  and segid B)
       (resid  76 and name c and segid B) (resid  77 and name n  and segid B)     1.0 -40 20 2
! C77 
assign (resid  76 and name c  and segid B) (resid  77 and name n  and segid B)
       (resid  77 and name ca and segid B) (resid  77 and name c  and segid B)     1.0 -60 20 2
assign (resid  77 and name n  and segid B) (resid  77 and name ca  and segid B)
       (resid  77 and name c and segid B) (resid  78 and name n  and segid B)     1.0 -40 20 2
! F78
assign (resid  78 and name c  and segid B) (resid  79 and name n  and segid B)
       (resid  79 and name ca and segid B) (resid  79 and name c  and segid B)     1.0 -60 20 2
assign (resid  79 and name n  and segid B) (resid  79 and name ca  and segid B)
       (resid  79 and name c and segid B) (resid  80 and name n  and segid B)     1.0 -40 20 2
! C80 
assign (resid  79 and name c  and segid B) (resid  80 and name n  and segid B)
       (resid  80 and name ca and segid B) (resid  80 and name c  and segid B)     1.0 -60 20 2
assign (resid  80 and name n  and segid B) (resid  80 and name ca  and segid B)
       (resid  80 and name c and segid B) (resid  81 and name n  and segid B)     1.0 -40 20 2
! L81 
assign (resid  80 and name c  and segid B) (resid  81 and name n  and segid B)
       (resid  81 and name ca and segid B) (resid  81 and name c  and segid B)     1.0 -60 20 2
assign (resid  81 and name n  and segid B) (resid  81 and name ca  and segid B)
       (resid  81 and name c and segid B) (resid  82 and name n  and segid B)     1.0 -40 20 2
! R82 
assign (resid  81 and name c  and segid B) (resid  82 and name n  and segid B)
       (resid  82 and name ca and segid B) (resid  82 and name c  and segid B)     1.0 -60 20 2
assign (resid  82 and name n  and segid B) (resid  82 and name ca  and segid B)
       (resid  82 and name c and segid B) (resid  83 and name n  and segid B)     1.0 -40 20 2
! E83 
assign (resid  82 and name c  and segid B) (resid  83 and name n  and segid B)
       (resid  83 and name ca and segid B) (resid  83 and name c  and segid B)     1.0 -60 20 2
assign (resid  83 and name n  and segid B) (resid  83 and name ca  and segid B)
       (resid  83 and name c and segid B) (resid  84 and name n  and segid B)     1.0 -40 20 2
! W84 
assign (resid  83 and name c  and segid B) (resid  84 and name n  and segid B)
       (resid  84 and name ca and segid B) (resid  84 and name c  and segid B)     1.0 -60 20 2
assign (resid  84 and name n  and segid B) (resid  84 and name ca  and segid B)
       (resid  84 and name c and segid B) (resid  85 and name n  and segid B)     1.0 -40 20 2
! C85 
assign (resid  84 and name c  and segid B) (resid  85 and name n  and segid B)
       (resid  85 and name ca and segid B) (resid  85 and name c  and segid B)     1.0 -60 20 2
assign (resid  85 and name n  and segid B) (resid  85 and name ca  and segid B)
       (resid  85 and name c and segid B) (resid  86 and name n  and segid B)     1.0 -40 20 2
! D86 
assign (resid  85 and name c  and segid B) (resid  86 and name n  and segid B)
       (resid  86 and name ca and segid B) (resid  86 and name c  and segid B)     1.0 -60 20 2
assign (resid  86 and name n  and segid B) (resid  86 and name ca  and segid B)
       (resid  86 and name c and segid B) (resid  87 and name n  and segid B)     1.0 -40 20 2
! A87 
assign (resid  86 and name c  and segid B) (resid  87 and name n  and segid B)
       (resid  87 and name ca and segid B) (resid  87 and name c  and segid B)     1.0 -75 20 2
assign (resid  87 and name n  and segid B) (resid  87 and name ca  and segid B)
       (resid  87 and name c and segid B) (resid  88 and name n  and segid B)     1.0 -40 20 2
! F88 
assign (resid  87 and name c  and segid B) (resid  88 and name n  and segid B)
       (resid  88 and name ca and segid B) (resid  88 and name c  and segid B)     1.0 -80 35 2
assign (resid  88 and name n  and segid B) (resid  88 and name ca  and segid B)
       (resid  88 and name c and segid B) (resid  89 and name n  and segid B)     1.0 -30 65 2
! L89  


!!T3
ASSIGN (RESID 3  AND NAME N   and segid A) (RESID 3  AND NAME CA  and segid A)
      (RESID 3 AND NAME CB  and segid A) (RESID 3   AND NAME OG1 and segid A) 1.0 60.0 20.0 2


!! K6
ASSIGN (RESID 6  AND NAME N   and segid A) (RESID 6  AND NAME CA  and segid A)
      (RESID 6 AND NAME CB  and segid A) (RESID 6   AND NAME CG and segid A) 1.0 -60.0 20.0 2
!! H7
ASSIGN (RESID 7  AND NAME N   and segid A) (RESID 7  AND NAME CA  and segid A)
      (RESID 7 AND NAME CB  and segid A) (RESID 7   AND NAME CG and segid A) 1.0 180.0 20.0 2
 
!!R8
ASSIGN (RESID 8  AND NAME N   and segid A) (RESID 8  AND NAME CA  and segid A)
      (RESID 8 AND NAME CB  and segid A) (RESID 8   AND NAME CG and segid A) 1.0 -60.0 20.0 2


!!D9
ASSIGN (RESID 9  AND NAME N   and segid A) (RESID 9 AND NAME CA  and segid A)
      (RESID 9 AND NAME CB  and segid A) (RESID 9 AND NAME CG and segid A) 1.0  -60.0 20.0 2
ASSIGN (RESID 9  AND NAME CA   and segid A) (RESID 9 AND NAME CB  and segid A)
      (RESID 9 AND NAME CG  and segid A) (RESID 9 AND NAME OD1 and segid A) 1.0 0.0 90.0 2

!!F10
ASSIGN (RESID 10  AND NAME N   and segid A) (RESID 10 AND NAME CA  and segid A)
      (RESID 10 AND NAME CB  and segid A) (RESID 10 AND NAME CG and segid A) 1.0  180.0 20.0 2
aSSIGN (RESID 10  AND NAME CA   and segid A) (RESID 10 AND NAME CB  and segid A)
      (RESID 10 AND NAME CG  and segid A) (RESID 10 AND NAME CD1 and segid A) 1.0 90.0 30.0 2

!!V11
ASSIGN (RESID 11  AND NAME N   and segid A) (RESID 11 AND NAME CA  and segid A)
      (RESID 11 AND NAME CB  and segid A) (RESID 11 AND NAME CG1 and segid A) 1.0  -60.0 20.0 2

!!E13
ASSIGN (RESID 13  AND NAME N   and segid A) (RESID 13 AND NAME CA  and segid A)
      (RESID 13 AND NAME CB  and segid A) (RESID 13 AND NAME CG and segid A) 1.0  60.0 20.0 2
ASSIGN (RESID 13  AND NAME CB   and segid A) (RESID 13 AND NAME CG  and segid A)
      (RESID 13 AND NAME CD  and segid A) (RESID 13 AND NAME OE1 and segid A) 1.0 0.0 90.0 2

!!P14
ASSIGN (RESID 14  AND NAME N   and segid A) (RESID 14 AND NAME CA  and segid A)
      (RESID 14 AND NAME CB  and segid A) (RESID 14 AND NAME CG and segid A) 1.0 -30.0 20.0 2
!!M15
ASSIGN (RESID 15  AND NAME N   and segid A) (RESID 15 AND NAME CA  and segid A)
      (RESID 15 AND NAME CB  and segid A) (RESID 15 AND NAME CG and segid A) 1.0 60.0 20.0 2
aSSIGN (RESID 15  AND NAME CA   and segid A) (RESID 15 AND NAME CB  and segid A)
      (RESID 15 AND NAME CG  and segid A) (RESID 15 AND NAME SD and segid A) 1.0 180 20.0 2

!!E17
ASSIGN (RESID 17  AND NAME N   and segid A) (RESID 17 AND NAME CA  and segid A)
      (RESID 17 AND NAME CB  and segid A) (RESID 17 AND NAME CG and segid A) 1.0  -60.0 20.0 2
assign (RESID 17 AND NAME CA  and segid A) (RESID 17 AND NAME CB  and segid A)
      (RESID 17 AND NAME CG and segid A)  (RESID 17 AND NAME CD  and segid A) 1.0  180 20.0 2
ASSIGN (RESID 17  AND NAME CB   and segid A) (RESID 17 AND NAME CG  and segid A)
      (RESID 17 AND NAME CD  and segid A) (RESID 17 AND NAME OE1 and segid A) 1.0 0.0 90.0 2


!!K18
ASSIGN (RESID 18  AND NAME N   and segid A) (RESID 18 AND NAME CA  and segid A)
      (RESID 18 AND NAME CB  and segid A) (RESID 18 AND NAME CG and segid A) 1.0  -60.0 20.0 2
!!P19
ASSIGN (RESID 19  AND NAME N   and segid A) (RESID 19 AND NAME CA  and segid A)
      (RESID 19 AND NAME CB  and segid A) (RESID 19 AND NAME CG and segid A) 1.0 30.0 20.0 2
!!V20
ASSIGN (RESID 20  AND NAME N   and segid A) (RESID 20 AND NAME CA  and segid A)
      (RESID 20 AND NAME CB  and segid A) (RESID 20 AND NAME CG1 and segid A) 1.0  60.0 20.0 2

!! L23
ASSIGN (RESID 23  AND NAME N   and segid A) (RESID 23 AND NAME CA  and segid A)
      (RESID 23 AND NAME CB  and segid A) (RESID 23 AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 23  AND NAME CA   and segid A) (RESID 23 AND NAME CB  and segid A)
      (RESID 23 AND NAME CG  and segid A) (RESID 23 AND NAME CD1 and segid A) 1.0 180.0 20.0 2

!! I26  
ASSIGN (RESID 26 AND NAME N   and segid A) (RESID 26 and NAME CA  and segid A)
      (RESID 26 and NAME CB  and segid A) (RESID 26 and NAME CG1 and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 26 AND NAME CA   and segid A) (RESID 26 and NAME CB  and segid A)
      (RESID 26 and NAME CG1  and segid A) (RESID 26 and NAME CD1 and segid A) 1.0 -60.0 20.0 2

!E28
ASSIGN (RESID 28  AND NAME N   and segid A) (RESID 28 AND NAME CA  and segid A)
      (RESID 28 AND NAME CB  and segid A) (RESID 28 AND NAME CG and segid A) 1.0  -60.0 20.0 2
ASSIGN (RESID 28  AND NAME CB   and segid A) (RESID 28 AND NAME CG  and segid A)
      (RESID 28 AND NAME CD  and segid A) (RESID 28 AND NAME OE1 and segid A) 1.0 0.0 90.0 2


!! V29
ASSIGN (RESID 29  AND NAME N   and segid A) (RESID 29 AND NAME CA  and segid A)
      (RESID 29 AND NAME CB  and segid A) (RESID 29 AND NAME CG1 and segid A) 1.0 180.0 20.0 2

!! L30
ASSIGN (RESID 30  AND NAME N   and segid A) (RESID 30 AND NAME CA  and segid A)
      (RESID 30 AND NAME CB  and segid A) (RESID 30 AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 30  AND NAME CA   and segid A) (RESID 30 AND NAME CB  and segid A)
      (RESID 30 AND NAME CG  and segid A) (RESID 30 AND NAME CD1 and segid A) 1.0 180.0 20.0 2

!!K33
ASSIGN (RESID 33  AND NAME N   and segid A) (RESID 33 AND NAME CA  and segid A)
      (RESID 33 AND NAME CB  and segid A) (RESID 33 AND NAME CG and segid A) 1.0 -60.0 20.0 2

!! L34
ASSIGN (RESID 34  AND NAME N   and segid A) (RESID 34 AND NAME CA  and segid A)
      (RESID 34 AND NAME CB  and segid A) (RESID 34 AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 34  AND NAME CA   and segid A) (RESID 34 AND NAME CB  and segid A)
      (RESID 34 AND NAME CG  and segid A) (RESID 34 AND NAME CD1 and segid A) 1.0 180.0 20.0 2
!!R37
ASSIGN (RESID 37  AND NAME N   and segid A) (RESID 37 AND NAME CA  and segid A)
      (RESID 37 AND NAME CB  and segid A) (RESID 37 AND NAME CG and segid A) 1.0  -60.0 20.0 2

!!F39
ASSIGN (RESID 39  AND NAME N   and segid A) (RESID 39 AND NAME CA  and segid A)
      (RESID 39 AND NAME CB  and segid A) (RESID 39 AND NAME CG and segid A) 1.0  -60.0 20.0 2
assign (resid 39 and name ca and segid A) (resid 39 and name cb and segid A)
       (resid 39 and name cg and segid A) (resid 39 and name cd1 and segid A) 1.0 90.0 30.0 2
!!D40
ASSIGN (RESID 40  AND NAME N   and segid A) (RESID 40 AND NAME CA  and segid A)
      (RESID 40 AND NAME CB  and segid A) (RESID 40 AND NAME CG and segid A) 1.0  60.0 20.0 2
ASSIGN (RESID 40  AND NAME CA   and segid A) (RESID 40 AND NAME CB  and segid A)
      (RESID 40 AND NAME CG  and segid A) (RESID 40 AND NAME OD1 and segid A) 1.0 0.0 90.0 2

!!K41
ASSIGN (RESID 41  AND NAME N   and segid A) (RESID 41 AND NAME CA  and segid A)
      (RESID 41 AND NAME CB  and segid A) (RESID 41 AND NAME CG and segid A) 1.0  -60.0 20.0 2

!!Y43
ASSIGN (RESID 43  AND NAME N   and segid A) (RESID 43 AND NAME CA  and segid A)
      (RESID 43 AND NAME CB  and segid A) (RESID 43 AND NAME CG and segid A) 1.0 60.0 20.0 2
ASSIGN (RESID 43  AND NAME CA   and segid A) (RESID 43 AND NAME CB  and segid A)
      (RESID 43 AND NAME CG  and segid A) (RESID 43 AND NAME CD1 and segid A) 1.0 90 20.0 2

!!V44
ASSIGN (RESID 44  AND NAME N   and segid A) (RESID 44 AND NAME CA  and segid A)
      (RESID 44 AND NAME CB  and segid A) (RESID 44 AND NAME CG1 and segid A) 1.0 180.0 20.0 2

!!V45
ASSIGN (RESID 45  AND NAME N   and segid A) (RESID 45 AND NAME CA  and segid A)
      (RESID 45 AND NAME CB  and segid A) (RESID 45 AND NAME CG1 and segid A) 1.0 180.0 20.0 2

!!L46
ASSIGN (RESID 46  AND NAME N   and segid A) (RESID 46 AND NAME CA  and segid A)
      (RESID 46 AND NAME CB  and segid A) (RESID 46 AND NAME CG and segid A) 1.0 180.0 20.0 2
ASSIGN (RESID 46  AND NAME CA   and segid A) (RESID 46 AND NAME CB  and segid A)
      (RESID 46 AND NAME CG  and segid A) (RESID 46 AND NAME CD1 and segid A) 1.0 60.0 20.0 2
 

!!Q48
assign (resid 48 and name n and segid A) (resid 48 and name ca and segid A)
       (resid 48 and name cb and segid A) (resid 48 and name cg and segid A) 1.0 180.0 20.0 2
assign (resid 48 and name ca and segid A) (resid 48 and name cb and segid A)
       (resid 48 and name cg and segid A) (resid 48 and name oe1 and segid A) 1.0 60.0 30.0 2

!!F49
ASSIGN (RESID 49  AND NAME N   and segid A) (RESID 49 AND NAME CA  and segid A)
      (RESID 49 AND NAME CB  and segid A) (RESID 49 AND NAME CG and segid A) 1.0 180.0 20.0 2
ASSIGN (RESID 49  AND NAME CA   and segid A) (RESID 49 AND NAME CB  and segid A)
      (RESID 49 AND NAME CG  and segid A) (RESID 49 AND NAME CD1 and segid A) 1.0 90.0 30.0 2

!!L50
ASSIGN (RESID 50  AND NAME N   and segid A) (RESID 50 AND NAME CA  and segid A)
      (RESID 50 AND NAME CB  and segid A) (RESID 50 AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 50  AND NAME CA   and segid A) (RESID 50 AND NAME CB  and segid A)
      (RESID 50 AND NAME CG  and segid A) (RESID 50 AND NAME CD1 and segid A) 1.0  180.0 20.0 2

!!V51
ASSIGN (RESID 51  AND NAME N   and segid A) (RESID 51 AND NAME CA  and segid A)
      (RESID 51 AND NAME CB  and segid A) (RESID 51 AND NAME CG1 and segid A) 1.0 180.0 20.0 2


!!L52
ASSIGN (RESID 52  AND NAME N   and segid A) (RESID 52 AND NAME CA  and segid A)
      (RESID 52 AND NAME CB  and segid A) (RESID 52 AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 52  AND NAME CA   and segid A) (RESID 52 AND NAME CB  and segid A)
      (RESID 52 AND NAME CG  and segid A) (RESID 52 AND NAME CD1 and segid A) 1.0 180.0 20.0 2

!!K53
ASSIGN (RESID 53  AND NAME N   and segid A) (RESID 53 AND NAME CA  and segid A)
      (RESID 53 AND NAME CB  and segid A) (RESID 53 AND NAME CG and segid A) 1.0 -60.0 20.0 2
!!K54
ASSIGN (RESID 54  AND NAME N   and segid A) (RESID 54 AND NAME CA  and segid A)
      (RESID 54 AND NAME CB  and segid A) (RESID 54 AND NAME CG and segid A) 1.0 0.0 80.0 2

!D55
assign (resid 55 and name ca and segid A) (resid 55 and name cb and segid A)
       (resid 55 and name cg and segid A) (resid 55 and name od1 and segid A) 1.0 -60 20.0 2
!!E56
ASSIGN (RESID 56  AND NAME N   and segid A) (RESID 56 AND NAME CA  and segid A)
      (RESID 56 AND NAME CB  and segid A) (RESID 56 AND NAME CG and segid A) 1.0  180.0 20.0 2
ASSIGN (RESID 56  AND NAME CB   and segid A) (RESID 56 AND NAME CG  and segid A)
      (RESID 56 AND NAME CD  and segid A) (RESID 56 AND NAME OE1 and segid A) 1.0 0.0 90.0 2


!D57
assign (resid 57 and name n and segid A) (resid 57 and name ca and segid A)
       (resid 57 and name cb and segid A) (resid 57 and name cg and segid A) 1.0 -60.0 20.0 2
assign (resid 57 and name ca and segid A) (resid 57 and name cb and segid A)
       (resid 57 and name cg and segid A) (resid 57 and name od1 and segid A) 1.0 0.0 90.0 2

!!L58
ASSIGN (RESID 58  AND NAME N   and segid A) (RESID 58 AND NAME CA  and segid A)
      (RESID 58 AND NAME CB  and segid A) (RESID 58 AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 58  AND NAME CA   and segid A) (RESID 58 AND NAME CB  and segid A)
      (RESID 58 AND NAME CG  and segid A) (RESID 58 AND NAME CD1 and segid A) 1.0 180.0 20.0 2
!!F59
ASSIGN (RESID 59  AND NAME N   and segid A) (RESID 59 AND NAME CA  and segid A)
      (RESID 59 AND NAME CB  and segid A) (RESID 59 AND NAME CG and segid A) 1.0 180.0 20.0 2
ASSIGN (RESID 59  AND NAME CA   and segid A) (RESID 59 AND NAME CB  and segid A)
      (RESID 59 AND NAME CG  and segid A) (RESID 59 AND NAME CD1 and segid A) 1.0 90.0 30.0 2

!!R60
ASSIGN (RESID 60  AND NAME N   and segid A) (RESID 60 AND NAME CA  and segid A)
      (RESID 60 AND NAME CB  and segid A) (RESID 60 AND NAME CG and segid A) 1.0   -60 20.0 2

!!W62
ASSIGN (RESID 62  AND NAME N   and segid A) (RESID 62 AND NAME CA  and segid A)
      (RESID 62 AND NAME CB  and segid A) (RESID 62 AND NAME CG and segid A) 1.0 180.0 20.0 2
ASSIGN (RESID 62  AND NAME ca   and segid A) (RESID 62 AND NAME Cb  and segid A)
     (RESID 62 AND NAME Cg  and segid A) (RESID 62 AND NAME CD1 and segid A) 1.0  90.0 30.0 2
!!L63
ASSIGN (RESID 63  AND NAME N   and segid A) (RESID 63 AND NAME CA  and segid A)
      (RESID 63 AND NAME CB  and segid A) (RESID 63 AND NAME CG and segid A) 1.0 180.0 20.0 2
ASSIGN (RESID 63  AND NAME ca   and segid A) (RESID 63 AND NAME Cb  and segid A)
     (RESID 63 AND NAME Cg  and segid A) (RESID 63 AND NAME CD1 and segid A) 1.0  60.0 20.0 2

!!K64
ASSIGN (RESID 64  AND NAME N   and segid A) (RESID 64 AND NAME CA  and segid A)
      (RESID 64 AND NAME CB  and segid A) (RESID 64 AND NAME CG and segid A) 1.0 180.0 20.0 2
!!D65
assign (resid 65 and name ca and segid A) (resid 65 and name cb and segid A)
       (resid 65 and name cg and segid A) (resid 65 and name od1 and segid A) 1.0 -60 20.0 2

!!T66
ASSIGN (RESID 66  AND NAME N   and segid A) (RESID 66 AND NAME CA  and segid A)
      (RESID 66 AND NAME CB  and segid A) (RESID 66 AND NAME OG1 and segid A) 1.0 -60.0 20.0 2


!!C67
ASSIGN (RESID 67  AND NAME N   and segid A) (RESID 67 AND NAME CA  and segid A)
      (RESID 67 AND NAME CB  and segid A) (RESID 67 AND NAME SG and segid A) 1.0  60.0 20.0 2


!!Q73
ASSIGN (RESID 73  AND NAME N   and segid A) (RESID 73 AND NAME CA  and segid A)
      (RESID 73 AND NAME CB  and segid A) (RESID 73 AND NAME CG and segid A) 1.0 -60.0 20.0 2

!!R75
ASSIGN (RESID 75  AND NAME N   and segid A) (RESID 75 AND NAME CA  and segid A)
      (RESID 75 AND NAME CB  and segid A) (RESID 75 AND NAME CG and segid A) 1.0 -60.0 20.0 2

!!D76
ASSIGN (RESID 76  AND NAME N   and segid A) (RESID 76 AND NAME CA  and segid A)
      (RESID 76 AND NAME CB  and segid A) (RESID 76 AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 76  AND NAME CA   and segid A) (RESID 76 AND NAME CB  and segid A)
      (RESID 76 AND NAME CG  and segid A) (RESID 76 AND NAME OD1 and segid A) 1.0 0.0 90.0 2

!!C77
ASSIGN (RESID 77  AND NAME N   and segid A) (RESID 77 AND NAME CA  and segid A)
      (RESID 77 AND NAME CB  and segid A) (RESID 77 AND NAME SG and segid A) 1.0  -60.0 20.0 2


!!F78
ASSIGN (RESID 78  AND NAME N   and segid A) (RESID 78 AND NAME CA  and segid A)
      (RESID 78 AND NAME CB  and segid A) (RESID 78 AND NAME CG and segid A) 1.0 180.0 20.0 2
ASSIGN (RESID 78  AND NAME CA   and segid A) (RESID 78 AND NAME CB  and segid A)
      (RESID 78 AND NAME CG  and segid A) (RESID 78 AND NAME CD1 and segid A) 1.0 90.0 30.0 2

!!C80
ASSIGN (RESID 80  AND NAME N   and segid A) (RESID 80 AND NAME CA  and segid A)
      (RESID 80 AND NAME CB  and segid A) (RESID 80 AND NAME SG and segid A) 1.0 180.0 20.0 2

!! L81
ASSIGN (RESID 81 AND NAME N   and segid A) (RESID 81 AND NAME CA  and segid A)
      (RESID 81 and NAME CB  and segid A) (RESID 81  AND NAME CG and segid A) 1.0 -60.0 20.0 2
ASSIGN (RESID 81 AND NAME CA   and segid A) (RESID 81 and NAME CB  and segid A)
      (RESID 81 and NAME CG  and segid A) (RESID 81 and NAME CD1 and segid A) 1.0  180.0 20.0 2

!!R82
ASSIGN (RESID 82  AND NAME N   and segid A) (RESID 82 AND NAME CA  and segid A)
      (RESID 82 AND NAME CB  and segid A) (RESID 82 AND NAME CG and segid A) 1.0 180.0 20.0 2

!!E83
ASSIGN (RESID 83  AND NAME N   and segid A) (RESID 83 AND NAME CA  and segid A)
      (RESID 83 AND NAME CB  and segid A) (RESID 83 AND NAME CG and segid A) 1.0  -60.0 20.0 2
ASSIGN (RESID 83  AND NAME CB   and segid A) (RESID 83 AND NAME CG  and segid A)
      (RESID 83 AND NAME CD  and segid A) (RESID 83 AND NAME OE1 and segid A) 1.0 0.0 90.0 2


!!W84
ASSIGN (RESID 84  AND NAME N   and segid A) (RESID 84 AND NAME CA  and segid A)
      (RESID 84 AND NAME CB  and segid A) (RESID 84 AND NAME CG and segid A) 1.0  180.0 20.0 2
ASSIGN (RESID 84  AND NAME ca   and segid A) (RESID 84 AND NAME Cb  and segid A)
     (RESID 84 AND NAME Cg  and segid A) (RESID 84 AND NAME CD1 and segid A) 1.0  90.0 30.0 2
!!C85
ASSIGN (RESID 85  AND NAME N   and segid A) (RESID 85 AND NAME CA  and segid A)
      (RESID 85 AND NAME CB  and segid A) (RESID 85 AND NAME SG and segid A) 1.0 -60.0 20.0 2

!!D86
ASSIGN (RESID 86  AND NAME N   and segid A) (RESID 86 AND NAME CA  and segid A)
      (RESID 86 AND NAME CB  and segid A) (RESID 86 AND NAME CG and segid A) 1.0  -60.0 20.0 2
ASSIGN (RESID 86  AND NAME CA   and segid A) (RESID 86 AND NAME CB  and segid A)
      (RESID 86 AND NAME CG  and segid A) (RESID 86 AND NAME OD1 and segid A) 1.0 0.0 90.0 2

!!F88
ASSIGN (RESID 88  AND NAME N   and segid A) (RESID 88 AND NAME CA  and segid A)
      (RESID 88 AND NAME CB  and segid A) (RESID 88 AND NAME CG and segid A) 1.0  -60.0 20.0 2
ASSIGN (RESID 88  AND NAME ca   and segid A) (RESID 88 AND NAME Cb  and segid A)
      (RESID 88 AND NAME Cg  and segid A) (RESID 88 AND NAME Cd1 and segid A) 1.0  90.0 30.0 2

!L89
ASSIGN (RESID 89  AND NAME N   and segid A) (RESID 89 AND NAME CA  and segid A)
      (RESID 89 AND NAME CB  and segid A) (RESID 89 AND NAME CG and segid A) 1.0  180.0 20.0 2
ASSIGN (RESID 89  AND NAME ca   and segid A) (RESID 89 AND NAME Cb  and segid A)
      (RESID 89 AND NAME Cg  and segid A) (RESID 89 AND NAME Cd1 and segid A) 1.0  60.0 20.0 2







!!T3
ASSIGN (RESID 3  AND NAME N   and segid B) (RESID 3  AND NAME CA  and segid B)
      (RESID 3 AND NAME CB  and segid B) (RESID 3   AND NAME OG1 and segid B) 1.0 60.0 20.0 2


!! K6
ASSIGN (RESID 6  AND NAME N   and segid B) (RESID 6  AND NAME CA  and segid B)
      (RESID 6 AND NAME CB  and segid B) (RESID 6   AND NAME CG and segid B) 1.0 -60.0 20.0 2
!! H7
ASSIGN (RESID 7  AND NAME N   and segid B) (RESID 7  AND NAME CA  and segid B)
      (RESID 7 AND NAME CB  and segid B) (RESID 7   AND NAME CG and segid B) 1.0 180.0 20.0 2
 
!!R8
ASSIGN (RESID 8  AND NAME N   and segid B) (RESID 8  AND NAME CA  and segid B)
      (RESID 8 AND NAME CB  and segid B) (RESID 8   AND NAME CG and segid B) 1.0 -60.0 20.0 2


!!D9
ASSIGN (RESID 9  AND NAME N   and segid B) (RESID 9 AND NAME CA  and segid B)
      (RESID 9 AND NAME CB  and segid B) (RESID 9 AND NAME CG and segid B) 1.0  -60.0 20.0 2
ASSIGN (RESID 9  AND NAME CA   and segid B) (RESID 9 AND NAME CB  and segid B)
      (RESID 9 AND NAME CG  and segid B) (RESID 9 AND NAME OD1 and segid B) 1.0 0.0 90.0 2

!!F10
ASSIGN (RESID 10  AND NAME N   and segid B) (RESID 10 AND NAME CA  and segid B)
      (RESID 10 AND NAME CB  and segid B) (RESID 10 AND NAME CG and segid B) 1.0  180.0 20.0 2
aSSIGN (RESID 10  AND NAME CA   and segid B) (RESID 10 AND NAME CB  and segid B)
      (RESID 10 AND NAME CG  and segid B) (RESID 10 AND NAME CD1 and segid B) 1.0 90.0 30.0 2

!!V11
ASSIGN (RESID 11  AND NAME N   and segid B) (RESID 11 AND NAME CA  and segid B)
      (RESID 11 AND NAME CB  and segid B) (RESID 11 AND NAME CG1 and segid B) 1.0  -60.0 20.0 2

!!E13
ASSIGN (RESID 13  AND NAME N   and segid B) (RESID 13 AND NAME CA  and segid B)
      (RESID 13 AND NAME CB  and segid B) (RESID 13 AND NAME CG and segid B) 1.0  60.0 20.0 2
ASSIGN (RESID 13  AND NAME CB   and segid B) (RESID 13 AND NAME CG  and segid B)
      (RESID 13 AND NAME CD  and segid B) (RESID 13 AND NAME OE1 and segid B) 1.0 0.0 90.0 2

!!P14
ASSIGN (RESID 14  AND NAME N   and segid B) (RESID 14 AND NAME CA  and segid B)
      (RESID 14 AND NAME CB  and segid B) (RESID 14 AND NAME CG and segid B) 1.0 -30.0 20.0 2
!!M15
ASSIGN (RESID 15  AND NAME N   and segid B) (RESID 15 AND NAME CA  and segid B)
      (RESID 15 AND NAME CB  and segid B) (RESID 15 AND NAME CG and segid B) 1.0 60.0 20.0 2
aSSIGN (RESID 15  AND NAME CA   and segid B) (RESID 15 AND NAME CB  and segid B)
      (RESID 15 AND NAME CG  and segid B) (RESID 15 AND NAME SD and segid B) 1.0 180 20.0 2

!!E17
ASSIGN (RESID 17  AND NAME N   and segid B) (RESID 17 AND NAME CA  and segid B)
      (RESID 17 AND NAME CB  and segid B) (RESID 17 AND NAME CG and segid B) 1.0  -60.0 20.0 2
assign (RESID 17 AND NAME CA  and segid B) (RESID 17 AND NAME CB  and segid B)
      (RESID 17 AND NAME CG and segid B)  (RESID 17 AND NAME CD  and segid B) 1.0  180 20.0 2
ASSIGN (RESID 17  AND NAME CB   and segid B) (RESID 17 AND NAME CG  and segid B)
      (RESID 17 AND NAME CD  and segid B) (RESID 17 AND NAME OE1 and segid B) 1.0 0.0 90.0 2


!!K18
ASSIGN (RESID 18  AND NAME N   and segid B) (RESID 18 AND NAME CA  and segid B)
      (RESID 18 AND NAME CB  and segid B) (RESID 18 AND NAME CG and segid B) 1.0  -60.0 20.0 2
!!P19
ASSIGN (RESID 19  AND NAME N   and segid B) (RESID 19 AND NAME CA  and segid B)
      (RESID 19 AND NAME CB  and segid B) (RESID 19 AND NAME CG and segid B) 1.0 30.0 20.0 2
!!V20
ASSIGN (RESID 20  AND NAME N   and segid B) (RESID 20 AND NAME CA  and segid B)
      (RESID 20 AND NAME CB  and segid B) (RESID 20 AND NAME CG1 and segid B) 1.0  60.0 20.0 2

!! L23
ASSIGN (RESID 23  AND NAME N   and segid B) (RESID 23 AND NAME CA  and segid B)
      (RESID 23 AND NAME CB  and segid B) (RESID 23 AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 23  AND NAME CA   and segid B) (RESID 23 AND NAME CB  and segid B)
      (RESID 23 AND NAME CG  and segid B) (RESID 23 AND NAME CD1 and segid B) 1.0 180.0 20.0 2

!! I26  
ASSIGN (RESID 26 AND NAME N   and segid B) (RESID 26 and NAME CA  and segid B)
      (RESID 26 and NAME CB  and segid B) (RESID 26 and NAME CG1 and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 26 AND NAME CA   and segid B) (RESID 26 and NAME CB  and segid B)
      (RESID 26 and NAME CG1  and segid B) (RESID 26 and NAME CD1 and segid B) 1.0 -60.0 20.0 2

!E28
ASSIGN (RESID 28  AND NAME N   and segid B) (RESID 28 AND NAME CA  and segid B)
      (RESID 28 AND NAME CB  and segid B) (RESID 28 AND NAME CG and segid B) 1.0  -60.0 20.0 2
ASSIGN (RESID 28  AND NAME CB   and segid B) (RESID 28 AND NAME CG  and segid B)
      (RESID 28 AND NAME CD  and segid B) (RESID 28 AND NAME OE1 and segid B) 1.0 0.0 90.0 2


!! V29
ASSIGN (RESID 29  AND NAME N   and segid B) (RESID 29 AND NAME CA  and segid B)
      (RESID 29 AND NAME CB  and segid B) (RESID 29 AND NAME CG1 and segid B) 1.0 180.0 20.0 2

!! L30
ASSIGN (RESID 30  AND NAME N   and segid B) (RESID 30 AND NAME CA  and segid B)
      (RESID 30 AND NAME CB  and segid B) (RESID 30 AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 30  AND NAME CA   and segid B) (RESID 30 AND NAME CB  and segid B)
      (RESID 30 AND NAME CG  and segid B) (RESID 30 AND NAME CD1 and segid B) 1.0 180.0 20.0 2

!!K33
ASSIGN (RESID 33  AND NAME N   and segid B) (RESID 33 AND NAME CA  and segid B)
      (RESID 33 AND NAME CB  and segid B) (RESID 33 AND NAME CG and segid B) 1.0 -60.0 20.0 2

!! L34
ASSIGN (RESID 34  AND NAME N   and segid B) (RESID 34 AND NAME CA  and segid B)
      (RESID 34 AND NAME CB  and segid B) (RESID 34 AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 34  AND NAME CA   and segid B) (RESID 34 AND NAME CB  and segid B)
      (RESID 34 AND NAME CG  and segid B) (RESID 34 AND NAME CD1 and segid B) 1.0 180.0 20.0 2
!!R37
ASSIGN (RESID 37  AND NAME N   and segid B) (RESID 37 AND NAME CA  and segid B)
      (RESID 37 AND NAME CB  and segid B) (RESID 37 AND NAME CG and segid B) 1.0  -60.0 20.0 2

!!F39
ASSIGN (RESID 39  AND NAME N   and segid B) (RESID 39 AND NAME CA  and segid B)
      (RESID 39 AND NAME CB  and segid B) (RESID 39 AND NAME CG and segid B) 1.0  -60.0 20.0 2
assign (resid 39 and name ca and segid B) (resid 39 and name cb and segid B)
       (resid 39 and name cg and segid B) (resid 39 and name cd1 and segid B) 1.0 90.0 30.0 2
!!D40
ASSIGN (RESID 40  AND NAME N   and segid B) (RESID 40 AND NAME CA  and segid B)
      (RESID 40 AND NAME CB  and segid B) (RESID 40 AND NAME CG and segid B) 1.0  60.0 20.0 2
ASSIGN (RESID 40  AND NAME CA   and segid B) (RESID 40 AND NAME CB  and segid B)
      (RESID 40 AND NAME CG  and segid B) (RESID 40 AND NAME OD1 and segid B) 1.0 0.0 90.0 2

!!K41
ASSIGN (RESID 41  AND NAME N   and segid B) (RESID 41 AND NAME CA  and segid B)
      (RESID 41 AND NAME CB  and segid B) (RESID 41 AND NAME CG and segid B) 1.0  -60.0 20.0 2

!!Y43
ASSIGN (RESID 43  AND NAME N   and segid B) (RESID 43 AND NAME CA  and segid B)
      (RESID 43 AND NAME CB  and segid B) (RESID 43 AND NAME CG and segid B) 1.0 60.0 20.0 2
ASSIGN (RESID 43  AND NAME CA   and segid B) (RESID 43 AND NAME CB  and segid B)
      (RESID 43 AND NAME CG  and segid B) (RESID 43 AND NAME CD1 and segid B) 1.0 90 20.0 2

!!V44
ASSIGN (RESID 44  AND NAME N   and segid B) (RESID 44 AND NAME CA  and segid B)
      (RESID 44 AND NAME CB  and segid B) (RESID 44 AND NAME CG1 and segid B) 1.0 180.0 20.0 2

!!V45
ASSIGN (RESID 45  AND NAME N   and segid B) (RESID 45 AND NAME CA  and segid B)
      (RESID 45 AND NAME CB  and segid B) (RESID 45 AND NAME CG1 and segid B) 1.0 180.0 20.0 2

!!L46
ASSIGN (RESID 46  AND NAME N   and segid B) (RESID 46 AND NAME CA  and segid B)
      (RESID 46 AND NAME CB  and segid B) (RESID 46 AND NAME CG and segid B) 1.0 180.0 20.0 2
ASSIGN (RESID 46  AND NAME CA   and segid B) (RESID 46 AND NAME CB  and segid B)
      (RESID 46 AND NAME CG  and segid B) (RESID 46 AND NAME CD1 and segid B) 1.0 60.0 20.0 2
 

!!Q48
assign (resid 48 and name n and segid B) (resid 48 and name ca and segid B)
       (resid 48 and name cb and segid B) (resid 48 and name cg and segid B) 1.0 180.0 20.0 2
assign (resid 48 and name ca and segid B) (resid 48 and name cb and segid B)
       (resid 48 and name cg and segid B) (resid 48 and name oe1 and segid B) 1.0 60.0 30.0 2

!!F49
ASSIGN (RESID 49  AND NAME N   and segid B) (RESID 49 AND NAME CA  and segid B)
      (RESID 49 AND NAME CB  and segid B) (RESID 49 AND NAME CG and segid B) 1.0 180.0 20.0 2
ASSIGN (RESID 49  AND NAME CA   and segid B) (RESID 49 AND NAME CB  and segid B)
      (RESID 49 AND NAME CG  and segid B) (RESID 49 AND NAME CD1 and segid B) 1.0 90.0 30.0 2

!!L50
ASSIGN (RESID 50  AND NAME N   and segid B) (RESID 50 AND NAME CA  and segid B)
      (RESID 50 AND NAME CB  and segid B) (RESID 50 AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 50  AND NAME CA   and segid B) (RESID 50 AND NAME CB  and segid B)
      (RESID 50 AND NAME CG  and segid B) (RESID 50 AND NAME CD1 and segid B) 1.0  180.0 20.0 2

!!V51
ASSIGN (RESID 51  AND NAME N   and segid B) (RESID 51 AND NAME CA  and segid B)
      (RESID 51 AND NAME CB  and segid B) (RESID 51 AND NAME CG1 and segid B) 1.0 180.0 20.0 2


!!L52
ASSIGN (RESID 52  AND NAME N   and segid B) (RESID 52 AND NAME CA  and segid B)
      (RESID 52 AND NAME CB  and segid B) (RESID 52 AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 52  AND NAME CA   and segid B) (RESID 52 AND NAME CB  and segid B)
      (RESID 52 AND NAME CG  and segid B) (RESID 52 AND NAME CD1 and segid B) 1.0 180.0 20.0 2

!!K53
ASSIGN (RESID 53  AND NAME N   and segid B) (RESID 53 AND NAME CA  and segid B)
      (RESID 53 AND NAME CB  and segid B) (RESID 53 AND NAME CG and segid B) 1.0 -60.0 20.0 2
!!K54
ASSIGN (RESID 54  AND NAME N   and segid B) (RESID 54 AND NAME CA  and segid B)
      (RESID 54 AND NAME CB  and segid B) (RESID 54 AND NAME CG and segid B) 1.0 0.0 80.0 2

!D55
assign (resid 55 and name ca and segid B) (resid 55 and name cb and segid B)
       (resid 55 and name cg and segid B) (resid 55 and name od1 and segid B) 1.0 -60 20.0 2
!!E56
ASSIGN (RESID 56  AND NAME N   and segid B) (RESID 56 AND NAME CA  and segid B)
      (RESID 56 AND NAME CB  and segid B) (RESID 56 AND NAME CG and segid B) 1.0  180.0 20.0 2
ASSIGN (RESID 56  AND NAME CB   and segid B) (RESID 56 AND NAME CG  and segid B)
      (RESID 56 AND NAME CD  and segid B) (RESID 56 AND NAME OE1 and segid B) 1.0 0.0 90.0 2


!D57
assign (resid 57 and name n and segid B) (resid 57 and name ca and segid B)
       (resid 57 and name cb and segid B) (resid 57 and name cg and segid B) 1.0 -60.0 20.0 2
assign (resid 57 and name ca and segid B) (resid 57 and name cb and segid B)
       (resid 57 and name cg and segid B) (resid 57 and name od1 and segid B) 1.0 0.0 90.0 2

!!L58
ASSIGN (RESID 58  AND NAME N   and segid B) (RESID 58 AND NAME CA  and segid B)
      (RESID 58 AND NAME CB  and segid B) (RESID 58 AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 58  AND NAME CA   and segid B) (RESID 58 AND NAME CB  and segid B)
      (RESID 58 AND NAME CG  and segid B) (RESID 58 AND NAME CD1 and segid B) 1.0 180.0 20.0 2
!!F59
ASSIGN (RESID 59  AND NAME N   and segid B) (RESID 59 AND NAME CA  and segid B)
      (RESID 59 AND NAME CB  and segid B) (RESID 59 AND NAME CG and segid B) 1.0 180.0 20.0 2
ASSIGN (RESID 59  AND NAME CA   and segid B) (RESID 59 AND NAME CB  and segid B)
      (RESID 59 AND NAME CG  and segid B) (RESID 59 AND NAME CD1 and segid B) 1.0 90.0 30.0 2

!!R60
ASSIGN (RESID 60  AND NAME N   and segid B) (RESID 60 AND NAME CA  and segid B)
      (RESID 60 AND NAME CB  and segid B) (RESID 60 AND NAME CG and segid B) 1.0   -60 20.0 2

!!W62
ASSIGN (RESID 62  AND NAME N   and segid B) (RESID 62 AND NAME CA  and segid B)
      (RESID 62 AND NAME CB  and segid B) (RESID 62 AND NAME CG and segid B) 1.0 180.0 20.0 2
ASSIGN (RESID 62  AND NAME ca   and segid B) (RESID 62 AND NAME Cb  and segid B)
     (RESID 62 AND NAME Cg  and segid B) (RESID 62 AND NAME CD1 and segid B) 1.0  90.0 30.0 2
!!L63
ASSIGN (RESID 63  AND NAME N   and segid B) (RESID 63 AND NAME CA  and segid B)
      (RESID 63 AND NAME CB  and segid B) (RESID 63 AND NAME CG and segid B) 1.0 180.0 20.0 2
ASSIGN (RESID 63  AND NAME ca   and segid B) (RESID 63 AND NAME Cb  and segid B)
     (RESID 63 AND NAME Cg  and segid B) (RESID 63 AND NAME CD1 and segid B) 1.0  60.0 20.0 2

!!K64
ASSIGN (RESID 64  AND NAME N   and segid B) (RESID 64 AND NAME CA  and segid B)
      (RESID 64 AND NAME CB  and segid B) (RESID 64 AND NAME CG and segid B) 1.0 180.0 20.0 2
!!D65
assign (resid 65 and name ca and segid B) (resid 65 and name cb and segid B)
       (resid 65 and name cg and segid B) (resid 65 and name od1 and segid B) 1.0 -60 20.0 2

!!T66
ASSIGN (RESID 66  AND NAME N   and segid B) (RESID 66 AND NAME CA  and segid B)
      (RESID 66 AND NAME CB  and segid B) (RESID 66 AND NAME OG1 and segid B) 1.0 -60.0 20.0 2


!!C67
ASSIGN (RESID 67  AND NAME N   and segid B) (RESID 67 AND NAME CA  and segid B)
      (RESID 67 AND NAME CB  and segid B) (RESID 67 AND NAME SG and segid B) 1.0  60.0 20.0 2


!!Q73
ASSIGN (RESID 73  AND NAME N   and segid B) (RESID 73 AND NAME CA  and segid B)
      (RESID 73 AND NAME CB  and segid B) (RESID 73 AND NAME CG and segid B) 1.0 -60.0 20.0 2

!!R75
ASSIGN (RESID 75  AND NAME N   and segid B) (RESID 75 AND NAME CA  and segid B)
      (RESID 75 AND NAME CB  and segid B) (RESID 75 AND NAME CG and segid B) 1.0 -60.0 20.0 2

!!D76
ASSIGN (RESID 76  AND NAME N   and segid B) (RESID 76 AND NAME CA  and segid B)
      (RESID 76 AND NAME CB  and segid B) (RESID 76 AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 76  AND NAME CA   and segid B) (RESID 76 AND NAME CB  and segid B)
      (RESID 76 AND NAME CG  and segid B) (RESID 76 AND NAME OD1 and segid B) 1.0 0.0 90.0 2

!!C77
ASSIGN (RESID 77  AND NAME N   and segid B) (RESID 77 AND NAME CA  and segid B)
      (RESID 77 AND NAME CB  and segid B) (RESID 77 AND NAME SG and segid B) 1.0  -60.0 20.0 2


!!F78
ASSIGN (RESID 78  AND NAME N   and segid B) (RESID 78 AND NAME CA  and segid B)
      (RESID 78 AND NAME CB  and segid B) (RESID 78 AND NAME CG and segid B) 1.0 180.0 20.0 2
ASSIGN (RESID 78  AND NAME CA   and segid B) (RESID 78 AND NAME CB  and segid B)
      (RESID 78 AND NAME CG  and segid B) (RESID 78 AND NAME CD1 and segid B) 1.0 90.0 30.0 2

!!C80
ASSIGN (RESID 80  AND NAME N   and segid B) (RESID 80 AND NAME CA  and segid B)
      (RESID 80 AND NAME CB  and segid B) (RESID 80 AND NAME SG and segid B) 1.0 180.0 20.0 2

!! L81
ASSIGN (RESID 81 AND NAME N   and segid B) (RESID 81 AND NAME CA  and segid B)
      (RESID 81 and NAME CB  and segid B) (RESID 81  AND NAME CG and segid B) 1.0 -60.0 20.0 2
ASSIGN (RESID 81 AND NAME CA   and segid B) (RESID 81 and NAME CB  and segid B)
      (RESID 81 and NAME CG  and segid B) (RESID 81 and NAME CD1 and segid B) 1.0  180.0 20.0 2

!!R82
ASSIGN (RESID 82  AND NAME N   and segid B) (RESID 82 AND NAME CA  and segid B)
      (RESID 82 AND NAME CB  and segid B) (RESID 82 AND NAME CG and segid B) 1.0 180.0 20.0 2

!!E83
ASSIGN (RESID 83  AND NAME N   and segid B) (RESID 83 AND NAME CA  and segid B)
      (RESID 83 AND NAME CB  and segid B) (RESID 83 AND NAME CG and segid B) 1.0  -60.0 20.0 2
ASSIGN (RESID 83  AND NAME CB   and segid B) (RESID 83 AND NAME CG  and segid B)
      (RESID 83 AND NAME CD  and segid B) (RESID 83 AND NAME OE1 and segid B) 1.0 0.0 90.0 2


!!W84
ASSIGN (RESID 84  AND NAME N   and segid B) (RESID 84 AND NAME CA  and segid B)
      (RESID 84 AND NAME CB  and segid B) (RESID 84 AND NAME CG and segid B) 1.0  180.0 20.0 2
ASSIGN (RESID 84  AND NAME ca   and segid B) (RESID 84 AND NAME Cb  and segid B)
     (RESID 84 AND NAME Cg  and segid B) (RESID 84 AND NAME CD1 and segid B) 1.0  90.0 30.0 2
!!C85
ASSIGN (RESID 85  AND NAME N   and segid B) (RESID 85 AND NAME CA  and segid B)
      (RESID 85 AND NAME CB  and segid B) (RESID 85 AND NAME SG and segid B) 1.0 -60.0 20.0 2

!!D86
ASSIGN (RESID 86  AND NAME N   and segid B) (RESID 86 AND NAME CA  and segid B)
      (RESID 86 AND NAME CB  and segid B) (RESID 86 AND NAME CG and segid B) 1.0  -60.0 20.0 2
ASSIGN (RESID 86  AND NAME CA   and segid B) (RESID 86 AND NAME CB  and segid B)
      (RESID 86 AND NAME CG  and segid B) (RESID 86 AND NAME OD1 and segid B) 1.0 0.0 90.0 2

!!F88
ASSIGN (RESID 88  AND NAME N   and segid B) (RESID 88 AND NAME CA  and segid B)
      (RESID 88 AND NAME CB  and segid B) (RESID 88 AND NAME CG and segid B) 1.0  -60.0 20.0 2
ASSIGN (RESID 88  AND NAME ca   and segid B) (RESID 88 AND NAME Cb  and segid B)
      (RESID 88 AND NAME Cg  and segid B) (RESID 88 AND NAME Cd1 and segid B) 1.0  90.0 30.0 2

!L89
ASSIGN (RESID 89  AND NAME N   and segid B) (RESID 89 AND NAME CA  and segid B)
      (RESID 89 AND NAME CB  and segid B) (RESID 89 AND NAME CG and segid B) 1.0  180.0 20.0 2
ASSIGN (RESID 89  AND NAME ca   and segid B) (RESID 89 AND NAME Cb  and segid B)
      (RESID 89 AND NAME Cg  and segid B) (RESID 89 AND NAME Cd1 and segid B) 1.0  60.0 20.0 2






3. 3JHNA couplings


!
! M1
! T2
! T3
! S4
! Q5
! K6
assign (resid   5 and name c  and segid A) (resid   6 and name n  and segid A)
       (resid   6 and name ca and segid A) (resid   6 and name c  and segid A)      5.1 0.5
! H7
! R8
assign (resid   7 and name c  and segid A) (resid   8 and name n  and segid A)
       (resid   8 and name ca and segid A) (resid   8 and name c  and segid A)      5.4 0.5
! D9
assign (resid   8 and name c  and segid A) (resid   9 and name n  and segid A)
       (resid   9 and name ca and segid A) (resid   9 and name c  and segid A)      5.8 0.5
! F10
assign (resid   9 and name c  and segid A) (resid  10 and name n  and segid A)
       (resid  10 and name ca and segid A) (resid  10 and name c  and segid A)      5.5 0.5
! V11
assign (resid  10 and name c  and segid A) (resid  11 and name n  and segid A)
       (resid  11 and name ca and segid A) (resid  11 and name c  and segid A)      6.8 0.5
! A12
assign (resid  11 and name c  and segid A) (resid  12 and name n  and segid A)
       (resid  12 and name ca and segid A) (resid  12 and name c  and segid A)      5.3 0.5
! E13
assign (resid  12 and name c  and segid A) (resid  13 and name n  and segid A)
       (resid  13 and name ca and segid A) (resid  13 and name c  and segid A)      8.8 0.5
! P14
! M15
assign (resid  14 and name c  and segid A) (resid  15 and name n  and segid A)
       (resid  15 and name ca and segid A) (resid  15 and name c  and segid A)      9.0 0.5
! E17
! K18
assign (resid  17 and name c  and segid A) (resid  18 and name n  and segid A)
       (resid  18 and name ca and segid A) (resid  18 and name c  and segid A)      5.3 0.5
! P19
! V20
assign (resid  19 and name c  and segid A) (resid  20 and name n  and segid A)
       (resid  20 and name ca and segid A) (resid  20 and name c  and segid A)      2.5 0.5
! S22
assign (resid  21 and name c  and segid A) (resid  22 and name n  and segid A)
       (resid  22 and name ca and segid A) (resid  22 and name c  and segid A)      7.8 0.5
! L23
assign (resid  22 and name c  and segid A) (resid  23 and name n  and segid A)
       (resid  23 and name ca and segid A) (resid  23 and name c  and segid A)      4.7 0.5
! A24
assign (resid  23 and name c  and segid A) (resid  24 and name n  and segid A)
       (resid  24 and name ca and segid A) (resid  24 and name c  and segid A)      4.5 0.5
! I26
assign (resid  25 and name c  and segid A) (resid  26 and name n  and segid A)
       (resid  26 and name ca and segid A) (resid  26 and name c  and segid A)     10.1 0.5
! E28
assign (resid  27 and name c  and segid A) (resid  28 and name n  and segid A)
       (resid  28 and name ca and segid A) (resid  28 and name c  and segid A)      2.7 0.5
! V29
assign (resid  28 and name c  and segid A) (resid  29 and name n  and segid A)
       (resid  29 and name ca and segid A) (resid  29 and name c  and segid A)      5.6 0.5
! L30
assign (resid  29 and name c  and segid A) (resid  30 and name n  and segid A)
       (resid  30 and name ca and segid A) (resid  30 and name c  and segid A)      5.4 0.5
! K32
assign (resid  31 and name c  and segid A) (resid  32 and name n  and segid A)
       (resid  32 and name ca and segid A) (resid  32 and name c  and segid A)      4.9 0.5
! K33
assign (resid  32 and name c  and segid A) (resid  33 and name n  and segid A)
       (resid  33 and name ca and segid A) (resid  33 and name c  and segid A)      6.4 0.5
! L34
assign (resid  33 and name c  and segid A) (resid  34 and name n  and segid A)
       (resid  34 and name ca and segid A) (resid  34 and name c  and segid A)      3.7 0.5
! E35
! E36
assign (resid  35 and name c  and segid A) (resid  36 and name n  and segid A)
       (resid  36 and name ca and segid A) (resid  36 and name c  and segid A)      4.8 0.5
! R37
assign (resid  36 and name c  and segid A) (resid  37 and name n  and segid A)
       (resid  37 and name ca and segid A) (resid  37 and name c  and segid A)      9.9 0.5
! F39
assign (resid  38 and name c  and segid A) (resid  39 and name n  and segid A)
       (resid  39 and name ca and segid A) (resid  39 and name c  and segid A)     10.2 0.5
! D40
assign (resid  39 and name c  and segid A) (resid  40 and name n  and segid A)
       (resid  40 and name ca and segid A) (resid  40 and name c  and segid A)      7.4 0.5
! K41
assign (resid  40 and name c  and segid A) (resid  41 and name n  and segid A)
       (resid  41 and name ca and segid A) (resid  41 and name c  and segid A)      9.3 0.5
! A42
assign (resid  41 and name c  and segid A) (resid  42 and name n  and segid A)
       (resid  42 and name ca and segid A) (resid  42 and name c  and segid A)      4.4 0.5
! Y43
! V44
assign (resid  43 and name c  and segid A) (resid  44 and name n  and segid A)
       (resid  44 and name ca and segid A) (resid  44 and name c  and segid A)      7.4 0.5
! V45
assign (resid  44 and name c  and segid A) (resid  45 and name n  and segid A)
       (resid  45 and name ca and segid A) (resid  45 and name c  and segid A)      9.0 0.5
! L46
! Q48
assign (resid  47 and name c  and segid A) (resid  48 and name n  and segid A)
       (resid  48 and name ca and segid A) (resid  48 and name c  and segid A)      4.1 0.5
! F49
! L50
assign (resid  49 and name c  and segid A) (resid  50 and name n  and segid A)
       (resid  50 and name ca and segid A) (resid  50 and name c  and segid A)      6.6 0.5
! V51
assign (resid  50 and name c  and segid A) (resid  51 and name n  and segid A)
       (resid  51 and name ca and segid A) (resid  51 and name c  and segid A)      5.4 0.5
! L52
assign (resid  51 and name c  and segid A) (resid  52 and name n  and segid A)
       (resid  52 and name ca and segid A) (resid  52 and name c  and segid A)      8.5 0.5
! K53
assign (resid  52 and name c  and segid A) (resid  53 and name n  and segid A)
       (resid  53 and name ca and segid A) (resid  53 and name c  and segid A)      6.9 0.5
! K54
assign (resid  53 and name c  and segid A) (resid  54 and name n  and segid A)
       (resid  54 and name ca and segid A) (resid  54 and name c  and segid A)      5.7 0.5
! D55
assign (resid  54 and name c  and segid A) (resid  55 and name n  and segid A)
       (resid  55 and name ca and segid A) (resid  55 and name c  and segid A)      5.3 0.5
! E56
assign (resid  55 and name c  and segid A) (resid  56 and name n  and segid A)
       (resid  56 and name ca and segid A) (resid  56 and name c  and segid A)      3.6 0.5
! D57
assign (resid  56 and name c  and segid A) (resid  57 and name n  and segid A)
       (resid  57 and name ca and segid A) (resid  57 and name c  and segid A)      5.7 0.5
! L58
assign (resid  57 and name c  and segid A) (resid  58 and name n  and segid A)
       (resid  58 and name ca and segid A) (resid  58 and name c  and segid A)      5.6 0.5
! F59
assign (resid  58 and name c  and segid A) (resid  59 and name n  and segid A)
       (resid  59 and name ca and segid A) (resid  59 and name c  and segid A)      4.7 0.5
! R60
assign (resid  59 and name c  and segid A) (resid  60 and name n  and segid A)
       (resid  60 and name ca and segid A) (resid  60 and name c  and segid A)      4.1 0.5
! E61
assign (resid  60 and name c  and segid A) (resid  61 and name n  and segid A)
       (resid  61 and name ca and segid A) (resid  61 and name c  and segid A)      5.7 0.5
! W62
assign (resid  61 and name c  and segid A) (resid  62 and name n  and segid A)
       (resid  62 and name ca and segid A) (resid  62 and name c  and segid A)      4.9 0.5
! L63
assign (resid  62 and name c  and segid A) (resid  63 and name n  and segid A)
       (resid  63 and name ca and segid A) (resid  63 and name c  and segid A)      5.5 0.5
! K64
assign (resid  63 and name c  and segid A) (resid  64 and name n  and segid A)
       (resid  64 and name ca and segid A) (resid  64 and name c  and segid A)      4.1 0.5
! D65
assign (resid  64 and name c  and segid A) (resid  65 and name n  and segid A)
       (resid  65 and name ca and segid A) (resid  65 and name c  and segid A)      5.1 0.5
! T66
assign (resid  65 and name c  and segid A) (resid  66 and name n  and segid A)
       (resid  66 and name ca and segid A) (resid  66 and name c  and segid A)      7.9 0.5
! C67
assign (resid  66 and name c  and segid A) (resid  67 and name n  and segid A)
       (resid  67 and name ca and segid A) (resid  67 and name c  and segid A)     10.5 0.5
! A69
assign (resid  68 and name c  and segid A) (resid  69 and name n  and segid A)
       (resid  69 and name ca and segid A) (resid  69 and name c  and segid A)      2.6 0.5
! N70
assign (resid  69 and name c  and segid A) (resid  70 and name n  and segid A)
       (resid  70 and name ca and segid A) (resid  70 and name c  and segid A)      9.0 0.5
! A71
! K72
assign (resid  71 and name c  and segid A) (resid  72 and name n  and segid A)
       (resid  72 and name ca and segid A) (resid  72 and name c  and segid A)      6.7 0.5
! Q73
assign (resid  72 and name c  and segid A) (resid  73 and name n  and segid A)
       (resid  73 and name ca and segid A) (resid  73 and name c  and segid A)      4.6 0.5
! S74
assign (resid  73 and name c  and segid A) (resid  74 and name n  and segid A)
       (resid  74 and name ca and segid A) (resid  74 and name c  and segid A)      5.4 0.5
! R75
assign (resid  74 and name c  and segid A) (resid  75 and name n  and segid A)
       (resid  75 and name ca and segid A) (resid  75 and name c  and segid A)      5.1 0.5
! D76
assign (resid  75 and name c  and segid A) (resid  76 and name n  and segid A)
       (resid  76 and name ca and segid A) (resid  76 and name c  and segid A)      5.7 0.5
! C77
assign (resid  76 and name c  and segid A) (resid  77 and name n  and segid A)
       (resid  77 and name ca and segid A) (resid  77 and name c  and segid A)      4.8 0.5
! F78
assign (resid  77 and name c  and segid A) (resid  78 and name n  and segid A)
       (resid  78 and name ca and segid A) (resid  78 and name c  and segid A)      3.3 0.5
! C80
assign (resid  79 and name c  and segid A) (resid  80 and name n  and segid A)
       (resid  80 and name ca and segid A) (resid  80 and name c  and segid A)      5.9 0.5
! L81
assign (resid  80 and name c  and segid A) (resid  81 and name n  and segid A)
       (resid  81 and name ca and segid A) (resid  81 and name c  and segid A)      5.7 0.5
! R82
assign (resid  81 and name c  and segid A) (resid  82 and name n  and segid A)
       (resid  82 and name ca and segid A) (resid  82 and name c  and segid A)      4.2 0.5
! E83
assign (resid  82 and name c  and segid A) (resid  83 and name n  and segid A)
       (resid  83 and name ca and segid A) (resid  83 and name c  and segid A)      5.6 0.5
! W84
assign (resid  83 and name c  and segid A) (resid  84 and name n  and segid A)
       (resid  84 and name ca and segid A) (resid  84 and name c  and segid A)      3.8 0.5
! C85
assign (resid  84 and name c  and segid A) (resid  85 and name n  and segid A)
       (resid  85 and name ca and segid A) (resid  85 and name c  and segid A)      4.4 0.5
! D86
assign (resid  85 and name c  and segid A) (resid  86 and name n  and segid A)
       (resid  86 and name ca and segid A) (resid  86 and name c  and segid A)      3.7 0.5
! A87
assign (resid  86 and name c  and segid A) (resid  87 and name n  and segid A)
       (resid  87 and name ca and segid A) (resid  87 and name c  and segid A)      8.8 0.5
! F88
assign (resid  87 and name c  and segid A) (resid  88 and name n  and segid A)
       (resid  88 and name ca and segid A) (resid  88 and name c  and segid A)     10.9 0.5
! L89
assign (resid  88 and name c  and segid A) (resid  89 and name n  and segid A)
       (resid  89 and name ca and segid A) (resid  89 and name c  and segid A)      8.2 0.5





!
! M1
! T2
! T3
! S4
! Q5
! K6
assign (resid   5 and name c  and segid B) (resid   6 and name n  and segid B)
       (resid   6 and name ca and segid B) (resid   6 and name c  and segid B)      5.1 0.5
! H7
! R8
assign (resid   7 and name c  and segid B) (resid   8 and name n  and segid B)
       (resid   8 and name ca and segid B) (resid   8 and name c  and segid B)      5.4 0.5
! D9
assign (resid   8 and name c  and segid B) (resid   9 and name n  and segid B)
       (resid   9 and name ca and segid B) (resid   9 and name c  and segid B)      5.8 0.5
! F10
assign (resid   9 and name c  and segid B) (resid  10 and name n  and segid B)
       (resid  10 and name ca and segid B) (resid  10 and name c  and segid B)      5.5 0.5
! V11
assign (resid  10 and name c  and segid B) (resid  11 and name n  and segid B)
       (resid  11 and name ca and segid B) (resid  11 and name c  and segid B)      6.8 0.5
! A12
assign (resid  11 and name c  and segid B) (resid  12 and name n  and segid B)
       (resid  12 and name ca and segid B) (resid  12 and name c  and segid B)      5.3 0.5
! E13
assign (resid  12 and name c  and segid B) (resid  13 and name n  and segid B)
       (resid  13 and name ca and segid B) (resid  13 and name c  and segid B)      8.8 0.5
! P14
! M15
assign (resid  14 and name c  and segid B) (resid  15 and name n  and segid B)
       (resid  15 and name ca and segid B) (resid  15 and name c  and segid B)      9.0 0.5
! E17
! K18
assign (resid  17 and name c  and segid B) (resid  18 and name n  and segid B)
       (resid  18 and name ca and segid B) (resid  18 and name c  and segid B)      5.3 0.5
! P19
! V20
assign (resid  19 and name c  and segid B) (resid  20 and name n  and segid B)
       (resid  20 and name ca and segid B) (resid  20 and name c  and segid B)      2.5 0.5
! S22
assign (resid  21 and name c  and segid B) (resid  22 and name n  and segid B)
       (resid  22 and name ca and segid B) (resid  22 and name c  and segid B)      7.8 0.5
! L23
assign (resid  22 and name c  and segid B) (resid  23 and name n  and segid B)
       (resid  23 and name ca and segid B) (resid  23 and name c  and segid B)      4.7 0.5
! A24
assign (resid  23 and name c  and segid B) (resid  24 and name n  and segid B)
       (resid  24 and name ca and segid B) (resid  24 and name c  and segid B)      4.5 0.5
! I26
assign (resid  25 and name c  and segid B) (resid  26 and name n  and segid B)
       (resid  26 and name ca and segid B) (resid  26 and name c  and segid B)     10.1 0.5
! E28
assign (resid  27 and name c  and segid B) (resid  28 and name n  and segid B)
       (resid  28 and name ca and segid B) (resid  28 and name c  and segid B)      2.7 0.5
! V29
assign (resid  28 and name c  and segid B) (resid  29 and name n  and segid B)
       (resid  29 and name ca and segid B) (resid  29 and name c  and segid B)      5.6 0.5
! L30
assign (resid  29 and name c  and segid B) (resid  30 and name n  and segid B)
       (resid  30 and name ca and segid B) (resid  30 and name c  and segid B)      5.4 0.5
! K32
assign (resid  31 and name c  and segid B) (resid  32 and name n  and segid B)
       (resid  32 and name ca and segid B) (resid  32 and name c  and segid B)      4.9 0.5
! K33
assign (resid  32 and name c  and segid B) (resid  33 and name n  and segid B)
       (resid  33 and name ca and segid B) (resid  33 and name c  and segid B)      6.4 0.5
! L34
assign (resid  33 and name c  and segid B) (resid  34 and name n  and segid B)
       (resid  34 and name ca and segid B) (resid  34 and name c  and segid B)      3.7 0.5
! E35
! E36
assign (resid  35 and name c  and segid B) (resid  36 and name n  and segid B)
       (resid  36 and name ca and segid B) (resid  36 and name c  and segid B)      4.8 0.5
! R37
assign (resid  36 and name c  and segid B) (resid  37 and name n  and segid B)
       (resid  37 and name ca and segid B) (resid  37 and name c  and segid B)      9.9 0.5
! F39
assign (resid  38 and name c  and segid B) (resid  39 and name n  and segid B)
       (resid  39 and name ca and segid B) (resid  39 and name c  and segid B)     10.2 0.5
! D40
assign (resid  39 and name c  and segid B) (resid  40 and name n  and segid B)
       (resid  40 and name ca and segid B) (resid  40 and name c  and segid B)      7.4 0.5
! K41
assign (resid  40 and name c  and segid B) (resid  41 and name n  and segid B)
       (resid  41 and name ca and segid B) (resid  41 and name c  and segid B)      9.3 0.5
! A42
assign (resid  41 and name c  and segid B) (resid  42 and name n  and segid B)
       (resid  42 and name ca and segid B) (resid  42 and name c  and segid B)      4.4 0.5
! Y43
! V44
assign (resid  43 and name c  and segid B) (resid  44 and name n  and segid B)
       (resid  44 and name ca and segid B) (resid  44 and name c  and segid B)      7.4 0.5
! V45
assign (resid  44 and name c  and segid B) (resid  45 and name n  and segid B)
       (resid  45 and name ca and segid B) (resid  45 and name c  and segid B)      9.0 0.5
! L46
! Q48
assign (resid  47 and name c  and segid B) (resid  48 and name n  and segid B)
       (resid  48 and name ca and segid B) (resid  48 and name c  and segid B)      4.1 0.5
! F49
! L50
assign (resid  49 and name c  and segid B) (resid  50 and name n  and segid B)
       (resid  50 and name ca and segid B) (resid  50 and name c  and segid B)      6.6 0.5
! V51
assign (resid  50 and name c  and segid B) (resid  51 and name n  and segid B)
       (resid  51 and name ca and segid B) (resid  51 and name c  and segid B)      5.4 0.5
! L52
assign (resid  51 and name c  and segid B) (resid  52 and name n  and segid B)
       (resid  52 and name ca and segid B) (resid  52 and name c  and segid B)      8.5 0.5
! K53
assign (resid  52 and name c  and segid B) (resid  53 and name n  and segid B)
       (resid  53 and name ca and segid B) (resid  53 and name c  and segid B)      6.9 0.5
! K54
assign (resid  53 and name c  and segid B) (resid  54 and name n  and segid B)
       (resid  54 and name ca and segid B) (resid  54 and name c  and segid B)      5.7 0.5
! D55
assign (resid  54 and name c  and segid B) (resid  55 and name n  and segid B)
       (resid  55 and name ca and segid B) (resid  55 and name c  and segid B)      5.3 0.5
! E56
assign (resid  55 and name c  and segid B) (resid  56 and name n  and segid B)
       (resid  56 and name ca and segid B) (resid  56 and name c  and segid B)      3.6 0.5
! D57
assign (resid  56 and name c  and segid B) (resid  57 and name n  and segid B)
       (resid  57 and name ca and segid B) (resid  57 and name c  and segid B)      5.7 0.5
! L58
assign (resid  57 and name c  and segid B) (resid  58 and name n  and segid B)
       (resid  58 and name ca and segid B) (resid  58 and name c  and segid B)      5.6 0.5
! F59
assign (resid  58 and name c  and segid B) (resid  59 and name n  and segid B)
       (resid  59 and name ca and segid B) (resid  59 and name c  and segid B)      4.7 0.5
! R60
assign (resid  59 and name c  and segid B) (resid  60 and name n  and segid B)
       (resid  60 and name ca and segid B) (resid  60 and name c  and segid B)      4.1 0.5
! E61
assign (resid  60 and name c  and segid B) (resid  61 and name n  and segid B)
       (resid  61 and name ca and segid B) (resid  61 and name c  and segid B)      5.7 0.5
! W62
assign (resid  61 and name c  and segid B) (resid  62 and name n  and segid B)
       (resid  62 and name ca and segid B) (resid  62 and name c  and segid B)      4.9 0.5
! L63
assign (resid  62 and name c  and segid B) (resid  63 and name n  and segid B)
       (resid  63 and name ca and segid B) (resid  63 and name c  and segid B)      5.5 0.5
! K64
assign (resid  63 and name c  and segid B) (resid  64 and name n  and segid B)
       (resid  64 and name ca and segid B) (resid  64 and name c  and segid B)      4.1 0.5
! D65
assign (resid  64 and name c  and segid B) (resid  65 and name n  and segid B)
       (resid  65 and name ca and segid B) (resid  65 and name c  and segid B)      5.1 0.5
! T66
assign (resid  65 and name c  and segid B) (resid  66 and name n  and segid B)
       (resid  66 and name ca and segid B) (resid  66 and name c  and segid B)      7.9 0.5
! C67
assign (resid  66 and name c  and segid B) (resid  67 and name n  and segid B)
       (resid  67 and name ca and segid B) (resid  67 and name c  and segid B)     10.5 0.5
! A69
assign (resid  68 and name c  and segid B) (resid  69 and name n  and segid B)
       (resid  69 and name ca and segid B) (resid  69 and name c  and segid B)      2.6 0.5
! N70
assign (resid  69 and name c  and segid B) (resid  70 and name n  and segid B)
       (resid  70 and name ca and segid B) (resid  70 and name c  and segid B)      9.0 0.5
! A71
! K72
assign (resid  71 and name c  and segid B) (resid  72 and name n  and segid B)
       (resid  72 and name ca and segid B) (resid  72 and name c  and segid B)      6.7 0.5
! Q73
assign (resid  72 and name c  and segid B) (resid  73 and name n  and segid B)
       (resid  73 and name ca and segid B) (resid  73 and name c  and segid B)      4.6 0.5
! S74
assign (resid  73 and name c  and segid B) (resid  74 and name n  and segid B)
       (resid  74 and name ca and segid B) (resid  74 and name c  and segid B)      5.4 0.5
! R75
assign (resid  74 and name c  and segid B) (resid  75 and name n  and segid B)
       (resid  75 and name ca and segid B) (resid  75 and name c  and segid B)      5.1 0.5
! D76
assign (resid  75 and name c  and segid B) (resid  76 and name n  and segid B)
       (resid  76 and name ca and segid B) (resid  76 and name c  and segid B)      5.7 0.5
! C77
assign (resid  76 and name c  and segid B) (resid  77 and name n  and segid B)
       (resid  77 and name ca and segid B) (resid  77 and name c  and segid B)      4.8 0.5
! F78
assign (resid  77 and name c  and segid B) (resid  78 and name n  and segid B)
       (resid  78 and name ca and segid B) (resid  78 and name c  and segid B)      3.3 0.5
! C80
assign (resid  79 and name c  and segid B) (resid  80 and name n  and segid B)
       (resid  80 and name ca and segid B) (resid  80 and name c  and segid B)      5.9 0.5
! L81
assign (resid  80 and name c  and segid B) (resid  81 and name n  and segid B)
       (resid  81 and name ca and segid B) (resid  81 and name c  and segid B)      5.7 0.5
! R82
assign (resid  81 and name c  and segid B) (resid  82 and name n  and segid B)
       (resid  82 and name ca and segid B) (resid  82 and name c  and segid B)      4.2 0.5
! E83
assign (resid  82 and name c  and segid B) (resid  83 and name n  and segid B)
       (resid  83 and name ca and segid B) (resid  83 and name c  and segid B)      5.6 0.5
! W84
assign (resid  83 and name c  and segid B) (resid  84 and name n  and segid B)
       (resid  84 and name ca and segid B) (resid  84 and name c  and segid B)      3.8 0.5
! C85
assign (resid  84 and name c  and segid B) (resid  85 and name n  and segid B)
       (resid  85 and name ca and segid B) (resid  85 and name c  and segid B)      4.4 0.5
! D86
assign (resid  85 and name c  and segid B) (resid  86 and name n  and segid B)
       (resid  86 and name ca and segid B) (resid  86 and name c  and segid B)      3.7 0.5
! A87
assign (resid  86 and name c  and segid B) (resid  87 and name n  and segid B)
       (resid  87 and name ca and segid B) (resid  87 and name c  and segid B)      8.8 0.5
! F88
assign (resid  87 and name c  and segid B) (resid  88 and name n  and segid B)
       (resid  88 and name ca and segid B) (resid  88 and name c  and segid B)     10.9 0.5
! L89
assign (resid  88 and name c  and segid B) (resid  89 and name n  and segid B)
       (resid  89 and name ca and segid B) (resid  89 and name c  and segid B)      8.2 0.5






4. 13Calpha and 13Cb shift restraints



  !!    T2
 assign (resid  1  and name c  and segid A) (resid  2  and name n  and segid A) 
        (resid  2  and name ca and segid A) (resid  2  and name c  and segid A)
	(resid  3  and name n  and segid A)  			  61.94 70.12 
  !!    T3
 assign (resid  2  and name c  and segid A) (resid  3  and name n  and segid A) 
        (resid  3  and name ca and segid A) (resid  3  and name c  and segid A)  
	(resid  4  and name n  and segid A) 			  62.85 70.13
  !!    S4
 assign (resid  3  and name c  and segid A) (resid  4  and name n  and segid A) 
        (resid  4  and name ca and segid A) (resid  4  and name c  and segid A) 
	(resid  5  and name n  and segid A) 			  58.81 64.59
  !!    Q5
 assign (resid  4  and name c  and segid A) (resid  5  and name n  and segid A)
        (resid  5  and name ca and segid A) (resid  5  and name c  and segid A)
	(resid  6  and name n  and segid A)			          58.75 28.95
  !!    K6
 assign (resid  5  and name c  and segid A) (resid  6  and name n  and segid A) 
        (resid  6  and name ca and segid A) (resid  6  and name c  and segid A)
	(resid  7  and name n  and segid A)          		  59.91 32.99
  !!    H7
 assign (resid  6  and name c  and segid A) (resid  7  and name n  and segid A) 
        (resid  7  and name ca and segid A) (resid  7  and name c  and segid A)
	(resid  8  and name n  and segid A)   			  60.30 31.57
  !!    R8
 assign (resid  7  and name c  and segid A) (resid  8  and name n  and segid A)
        (resid  8  and name ca and segid A) (resid  8  and name c  and segid A)
        (resid  9  and name n  and segid A)   			  59.72 30.50
  !!    D9
 assign (resid  8  and name c  and segid A) (resid  9  and name n  and segid A) 
        (resid  9  and name ca and segid A) (resid  9  and name c  and segid A) 
	(resid  10  and name n  and segid A)  		          56.55 40.84
  !!    F10
 assign (resid  9  and name c  and segid A) (resid  10  and name n  and segid A)
        (resid 10  and name ca and segid A) (resid  10  and name c  and segid A)
	(resid 11 and name n  and segid A)   			  62.09 40.39


  !!    V11
 assign (resid 10 and name c  and segid A) (resid 11 and name n  and segid A) 
        (resid 11 and name ca and segid A) (resid 11 and name c  and segid A) 
	(resid 12 and name n  and segid A)    			  63.82 32.04
  !!    A12
 assign (resid 11 and name c  and segid A) (resid 12 and name n  and segid A) 
        (resid 12 and name ca and segid A) (resid 12 and name c  and segid A)   
	(resid 13 and name n  and segid A)  		          52.72 20.67
  !!    E13
 assign (resid 12 and name c  and segid A) (resid 13 and name n  and segid A) 
        (resid 13 and name ca and segid A) (resid 13 and name c  and segid A)
	(resid 14 and name n  and segid A)     			  53.75 30.59
  !!    P14
 assign (resid 13 and name c  and segid A) (resid 14 and name n  and segid A) 
        (resid 14 and name ca and segid A) (resid 14 and name c  and segid A)
	(resid 15 and name n  and segid A)     			  64.29  31.77
  !!    M15
 assign (resid 14 and name c  and segid A) (resid 15 and name n  and segid A) 
        (resid 15 and name ca and segid A) (resid 15 and name c  and segid A)
	(resid 16 and name n  and segid A)     			  57.24 34.71
  !!    G16
 assign (resid 15 and name c  and segid A) (resid 16 and name n  and segid A) 
        (resid 16 and name ca and segid A) (resid 16 and name c  and segid A) 
	(resid 17 and name n  and segid A)    			  48.39 0.00
  !!    E17
 assign (resid 16 and name c  and segid A) (resid 17 and name n  and segid A) 
        (resid 17 and name ca and segid A) (resid 17 and name c  and segid A) 
	(resid 18 and name n  and segid A)    			  55.06 29.45
  !!    K18
 assign (resid 17 and name c  and segid A) (resid 18 and name n  and segid A) 
        (resid 18 and name ca and segid A) (resid 18 and name c  and segid A)
	(resid 19 and name n  and segid A)     			  57.25 32.76
  !!    P19
assign  (resid 18 and name c  and segid A) (resid 19 and name n  and segid A)
        (resid 19 and name ca and segid A) (resid 19 and name c  and segid A)
        (resid 20 and name n  and segid A)     			  62.48 33.38
 !!    V20
 assign (resid 19 and name c  and segid A) (resid 20 and name n  and segid A) 
        (resid 20 and name ca and segid A) (resid 20 and name c  and segid A)
	(resid 21 and name n  and segid A)     			  65.98 32.23
  !!    G21
 assign (resid 20 and name c  and segid A) (resid 21 and name n  and segid A) 
        (resid 21 and name ca and segid A) (resid 21 and name c  and segid A)
	(resid 22 and name n  and segid A)     			  45.80 0.000
  !!    S22
 assign (resid 21 and name c  and segid A) (resid 22 and name n  and segid A) 
        (resid 22 and name ca and segid A) (resid 22 and name c  and segid A)
	(resid 23 and name n  and segid A)     		          60.80 64.06
  !!    L23
 assign (resid 22 and name c  and segid A) (resid 23 and name n  and segid A)
        (resid 23 and name ca and segid A) (resid 23 and name c  and segid A)
	(resid 24 and name n  and segid A) 		          	  55.22 42.46
  !!    A24
 assign (resid 23 and name c  and segid A) (resid 24 and name n  and segid A)
        (resid 24 and name ca and segid A) (resid 24 and name c  and segid A)
	(resid 25 and name n  and segid A)   			  53.63 19.16
  !!    G25
 assign (resid 24 and name c  and segid A) (resid 25 and name n  and segid A)
        (resid 25 and name ca and segid A) (resid 25 and name c  and segid A)
	(resid 26 and name n  and segid A)   			  45.71 0.00
  !!    I26
 assign (resid 25 and name c  and segid A) (resid 26 and name n  and segid A) 
        (resid 26 and name ca and segid A) (resid 26 and name c  and segid A) 
	(resid 27 and name n  and segid A)    			  58.44 33.96
 !!    G27
 assign (resid 26 and name c  and segid A) (resid 27 and name n  and segid A)
        (resid 27 and name ca and segid A) (resid 27 and name c  and segid A)
	(resid 28 and name n  and segid A)     			  44.75 0.00
  !!    E28
 assign (resid 27 and name c  and segid A) (resid 28 and name n  and segid A) 
        (resid 28 and name ca and segid A) (resid 28 and name c  and segid A)
	(resid 29 and name n  and segid A)    			  60.17 30.27
  !!    V29
 assign (resid 28 and name c  and segid A) (resid 29 and name n  and segid A) 
        (resid 29 and name ca and segid A) (resid 29 and name c  and segid A) 
	(resid 30 and name n  and segid A)    			  66.65 31.67
  !!    L30
 assign (resid 29 and name c  and segid A) (resid 30 and name n  and segid A)
        (resid 30 and name ca and segid A) (resid 30 and name c  and segid A)
        (resid 31 and name n  and segid A)    			  58.26 42.17
  !!    G31
assign (resid 30 and name c  and segid A) (resid 31 and name n  and segid A)
       (resid 31 and name ca and segid A) (resid 31 and name c  and segid A)
       (resid 32 and name n  and segid A)    			  47.55 0.00
  !!    K32
assign (resid 31 and name c  and segid A) (resid 32 and name n  and segid A) 
       (resid 32 and name ca and segid A) (resid 32 and name c  and segid A) 
       (resid 33 and name n  and segid A)    			  59.21 32.38
  !!    K33
 assign (resid 32 and name c  and segid A) (resid 33 and name n  and segid A)
        (resid 33 and name ca and segid A) (resid 33 and name c  and segid A)
        (resid 34 and name n  and segid A)    			  59.35 32.60
  !!    L34
 assign (resid 33 and name c  and segid A) (resid 34 and name n  and segid A)
        (resid 34 and name ca and segid A) (resid 34 and name c  and segid A)
        (resid 35 and name n  and segid A)    			  58.95 40.72
  !!    E35
 assign (resid 34 and name c  and segid A) (resid 35 and name n  and segid A)
        (resid 35 and name ca and segid A) (resid 35 and name c  and segid A)
        (resid 36 and name n  and segid A)    			  60.84 29.74
  !!    E36
 assign (resid 35 and name c  and segid A) (resid 36 and name n  and segid A)
        (resid 36 and name ca and segid A) (resid 36 and name c  and segid A)
        (resid 37 and name n  and segid A)    			  59.17 29.80
  !!    R37
 assign (resid 36 and name c  and segid A) (resid 37 and name n  and segid A) 
       (resid 37 and name ca and segid A) (resid 37 and name c  and segid A)   
 	(resid 38 and name n  and segid A)  			  55.34 30.58
  !!    G38
 assign (resid 37 and name c  and segid A) (resid 38 and name n  and segid A) 
        (resid 38 and name ca and segid A) (resid 38 and name c  and segid A) 
	(resid 39 and name n  and segid A)    			  45.24 0.00
  !!    F39
 assign (resid 38 and name c  and segid A) (resid 39 and name n  and segid A)
        (resid 39 and name ca and segid A) (resid 39 and name c  and segid A)
        (resid 40 and name n  and segid A)    			  56.24 38.39
  !!    D40
 assign (resid 39 and name c  and segid A) (resid 40 and name n  and segid A)
        (resid 40 and name ca and segid A) (resid 40 and name c  and segid A)
        (resid 41 and name n  and segid A)    			  54.97 40.60
  !!    K41
 assign (resid 40 and name c  and segid A) (resid 41 and name n  and segid A) 
        (resid 41 and name ca and segid A) (resid 41 and name c  and segid A)  
	(resid 42 and name n  and segid A)   			  53.99 36.00
  !!    A42
 assign (resid 41 and name c  and segid A) (resid 42 and name n  and segid A) 
        (resid 42 and name ca and segid A) (resid 42 and name c  and segid A) 
	(resid 43 and name n  and segid A)    			  56.76 17.35
  !!    Y43
assign (resid 42 and name c  and segid A) (resid 43 and name n  and segid A) 
       (resid 43 and name ca and segid A) (resid 43 and name c  and segid A)
       (resid 44 and name n  and segid A)     			  60.25 36.82
  !!    V44
 assign (resid 43 and name c  and segid A) (resid 44 and name n  and segid A) 
        (resid 44 and name ca and segid A) (resid 44 and name c  and segid A) 
	(resid 45 and name n  and segid A)    			  65.28 32.37
  !!    V45
 assign (resid 44 and name c  and segid A) (resid 45 and name n  and segid A) 
        (resid 45 and name ca and segid A) (resid 45 and name c  and segid A)
	(resid 46 and name n  and segid A)     			  66.64 31.37
  !!    L46
 assign (resid 45 and name c  and segid A) (resid 46 and name n  and segid A) 
        (resid 46 and name ca and segid A) (resid 46 and name c  and segid A)
	(resid 47 and name n  and segid A)     			  58.71 40.11
  !!    G47
 assign (resid 46 and name c  and segid A) (resid 47 and name n  and segid A) 
        (resid 47 and name ca and segid A) (resid 47 and name c  and segid A)
	(resid 48 and name n  and segid A)     			  50.25 0.000
  !!    Q48
 assign (resid 47 and name c  and segid A) (resid 48 and name n  and segid A) 
        (resid 48 and name ca and segid A) (resid 48 and name c  and segid A)
	(resid 49 and name n  and segid A)     			  58.13 27.82
  !!    F49
 assign (resid 48 and name c  and segid A) (resid 49 and name n  and segid A) 
        (resid 49 and name ca and segid A) (resid 49 and name c  and segid A) 
	(resid 50 and name n  and segid A)    			  61.66 39.50
  !!    L50
 assign (resid 49 and name c  and segid A) (resid 50 and name n  and segid A) 
        (resid 50 and name ca and segid A) (resid 50 and name c  and segid A)
	(resid 51 and name n  and segid A)     			  58.04 40.99
  !!    V51
 assign (resid 50 and name c  and segid A) (resid 51 and name n  and segid A) 
        (resid 51 and name ca and segid A) (resid 51 and name c  and segid A)
	(resid 52 and name n  and segid A)     			  66.72 31.66
  !!    L52
 assign (resid 51 and name c  and segid A) (resid 52 and name n  and segid A) 
        (resid 52 and name ca and segid A) (resid 52 and name c  and segid A) 
	(resid 53 and name n  and segid A)    			  54.55 40.39
  !!    K53
 assign (resid 52 and name c  and segid A) (resid 53 and name n  and segid A) 
        (resid 53 and name ca and segid A) (resid 53 and name c  and segid A) 
	(resid 54 and name n  and segid A)    			  57.51 28.46
  !!    K54
 assign (resid 53 and name c  and segid A) (resid 54 and name n  and segid A)
        (resid 54 and name ca and segid A) (resid 54 and name c  and segid A)
	(resid 55 and name n  and segid A)     			  55.98 29.72
  !!    D55
 assign (resid 54 and name c  and segid A) (resid 55 and name n  and segid A)
        (resid 55 and name ca and segid A) (resid 55 and name c  and segid A) 
	(resid 56 and name n  and segid A)    			  55.36 44.08
  !!    E56
 assign (resid 55 and name c  and segid A) (resid 56 and name n  and segid A)
        (resid 56 and name ca and segid A) (resid 56 and name c  and segid A) 
	(resid 57 and name n  and segid A)    			  56.39 30.21
  !!    D57
 assign (resid 56 and name c  and segid A) (resid 57 and name n  and segid A)
        (resid 57 and name ca and segid A) (resid 57 and name c  and segid A) 
	(resid 58 and name n  and segid A)    			  58.02 40.75
  !!    L58
 assign (resid 57 and name c  and segid A) (resid 58 and name n  and segid A)
        (resid 58 and name ca and segid A) (resid 58 and name c  and segid A) 
	(resid 59 and name n  and segid A)    			  57.98 42.74
  !!    F59
 assign (resid 58 and name c  and segid A) (resid 59 and name n  and segid A)
        (resid 59 and name ca and segid A) (resid 59 and name c  and segid A) 
	(resid 60 and name n  and segid A)    			  62.76 39.96
  !!    R60
 assign (resid 59 and name c  and segid A) (resid 60 and name n  and segid A)
        (resid 60 and name ca and segid A) (resid 60 and name c  and segid A) 
	(resid 61 and name n  and segid A)    			  61.05 29.85
  !!    E61
 assign (resid 60 and name c  and segid A) (resid 61 and name n  and segid A)
        (resid 61 and name ca and segid A) (resid 61 and name c  and segid A) 
	(resid 62 and name n  and segid A)    			  59.54 29.68
  !!    W62
 assign (resid 61 and name c  and segid A) (resid 62 and name n  and segid A)
        (resid 62 and name ca and segid A) (resid 62 and name c  and segid A) 
	(resid 63 and name n  and segid A)    			  62.43 27.71
  !!    L63
 assign (resid 62 and name c  and segid A) (resid 63 and name n  and segid A)
        (resid 63 and name ca and segid A) (resid 63 and name c  and segid A) 
	(resid 64 and name n  and segid A)    			  57.98 42.26
  !!    K64
 assign (resid 63 and name c  and segid A) (resid 64 and name n  and segid A)
        (resid 64 and name ca and segid A) (resid 64 and name c  and segid A) 
	(resid 65 and name n  and segid A)    			  60.36 32.08
  !!    D65
 assign (resid 64 and name c  and segid A) (resid 65 and name n  and segid A)
        (resid 65 and name ca and segid A) (resid 65 and name c  and segid A) 
	(resid 66 and name n  and segid A)    			  57.38 41.37
  !!    T66
 assign (resid 65 and name c  and segid A) (resid 66 and name n  and segid A)
        (resid 66 and name ca and segid A) (resid 66 and name c  and segid A) 
	(resid 67 and name n  and segid A)    			  65.81 68.52
  !!    C67
 assign (resid 66 and name c  and segid A) (resid 67 and name n  and segid A)
        (resid 67 and name ca and segid A) (resid 67 and name c  and segid A) 
	(resid 68 and name n  and segid A)    		       	  56.44 31.46
  !!    G68
 assign (resid 67 and name c  and segid A) (resid 68 and name n  and segid A)
        (resid 68 and name ca and segid A) (resid 68 and name c  and segid A) 
	(resid 69 and name n  and segid A)    			  46.54 0.00
  !!    A69
 assign (resid 68 and name c  and segid A) (resid 69 and name n  and segid A)
        (resid 69 and name ca and segid A) (resid 69 and name c  and segid A) 
	(resid 70 and name n  and segid A)    			  52.70 20.72
  !!    N70
 assign (resid 69 and name c  and segid A) (resid 70 and name n  and segid A)
        (resid 70 and name ca and segid A) (resid 70 and name c  and segid A) 
	(resid 71 and name n  and segid A)    			  51.20 38.77
  !!    A71
 assign (resid 70 and name c  and segid A) (resid 71 and name n  and segid A)
        (resid 71 and name ca and segid A) (resid 71 and name c  and segid A) 
	(resid 72 and name n  and segid A)    			  56.09 18.88
  !!    K72
 assign (resid 71 and name c  and segid A) (resid 72 and name n  and segid A)
        (resid 72 and name ca and segid A) (resid 72 and name c  and segid A) 
	(resid 73 and name n  and segid A)    			  59.79 32.67
  !!    Q73
 assign (resid 72 and name c  and segid A) (resid 73 and name n  and segid A)
        (resid 73 and name ca and segid A) (resid 73 and name c  and segid A) 
	(resid 74 and name n  and segid A)    			  59.22 28.35
  !!    S74
 assign (resid 73 and name c  and segid A) (resid 74 and name n  and segid A)
        (resid 74 and name ca and segid A) (resid 74 and name c  and segid A) 
	(resid 75 and name n  and segid A)    			  61.84 62.74
  !!    R75
 assign (resid 74 and name c  and segid A) (resid 75 and name n  and segid A)
        (resid 75 and name ca and segid A) (resid 75 and name c  and segid A) 
	(resid 76 and name n  and segid A)    			  60.36 30.18
  !!    D76
 assign (resid 75 and name c  and segid A) (resid 76 and name n  and segid A)
        (resid 76 and name ca and segid A) (resid 76 and name c  and segid A) 
	(resid 77 and name n  and segid A)    			  57.44 39.49
  !!    C77
 assign (resid 76 and name c  and segid A) (resid 77 and name n  and segid A)
        (resid 77 and name ca and segid A) (resid 77 and name c  and segid A) 
	(resid 78 and name n  and segid A)    			  63.19 27.45
  !!    F78
 assign (resid 77 and name c  and segid A) (resid 78 and name n  and segid A)
        (resid 78 and name ca and segid A) (resid 78 and name c  and segid A) 
	(resid 79 and name n  and segid A)    			  62.35 39.74
  !!    G79
 assign (resid 78 and name c  and segid A) (resid 79 and name n  and segid A)
        (resid 79 and name ca and segid A) (resid 79 and name c  and segid A) 
	(resid 80 and name n  and segid A)    			  47.53 0.00
  !!    C80
 assign (resid 79 and name c  and segid A) (resid 80 and name n  and segid A)
        (resid 80 and name ca and segid A) (resid 80 and name c  and segid A) 
	(resid 81 and name n  and segid A)    			  61.72 27.36
  !!    L81
 assign (resid 80 and name c  and segid A) (resid 81 and name n  and segid A)
        (resid 81 and name ca and segid A) (resid 81 and name c  and segid A) 
	(resid 82 and name n  and segid A)    			  57.84 40.74
  !!    R82
 assign (resid 81 and name c  and segid A) (resid 82 and name n  and segid A)
        (resid 82 and name ca and segid A) (resid 82 and name c  and segid A) 
	(resid 83 and name n  and segid A)    			  59.93 29.77
  !!    E83
 assign (resid 82 and name c  and segid A) (resid 83 and name n  and segid A)
        (resid 83 and name ca and segid A) (resid 83 and name c  and segid A) 
	(resid 84 and name n  and segid A)    			  60.10 29.75

  !!    W84
 assign (resid 83 and name c  and segid A) (resid 84 and name n  and segid A)
        (resid 84 and name ca and segid A) (resid 84 and name c  and segid A) 
	(resid 85 and name n  and segid A)    			  64.10 30.21
  !!    C85
 assign (resid 84 and name c  and segid A) (resid 85 and name n  and segid A)
        (resid 85 and name ca and segid A) (resid 85 and name c  and segid A) 
	(resid 86 and name n  and segid A)    			  64.54 26.88
  !!    D86
 assign (resid 85 and name c  and segid A) (resid 86 and name n  and segid A)
        (resid 86 and name ca and segid A) (resid 86 and name c  and segid A) 
	(resid 87 and name n  and segid A)    			  57.31 40.53
  !!    A87
 assign (resid 86 and name c  and segid A) (resid 87 and name n  and segid A)
        (resid 87 and name ca and segid A) (resid 87 and name c  and segid A) 
	(resid 88 and name n  and segid A)    			  54.09 19.65
  !!    F88
 assign (resid 87 and name c  and segid A) (resid 88 and name n  and segid A)
        (resid 88 and name ca and segid A) (resid 88 and name c  and segid A) 
	(resid 89 and name n  and segid A)    			  59.63 42.05




  !!    T2
 assign (resid  1  and name c  and segid B) (resid  2  and name n  and segid B) 
        (resid  2  and name ca and segid B) (resid  2  and name c  and segid B)
	(resid  3  and name n  and segid B)  			  61.94 70.12 
  !!    T3
 assign (resid  2  and name c  and segid B) (resid  3  and name n  and segid B) 
        (resid  3  and name ca and segid B) (resid  3  and name c  and segid B)  
	(resid  4  and name n  and segid B) 			  62.85 70.13
  !!    S4
 assign (resid  3  and name c  and segid B) (resid  4  and name n  and segid B) 
        (resid  4  and name ca and segid B) (resid  4  and name c  and segid B) 
	(resid  5  and name n  and segid B) 			  58.81 64.59
  !!    Q5
 assign (resid  4  and name c  and segid B) (resid  5  and name n  and segid B)
        (resid  5  and name ca and segid B) (resid  5  and name c  and segid B)
	(resid  6  and name n  and segid B)			          58.75 28.95
  !!    K6
 assign (resid  5  and name c  and segid B) (resid  6  and name n  and segid B) 
        (resid  6  and name ca and segid B) (resid  6  and name c  and segid B)
	(resid  7  and name n  and segid B)          		  59.91 32.99
  !!    H7
 assign (resid  6  and name c  and segid B) (resid  7  and name n  and segid B) 
        (resid  7  and name ca and segid B) (resid  7  and name c  and segid B)
	(resid  8  and name n  and segid B)   			  60.30 31.57
  !!    R8
 assign (resid  7  and name c  and segid B) (resid  8  and name n  and segid B)
        (resid  8  and name ca and segid B) (resid  8  and name c  and segid B)
        (resid  9  and name n  and segid B)   			  59.72 30.50
  !!    D9
 assign (resid  8  and name c  and segid B) (resid  9  and name n  and segid B) 
        (resid  9  and name ca and segid B) (resid  9  and name c  and segid B) 
	(resid  10  and name n  and segid B)  		          56.55 40.84
  !!    F10
 assign (resid  9  and name c  and segid B) (resid  10  and name n  and segid B)
        (resid 10  and name ca and segid B) (resid  10  and name c  and segid B)
	(resid 11 and name n  and segid B)   			  62.09 40.39


  !!    V11
 assign (resid 10 and name c  and segid B) (resid 11 and name n  and segid B) 
        (resid 11 and name ca and segid B) (resid 11 and name c  and segid B) 
	(resid 12 and name n  and segid B)    			  63.82 32.04
  !!    A12
 assign (resid 11 and name c  and segid B) (resid 12 and name n  and segid B) 
        (resid 12 and name ca and segid B) (resid 12 and name c  and segid B)   
	(resid 13 and name n  and segid B)  		          52.72 20.67
  !!    E13
 assign (resid 12 and name c  and segid B) (resid 13 and name n  and segid B) 
        (resid 13 and name ca and segid B) (resid 13 and name c  and segid B)
	(resid 14 and name n  and segid B)     			  53.75 30.59
  !!    P14
 assign (resid 13 and name c  and segid B) (resid 14 and name n  and segid B) 
        (resid 14 and name ca and segid B) (resid 14 and name c  and segid B)
	(resid 15 and name n  and segid B)     			  64.29  31.77
  !!    M15
 assign (resid 14 and name c  and segid B) (resid 15 and name n  and segid B) 
        (resid 15 and name ca and segid B) (resid 15 and name c  and segid B)
	(resid 16 and name n  and segid B)     			  57.24 34.71
  !!    G16
 assign (resid 15 and name c  and segid B) (resid 16 and name n  and segid B) 
        (resid 16 and name ca and segid B) (resid 16 and name c  and segid B) 
	(resid 17 and name n  and segid B)    			  48.39 0.00
  !!    E17
 assign (resid 16 and name c  and segid B) (resid 17 and name n  and segid B) 
        (resid 17 and name ca and segid B) (resid 17 and name c  and segid B) 
	(resid 18 and name n  and segid B)    			  55.06 29.45
  !!    K18
 assign (resid 17 and name c  and segid B) (resid 18 and name n  and segid B) 
        (resid 18 and name ca and segid B) (resid 18 and name c  and segid B)
	(resid 19 and name n  and segid B)     			  57.25 32.76
  !!    P19
assign  (resid 18 and name c  and segid B) (resid 19 and name n  and segid B)
        (resid 19 and name ca and segid B) (resid 19 and name c  and segid B)
        (resid 20 and name n  and segid B)     			  62.48 33.38
 !!    V20
 assign (resid 19 and name c  and segid B) (resid 20 and name n  and segid B) 
        (resid 20 and name ca and segid B) (resid 20 and name c  and segid B)
	(resid 21 and name n  and segid B)     			  65.98 32.23
  !!    G21
 assign (resid 20 and name c  and segid B) (resid 21 and name n  and segid B) 
        (resid 21 and name ca and segid B) (resid 21 and name c  and segid B)
	(resid 22 and name n  and segid B)     			  45.80 0.000
  !!    S22
 assign (resid 21 and name c  and segid B) (resid 22 and name n  and segid B) 
        (resid 22 and name ca and segid B) (resid 22 and name c  and segid B)
	(resid 23 and name n  and segid B)     		          60.80 64.06
  !!    L23
 assign (resid 22 and name c  and segid B) (resid 23 and name n  and segid B)
        (resid 23 and name ca and segid B) (resid 23 and name c  and segid B)
	(resid 24 and name n  and segid B) 		          	  55.22 42.46
  !!    A24
 assign (resid 23 and name c  and segid B) (resid 24 and name n  and segid B)
        (resid 24 and name ca and segid B) (resid 24 and name c  and segid B)
	(resid 25 and name n  and segid B)   			  53.63 19.16
  !!    G25
 assign (resid 24 and name c  and segid B) (resid 25 and name n  and segid B)
        (resid 25 and name ca and segid B) (resid 25 and name c  and segid B)
	(resid 26 and name n  and segid B)   			  45.71 0.00
  !!    I26
 assign (resid 25 and name c  and segid B) (resid 26 and name n  and segid B) 
        (resid 26 and name ca and segid B) (resid 26 and name c  and segid B) 
	(resid 27 and name n  and segid B)    			  58.44 33.96
 !!    G27
 assign (resid 26 and name c  and segid B) (resid 27 and name n  and segid B)
        (resid 27 and name ca and segid B) (resid 27 and name c  and segid B)
	(resid 28 and name n  and segid B)     			  44.75 0.00
  !!    E28
 assign (resid 27 and name c  and segid B) (resid 28 and name n  and segid B) 
        (resid 28 and name ca and segid B) (resid 28 and name c  and segid B)
	(resid 29 and name n  and segid B)    			  60.17 30.27
  !!    V29
 assign (resid 28 and name c  and segid B) (resid 29 and name n  and segid B) 
        (resid 29 and name ca and segid B) (resid 29 and name c  and segid B) 
	(resid 30 and name n  and segid B)    			  66.65 31.67
  !!    L30
 assign (resid 29 and name c  and segid B) (resid 30 and name n  and segid B)
        (resid 30 and name ca and segid B) (resid 30 and name c  and segid B)
        (resid 31 and name n  and segid B)    			  58.26 42.17
  !!    G31
assign (resid 30 and name c  and segid B) (resid 31 and name n  and segid B)
       (resid 31 and name ca and segid B) (resid 31 and name c  and segid B)
       (resid 32 and name n  and segid B)    			  47.55 0.00
  !!    K32
assign (resid 31 and name c  and segid B) (resid 32 and name n  and segid B) 
       (resid 32 and name ca and segid B) (resid 32 and name c  and segid B) 
       (resid 33 and name n  and segid B)    			  59.21 32.38
  !!    K33
 assign (resid 32 and name c  and segid B) (resid 33 and name n  and segid B)
        (resid 33 and name ca and segid B) (resid 33 and name c  and segid B)
        (resid 34 and name n  and segid B)    			  59.35 32.60
  !!    L34
 assign (resid 33 and name c  and segid B) (resid 34 and name n  and segid B)
        (resid 34 and name ca and segid B) (resid 34 and name c  and segid B)
        (resid 35 and name n  and segid B)    			  58.95 40.72
  !!    E35
 assign (resid 34 and name c  and segid B) (resid 35 and name n  and segid B)
        (resid 35 and name ca and segid B) (resid 35 and name c  and segid B)
        (resid 36 and name n  and segid B)    			  60.84 29.74
  !!    E36
 assign (resid 35 and name c  and segid B) (resid 36 and name n  and segid B)
        (resid 36 and name ca and segid B) (resid 36 and name c  and segid B)
        (resid 37 and name n  and segid B)    			  59.17 29.80
  !!    R37
 assign (resid 36 and name c  and segid B) (resid 37 and name n  and segid B) 
       (resid 37 and name ca and segid B) (resid 37 and name c  and segid B)   
 	(resid 38 and name n  and segid B)  			  55.34 30.58
  !!    G38
 assign (resid 37 and name c  and segid B) (resid 38 and name n  and segid B) 
        (resid 38 and name ca and segid B) (resid 38 and name c  and segid B) 
	(resid 39 and name n  and segid B)    			  45.24 0.00
  !!    F39
 assign (resid 38 and name c  and segid B) (resid 39 and name n  and segid B)
        (resid 39 and name ca and segid B) (resid 39 and name c  and segid B)
        (resid 40 and name n  and segid B)    			  56.24 38.39
  !!    D40
 assign (resid 39 and name c  and segid B) (resid 40 and name n  and segid B)
        (resid 40 and name ca and segid B) (resid 40 and name c  and segid B)
        (resid 41 and name n  and segid B)    			  54.97 40.60
  !!    K41
 assign (resid 40 and name c  and segid B) (resid 41 and name n  and segid B) 
        (resid 41 and name ca and segid B) (resid 41 and name c  and segid B)  
	(resid 42 and name n  and segid B)   			  53.99 36.00
  !!    A42
 assign (resid 41 and name c  and segid B) (resid 42 and name n  and segid B) 
        (resid 42 and name ca and segid B) (resid 42 and name c  and segid B) 
	(resid 43 and name n  and segid B)    			  56.76 17.35
  !!    Y43
assign (resid 42 and name c  and segid B) (resid 43 and name n  and segid B) 
       (resid 43 and name ca and segid B) (resid 43 and name c  and segid B)
       (resid 44 and name n  and segid B)     			  60.25 36.82
  !!    V44
 assign (resid 43 and name c  and segid B) (resid 44 and name n  and segid B) 
        (resid 44 and name ca and segid B) (resid 44 and name c  and segid B) 
	(resid 45 and name n  and segid B)    			  65.28 32.37
  !!    V45
 assign (resid 44 and name c  and segid B) (resid 45 and name n  and segid B) 
        (resid 45 and name ca and segid B) (resid 45 and name c  and segid B)
	(resid 46 and name n  and segid B)     			  66.64 31.37
  !!    L46
 assign (resid 45 and name c  and segid B) (resid 46 and name n  and segid B) 
        (resid 46 and name ca and segid B) (resid 46 and name c  and segid B)
	(resid 47 and name n  and segid B)     			  58.71 40.11
  !!    G47
 assign (resid 46 and name c  and segid B) (resid 47 and name n  and segid B) 
        (resid 47 and name ca and segid B) (resid 47 and name c  and segid B)
	(resid 48 and name n  and segid B)     			  50.25 0.000
  !!    Q48
 assign (resid 47 and name c  and segid B) (resid 48 and name n  and segid B) 
        (resid 48 and name ca and segid B) (resid 48 and name c  and segid B)
	(resid 49 and name n  and segid B)     			  58.13 27.82
  !!    F49
 assign (resid 48 and name c  and segid B) (resid 49 and name n  and segid B) 
        (resid 49 and name ca and segid B) (resid 49 and name c  and segid B) 
	(resid 50 and name n  and segid B)    			  61.66 39.50
  !!    L50
 assign (resid 49 and name c  and segid B) (resid 50 and name n  and segid B) 
        (resid 50 and name ca and segid B) (resid 50 and name c  and segid B)
	(resid 51 and name n  and segid B)     			  58.04 40.99
  !!    V51
 assign (resid 50 and name c  and segid B) (resid 51 and name n  and segid B) 
        (resid 51 and name ca and segid B) (resid 51 and name c  and segid B)
	(resid 52 and name n  and segid B)     			  66.72 31.66
  !!    L52
 assign (resid 51 and name c  and segid B) (resid 52 and name n  and segid B) 
        (resid 52 and name ca and segid B) (resid 52 and name c  and segid B) 
	(resid 53 and name n  and segid B)    			  54.55 40.39
  !!    K53
 assign (resid 52 and name c  and segid B) (resid 53 and name n  and segid B) 
        (resid 53 and name ca and segid B) (resid 53 and name c  and segid B) 
	(resid 54 and name n  and segid B)    			  57.51 28.46
  !!    K54
 assign (resid 53 and name c  and segid B) (resid 54 and name n  and segid B)
        (resid 54 and name ca and segid B) (resid 54 and name c  and segid B)
	(resid 55 and name n  and segid B)     			  55.98 29.72
  !!    D55
 assign (resid 54 and name c  and segid B) (resid 55 and name n  and segid B)
        (resid 55 and name ca and segid B) (resid 55 and name c  and segid B) 
	(resid 56 and name n  and segid B)    			  55.36 44.08
  !!    E56
 assign (resid 55 and name c  and segid B) (resid 56 and name n  and segid B)
        (resid 56 and name ca and segid B) (resid 56 and name c  and segid B) 
	(resid 57 and name n  and segid B)    			  56.39 30.21
  !!    D57
 assign (resid 56 and name c  and segid B) (resid 57 and name n  and segid B)
        (resid 57 and name ca and segid B) (resid 57 and name c  and segid B) 
	(resid 58 and name n  and segid B)    			  58.02 40.75
  !!    L58
 assign (resid 57 and name c  and segid B) (resid 58 and name n  and segid B)
        (resid 58 and name ca and segid B) (resid 58 and name c  and segid B) 
	(resid 59 and name n  and segid B)    			  57.98 42.74
  !!    F59
 assign (resid 58 and name c  and segid B) (resid 59 and name n  and segid B)
        (resid 59 and name ca and segid B) (resid 59 and name c  and segid B) 
	(resid 60 and name n  and segid B)    			  62.76 39.96
  !!    R60
 assign (resid 59 and name c  and segid B) (resid 60 and name n  and segid B)
        (resid 60 and name ca and segid B) (resid 60 and name c  and segid B) 
	(resid 61 and name n  and segid B)    			  61.05 29.85
  !!    E61
 assign (resid 60 and name c  and segid B) (resid 61 and name n  and segid B)
        (resid 61 and name ca and segid B) (resid 61 and name c  and segid B) 
	(resid 62 and name n  and segid B)    			  59.54 29.68
  !!    W62
 assign (resid 61 and name c  and segid B) (resid 62 and name n  and segid B)
        (resid 62 and name ca and segid B) (resid 62 and name c  and segid B) 
	(resid 63 and name n  and segid B)    			  62.43 27.71
  !!    L63
 assign (resid 62 and name c  and segid B) (resid 63 and name n  and segid B)
        (resid 63 and name ca and segid B) (resid 63 and name c  and segid B) 
	(resid 64 and name n  and segid B)    			  57.98 42.26
  !!    K64
 assign (resid 63 and name c  and segid B) (resid 64 and name n  and segid B)
        (resid 64 and name ca and segid B) (resid 64 and name c  and segid B) 
	(resid 65 and name n  and segid B)    			  60.36 32.08
  !!    D65
 assign (resid 64 and name c  and segid B) (resid 65 and name n  and segid B)
        (resid 65 and name ca and segid B) (resid 65 and name c  and segid B) 
	(resid 66 and name n  and segid B)    			  57.38 41.37
  !!    T66
 assign (resid 65 and name c  and segid B) (resid 66 and name n  and segid B)
        (resid 66 and name ca and segid B) (resid 66 and name c  and segid B) 
	(resid 67 and name n  and segid B)    			  65.81 68.52
  !!    C67
 assign (resid 66 and name c  and segid B) (resid 67 and name n  and segid B)
        (resid 67 and name ca and segid B) (resid 67 and name c  and segid B) 
	(resid 68 and name n  and segid B)    		       	  56.44 31.46
  !!    G68
 assign (resid 67 and name c  and segid B) (resid 68 and name n  and segid B)
        (resid 68 and name ca and segid B) (resid 68 and name c  and segid B) 
	(resid 69 and name n  and segid B)    			  46.54 0.00
  !!    A69
 assign (resid 68 and name c  and segid B) (resid 69 and name n  and segid B)
        (resid 69 and name ca and segid B) (resid 69 and name c  and segid B) 
	(resid 70 and name n  and segid B)    			  52.70 20.72
  !!    N70
 assign (resid 69 and name c  and segid B) (resid 70 and name n  and segid B)
        (resid 70 and name ca and segid B) (resid 70 and name c  and segid B) 
	(resid 71 and name n  and segid B)    			  51.20 38.77
  !!    A71
 assign (resid 70 and name c  and segid B) (resid 71 and name n  and segid B)
        (resid 71 and name ca and segid B) (resid 71 and name c  and segid B) 
	(resid 72 and name n  and segid B)    			  56.09 18.88
  !!    K72
 assign (resid 71 and name c  and segid B) (resid 72 and name n  and segid B)
        (resid 72 and name ca and segid B) (resid 72 and name c  and segid B) 
	(resid 73 and name n  and segid B)    			  59.79 32.67
  !!    Q73
 assign (resid 72 and name c  and segid B) (resid 73 and name n  and segid B)
        (resid 73 and name ca and segid B) (resid 73 and name c  and segid B) 
	(resid 74 and name n  and segid B)    			  59.22 28.35
  !!    S74
 assign (resid 73 and name c  and segid B) (resid 74 and name n  and segid B)
        (resid 74 and name ca and segid B) (resid 74 and name c  and segid B) 
	(resid 75 and name n  and segid B)    			  61.84 62.74
  !!    R75
 assign (resid 74 and name c  and segid B) (resid 75 and name n  and segid B)
        (resid 75 and name ca and segid B) (resid 75 and name c  and segid B) 
	(resid 76 and name n  and segid B)    			  60.36 30.18
  !!    D76
 assign (resid 75 and name c  and segid B) (resid 76 and name n  and segid B)
        (resid 76 and name ca and segid B) (resid 76 and name c  and segid B) 
	(resid 77 and name n  and segid B)    			  57.44 39.49
  !!    C77
 assign (resid 76 and name c  and segid B) (resid 77 and name n  and segid B)
        (resid 77 and name ca and segid B) (resid 77 and name c  and segid B) 
	(resid 78 and name n  and segid B)    			  63.19 27.45
  !!    F78
 assign (resid 77 and name c  and segid B) (resid 78 and name n  and segid B)
        (resid 78 and name ca and segid B) (resid 78 and name c  and segid B) 
	(resid 79 and name n  and segid B)    			  62.35 39.74
  !!    G79
 assign (resid 78 and name c  and segid B) (resid 79 and name n  and segid B)
        (resid 79 and name ca and segid B) (resid 79 and name c  and segid B) 
	(resid 80 and name n  and segid B)    			  47.53 0.00
  !!    C80
 assign (resid 79 and name c  and segid B) (resid 80 and name n  and segid B)
        (resid 80 and name ca and segid B) (resid 80 and name c  and segid B) 
	(resid 81 and name n  and segid B)    			  61.72 27.36
  !!    L81
 assign (resid 80 and name c  and segid B) (resid 81 and name n  and segid B)
        (resid 81 and name ca and segid B) (resid 81 and name c  and segid B) 
	(resid 82 and name n  and segid B)    			  57.84 40.74
  !!    R82
 assign (resid 81 and name c  and segid B) (resid 82 and name n  and segid B)
        (resid 82 and name ca and segid B) (resid 82 and name c  and segid B) 
	(resid 83 and name n  and segid B)    			  59.93 29.77
  !!    E83
 assign (resid 82 and name c  and segid B) (resid 83 and name n  and segid B)
        (resid 83 and name ca and segid B) (resid 83 and name c  and segid B) 
	(resid 84 and name n  and segid B)    			  60.10 29.75

  !!    W84
 assign (resid 83 and name c  and segid B) (resid 84 and name n  and segid B)
        (resid 84 and name ca and segid B) (resid 84 and name c  and segid B) 
	(resid 85 and name n  and segid B)    			  64.10 30.21
  !!    C85
 assign (resid 84 and name c  and segid B) (resid 85 and name n  and segid B)
        (resid 85 and name ca and segid B) (resid 85 and name c  and segid B) 
	(resid 86 and name n  and segid B)    			  64.54 26.88
  !!    D86
 assign (resid 85 and name c  and segid B) (resid 86 and name n  and segid B)
        (resid 86 and name ca and segid B) (resid 86 and name c  and segid B) 
	(resid 87 and name n  and segid B)    			  57.31 40.53
  !!    A87
 assign (resid 86 and name c  and segid B) (resid 87 and name n  and segid B)
        (resid 87 and name ca and segid B) (resid 87 and name c  and segid B) 
	(resid 88 and name n  and segid B)    			  54.09 19.65
  !!    F88
 assign (resid 87 and name c  and segid B) (resid 88 and name n  and segid B)
        (resid 88 and name ca and segid B) (resid 88 and name c  and segid B) 
	(resid 89 and name n  and segid B)    			  59.63 42.05




5. Residual dipolar coupling restraints  (All couplings normalized to
one bond H-N couplings) Da(NH)=-14.1 Hz, R=0.17





assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name N   and segid A)
       ( resid 6    and name HN  and segid A)  -18.3100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name N   and segid A)
       ( resid 8    and name HN  and segid A)  -29.5900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9    and name N   and segid A)
       ( resid 9    and name HN  and segid A)  -18.3900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name N   and segid A)
       ( resid 10   and name HN  and segid A)  -16.8400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 12   and name N   and segid A)
       ( resid 12   and name HN  and segid A)  4.8000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name N   and segid A)
       ( resid 13   and name HN  and segid A)  7.0900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16   and name N   and segid A)
       ( resid 16   and name HN  and segid A)  -2.9700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name N   and segid A)
       ( resid 17   and name HN  and segid A)  12.6400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name N   and segid A)
       ( resid 18   and name HN  and segid A)  6.4300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name N   and segid A)
       ( resid 21   and name HN  and segid A)  15.2200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name N   and segid A)
       ( resid 22   and name HN  and segid A)  -19.1800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name N   and segid A)
       ( resid 24   and name HN  and segid A)  -11.2100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name N   and segid A)
       ( resid 25   and name HN  and segid A)  -7.3900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name N   and segid A)
       ( resid 27   and name HN  and segid A)  11.3700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name N   and segid A)
       ( resid 28   and name HN  and segid A)  -15.3900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name N   and segid A)
       ( resid 30   and name HN  and segid A)  -3.3000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name N   and segid A)
       ( resid 31   and name HN  and segid A)  -16.5000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name N   and segid A)
       ( resid 33   and name HN  and segid A)  -8.5200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name N   and segid A)
       ( resid 35   and name HN  and segid A)  -23.7100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name N   and segid A)
       ( resid 37   and name HN  and segid A)  -1.6000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name N   and segid A)
       ( resid 38   and name HN  and segid A)  -14.3600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name N   and segid A)
       ( resid 39   and name HN  and segid A)  -17.2600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name N   and segid A)
       ( resid 40   and name HN  and segid A)  -22.2200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 41   and name N   and segid A)
       ( resid 41   and name HN  and segid A)  -0.6900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name N   and segid A)
       ( resid 42   and name HN  and segid A)  10.9800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name N   and segid A)
       ( resid 43   and name HN  and segid A)  15.7000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name N   and segid A)
       ( resid 44   and name HN  and segid A)  -7.8700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name N   and segid A)
       ( resid 45   and name HN  and segid A)  9.8900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name N   and segid A)
       ( resid 47   and name HN  and segid A)  13.6300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48   and name N   and segid A)
       ( resid 48   and name HN  and segid A)  1.2700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name N   and segid A)
       ( resid 50   and name HN  and segid A)  16.1900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name N   and segid A)
       ( resid 51   and name HN  and segid A)  4.0400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name N   and segid A)
       ( resid 52   and name HN  and segid A)  2.9000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name N   and segid A)
       ( resid 53   and name HN  and segid A)  6.1800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name N   and segid A)
       ( resid 54   and name HN  and segid A)  16.6000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 55   and name N   and segid A)
       ( resid 55   and name HN  and segid A)  -6.1100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56   and name N   and segid A)
       ( resid 56   and name HN  and segid A)  13.3400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name N   and segid A)
       ( resid 57   and name HN  and segid A)  -2.7300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name N   and segid A)
       ( resid 58   and name HN  and segid A)  0.6400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name N   and segid A)
       ( resid 59   and name HN  and segid A)  13.3300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name N   and segid A)
       ( resid 61   and name HN  and segid A)  -1.9400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name N   and segid A)
       ( resid 62   and name HN  and segid A)  5.7400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 63   and name N   and segid A)
       ( resid 63   and name HN  and segid A)  14.9100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name N   and segid A)
       ( resid 64   and name HN  and segid A)  7.9700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name N   and segid A)
       ( resid 66   and name HN  and segid A)  12.8700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name N   and segid A)
       ( resid 67   and name HN  and segid A)  16.8600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name N   and segid A)
       ( resid 68   and name HN  and segid A)  -13.5200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name N   and segid A)
       ( resid 69   and name HN  and segid A)  -25.0700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name N   and segid A)
       ( resid 70   and name HN  and segid A)  9.8200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name N   and segid A)
       ( resid 72   and name HN  and segid A)  -9.8000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name N   and segid A)
       ( resid 73   and name HN  and segid A)  1.1600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name N   and segid A)
       ( resid 74   and name HN  and segid A)  -3.5100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name N   and segid A)
       ( resid 75   and name HN  and segid A)  -20.6300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name N   and segid A)
       ( resid 76   and name HN  and segid A)  -10.3000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77   and name N   and segid A)
       ( resid 77   and name HN  and segid A)  -0.2600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name N   and segid A)
       ( resid 79   and name HN  and segid A)  -18.9200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name N   and segid A)
       ( resid 80   and name HN  and segid A)  -0.6500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name N   and segid A)
       ( resid 81   and name HN  and segid A)  -0.2100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name N   and segid A)
       ( resid 82   and name HN  and segid A)  -17.8500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 83   and name N   and segid A)
       ( resid 83   and name HN  and segid A)  -17.5800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name N   and segid A)
       ( resid 84   and name HN  and segid A)  -2.0500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 85   and name N   and segid A)
       ( resid 85   and name HN  and segid A)  -6.2300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name N   and segid A)
       ( resid 87   and name HN  and segid A)  -4.1000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 88   and name N   and segid A)
       ( resid 88   and name HN  and segid A)  -5.2400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 89   and name N   and segid A)
       ( resid 89   and name HN  and segid A)  -11.0500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name NE1 and segid A)
       ( resid 62   and name HE1 and segid A)  4.6800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name NE1 and segid A)
       ( resid 84   and name HE1 and segid A)  15.2200  0.2000





assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name N   and segid B)
       ( resid 6    and name HN  and segid B)  -18.3100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name N   and segid B)
       ( resid 8    and name HN  and segid B)  -29.5900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9    and name N   and segid B)
       ( resid 9    and name HN  and segid B)  -18.3900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name N   and segid B)
       ( resid 10   and name HN  and segid B)  -16.8400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 12   and name N   and segid B)
       ( resid 12   and name HN  and segid B)  4.8000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name N   and segid B)
       ( resid 13   and name HN  and segid B)  7.0900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16   and name N   and segid B)
       ( resid 16   and name HN  and segid B)  -2.9700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name N   and segid B)
       ( resid 17   and name HN  and segid B)  12.6400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name N   and segid B)
       ( resid 18   and name HN  and segid B)  6.4300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name N   and segid B)
       ( resid 21   and name HN  and segid B)  15.2200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name N   and segid B)
       ( resid 22   and name HN  and segid B)  -19.1800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name N   and segid B)
       ( resid 24   and name HN  and segid B)  -11.2100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name N   and segid B)
       ( resid 25   and name HN  and segid B)  -7.3900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name N   and segid B)
       ( resid 27   and name HN  and segid B)  11.3700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name N   and segid B)
       ( resid 28   and name HN  and segid B)  -15.3900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name N   and segid B)
       ( resid 30   and name HN  and segid B)  -3.3000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name N   and segid B)
       ( resid 31   and name HN  and segid B)  -16.5000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name N   and segid B)
       ( resid 33   and name HN  and segid B)  -8.5200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name N   and segid B)
       ( resid 35   and name HN  and segid B)  -23.7100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name N   and segid B)
       ( resid 37   and name HN  and segid B)  -1.6000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name N   and segid B)
       ( resid 38   and name HN  and segid B)  -14.3600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name N   and segid B)
       ( resid 39   and name HN  and segid B)  -17.2600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name N   and segid B)
       ( resid 40   and name HN  and segid B)  -22.2200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 41   and name N   and segid B)
       ( resid 41   and name HN  and segid B)  -0.6900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name N   and segid B)
       ( resid 42   and name HN  and segid B)  10.9800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name N   and segid B)
       ( resid 43   and name HN  and segid B)  15.7000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name N   and segid B)
       ( resid 44   and name HN  and segid B)  -7.8700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name N   and segid B)
       ( resid 45   and name HN  and segid B)  9.8900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name N   and segid B)
       ( resid 47   and name HN  and segid B)  13.6300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48   and name N   and segid B)
       ( resid 48   and name HN  and segid B)  1.2700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name N   and segid B)
       ( resid 50   and name HN  and segid B)  16.1900  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name N   and segid B)
       ( resid 51   and name HN  and segid B)  4.0400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name N   and segid B)
       ( resid 52   and name HN  and segid B)  2.9000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name N   and segid B)
       ( resid 53   and name HN  and segid B)  6.1800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name N   and segid B)
       ( resid 54   and name HN  and segid B)  16.6000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 55   and name N   and segid B)
       ( resid 55   and name HN  and segid B)  -6.1100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56   and name N   and segid B)
       ( resid 56   and name HN  and segid B)  13.3400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name N   and segid B)
       ( resid 57   and name HN  and segid B)  -2.7300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name N   and segid B)
       ( resid 58   and name HN  and segid B)  0.6400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name N   and segid B)
       ( resid 59   and name HN  and segid B)  13.3300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name N   and segid B)
       ( resid 61   and name HN  and segid B)  -1.9400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name N   and segid B)
       ( resid 62   and name HN  and segid B)  5.7400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 63   and name N   and segid B)
       ( resid 63   and name HN  and segid B)  14.9100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name N   and segid B)
       ( resid 64   and name HN  and segid B)  7.9700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name N   and segid B)
       ( resid 66   and name HN  and segid B)  12.8700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name N   and segid B)
       ( resid 67   and name HN  and segid B)  16.8600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name N   and segid B)
       ( resid 68   and name HN  and segid B)  -13.5200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name N   and segid B)
       ( resid 69   and name HN  and segid B)  -25.0700  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name N   and segid B)
       ( resid 70   and name HN  and segid B)  9.8200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name N   and segid B)
       ( resid 72   and name HN  and segid B)  -9.8000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name N   and segid B)
       ( resid 73   and name HN  and segid B)  1.1600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name N   and segid B)
       ( resid 74   and name HN  and segid B)  -3.5100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name N   and segid B)
       ( resid 75   and name HN  and segid B)  -20.6300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name N   and segid B)
       ( resid 76   and name HN  and segid B)  -10.3000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77   and name N   and segid B)
       ( resid 77   and name HN  and segid B)  -0.2600  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name N   and segid B)
       ( resid 79   and name HN  and segid B)  -18.9200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name N   and segid B)
       ( resid 80   and name HN  and segid B)  -0.6500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name N   and segid B)
       ( resid 81   and name HN  and segid B)  -0.2100  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name N   and segid B)
       ( resid 82   and name HN  and segid B)  -17.8500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 83   and name N   and segid B)
       ( resid 83   and name HN  and segid B)  -17.5800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name N   and segid B)
       ( resid 84   and name HN  and segid B)  -2.0500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 85   and name N   and segid B)
       ( resid 85   and name HN  and segid B)  -6.2300  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name N   and segid B)
       ( resid 87   and name HN  and segid B)  -4.1000  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 88   and name N   and segid B)
       ( resid 88   and name HN  and segid B)  -5.2400  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 89   and name N   and segid B)
       ( resid 89   and name HN  and segid B)  -11.0500  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name NE1 and segid B)
       ( resid 62   and name HE1 and segid B)  4.6800  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name NE1 and segid B)
       ( resid 84   and name HE1 and segid B)  15.2200  0.2000






assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 4    and name CA  and segid A)
       ( resid 4    and name C and segid A)  -17.8399  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 5    and name CA  and segid A)
       ( resid 5    and name C and segid A)  -22.9830  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name CA  and segid A)
       ( resid 6    and name C and segid A)  1.5001  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 7    and name CA  and segid A)
       ( resid 7    and name C and segid A)  -9.3218  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name CA  and segid A)
       ( resid 8    and name C and segid A)  5.6252  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9   and name CA  and segid A)
       ( resid 9   and name C and segid A)  -21.4829  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 11   and name CA  and segid A)
       ( resid 11   and name C and segid A)  -1.3393  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 12   and name CA  and segid A)
       ( resid 12   and name C and segid A)  0.6429  0.2000


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15   and name CA  and segid A)
       ( resid 15   and name C and segid A)  27.2153  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16   and name CA  and segid A)
       ( resid 16   and name C and segid A)  0.9643  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name CA  and segid A)
       ( resid 17   and name C and segid A)  -31.2333  0.2000


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20   and name CA  and segid A)
       ( resid 20   and name C and segid A)  -10.2861  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name CA  and segid A)
       ( resid 21   and name C and segid A)  16.3399  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name CA  and segid A)
       ( resid 22   and name C and segid A)  16.1256  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 23   and name CA  and segid A)
       ( resid 23   and name C and segid A)  -22.5008  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name CA  and segid A)
       ( resid 24   and name C and segid A)  24.9652  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name CA  and segid A)
       ( resid 25   and name C and segid A)  24.9652  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 26   and name CA  and segid A)
       ( resid 26   and name C and segid A)  -12.5362  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name CA  and segid A)
       ( resid 27   and name C and segid A)  18.3757  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 29   and name CA  and segid A)
       ( resid 29   and name C and segid A)  -20.5722  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name CA  and segid A)
       ( resid 30   and name C and segid A)  -16.9827  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name CA  and segid A)
       ( resid 31   and name C and segid A)  9.4289  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 32   and name CA  and segid A)
       ( resid 32   and name C and segid A)  9.6432  0.2000


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 34   and name CA  and segid A)
       ( resid 34   and name C and segid A)  4.8216  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name CA  and segid A)
       ( resid 35   and name C and segid A)  2.6251  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 36   and name CA  and segid A)
       ( resid 36   and name C and segid A)  -7.8217  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name CA  and segid A)
       ( resid 37   and name C and segid A)  -20.5722  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name CA  and segid A)
       ( resid 38   and name C and segid A)  12.3219  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name CA  and segid A)
       ( resid 39   and name C and segid A)  -0.2143  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name CA  and segid A)
       ( resid 40   and name C and segid A)  16.9292  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 41   and name CA  and segid A)
       ( resid 41   and name C and segid A)  21.0008  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name CA  and segid A)
       ( resid 42   and name C and segid A)  -22.7151  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name CA  and segid A)
       ( resid 43   and name C and segid A)  6.7502  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name CA  and segid A)
       ( resid 44   and name C and segid A)  18.5899  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 46   and name CA  and segid A)
       ( resid 46   and name C and segid A)  -11.6254  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name CA  and segid A)
       ( resid 47   and name C and segid A)  17.7863  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 49   and name CA  and segid A)
       ( resid 49   and name C and segid A)  -23.4116  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name CA  and segid A)
       ( resid 50   and name C and segid A)  6.5895  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name CA  and segid A)
       ( resid 51   and name C and segid A)  15.9649  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name CA  and segid A)
       ( resid 52   and name C and segid A)  -2.3572  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name CA  and segid A)
       ( resid 53   and name C and segid A)  -15.2148  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name CA  and segid A)
       ( resid 54   and name C and segid A)  22.2865  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 55   and name CA  and segid A)
       ( resid 55   and name C and segid A)  -27.3760  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56   and name CA  and segid A)
       ( resid 56   and name C and segid A)  0.3214  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name CA  and segid A)
       ( resid 57   and name C and segid A)  0.5893  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name CA  and segid A)
       ( resid 58   and name C and segid A)  21.1079  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name CA  and segid A)
       ( resid 59   and name C and segid A)  -10.0182  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 60   and name CA  and segid A)
       ( resid 60   and name C and segid A)  4.0716  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name CA  and segid A)
       ( resid 61   and name C and segid A)  10.2325  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name CA  and segid A)
       ( resid 62   and name C and segid A)  1.1250  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 63   and name CA  and segid A)
       ( resid 63   and name C and segid A)  -14.6791  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name CA  and segid A)
       ( resid 64   and name C and segid A)  21.0543  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 65   and name CA  and segid A)
       ( resid 65   and name C and segid A)  24.4294  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name CA  and segid A)
       ( resid 66   and name C and segid A)  -16.8220  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name CA  and segid A)
       ( resid 67   and name C and segid A)  -31.8761  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name CA  and segid A)
       ( resid 68   and name C and segid A)  13.7683  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name CA  and segid A)
       ( resid 69   and name C and segid A)  12.5362  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 71   and name CA  and segid A)
       ( resid 71   and name C and segid A)  12.0540  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name CA  and segid A)
       ( resid 72   and name C and segid A)  -10.7682  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name CA  and segid A)
       ( resid 73   and name C and segid A)  -38.0906  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name CA  and segid A)
       ( resid 74   and name C and segid A)  7.6074  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name CA  and segid A)
       ( resid 75   and name C and segid A)  16.1256  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name CA  and segid A)
       ( resid 76   and name C and segid A)  -15.5898  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77   and name CA  and segid A)
       ( resid 77   and name C and segid A)  -0.8572  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 78   and name CA  and segid A)
       ( resid 78   and name C and segid A)  8.3574  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name CA  and segid A)
       ( resid 79   and name C and segid A)  7.8753  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name CA  and segid A)
       ( resid 80   and name C and segid A)  -19.4471  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name CA  and segid A)
       ( resid 81   and name C and segid A)  6.4824  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name CA  and segid A)
       ( resid 82   and name C and segid A)  14.4648  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 83   and name CA  and segid A)
       ( resid 83   and name C and segid A)  12.7505  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name CA  and segid A)
       ( resid 84   and name C and segid A)  -19.0721  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 86   and name CA  and segid A)
       ( resid 86   and name C and segid A)  9.3753  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name CA  and segid A)
       ( resid 87   and name C and segid A)  -15.3220  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 88   and name CA  and segid A)
       ( resid 88   and name C and segid A)  -13.9291  0.2000




assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 4    and name CA  and segid B)
       ( resid 4    and name C and segid B)  -17.8399  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 5    and name CA  and segid B)
       ( resid 5    and name C and segid B)  -22.9830  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name CA  and segid B)
       ( resid 6    and name C and segid B)  1.5001  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 7    and name CA  and segid B)
       ( resid 7    and name C and segid B)  -9.3218  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name CA  and segid B)
       ( resid 8    and name C and segid B)  5.6252  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9   and name CA  and segid B)
       ( resid 9   and name C and segid B)  -21.4829  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 11   and name CA  and segid B)
       ( resid 11   and name C and segid B)  -1.3393  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 12   and name CA  and segid B)
       ( resid 12   and name C and segid B)  0.6429  0.2000


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15   and name CA  and segid B)
       ( resid 15   and name C and segid B)  27.2153  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16   and name CA  and segid B)
       ( resid 16   and name C and segid B)  0.9643  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name CA  and segid B)
       ( resid 17   and name C and segid B)  -31.2333  0.2000


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20   and name CA  and segid B)
       ( resid 20   and name C and segid B)  -10.2861  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name CA  and segid B)
       ( resid 21   and name C and segid B)  16.3399  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name CA  and segid B)
       ( resid 22   and name C and segid B)  16.1256  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 23   and name CA  and segid B)
       ( resid 23   and name C and segid B)  -22.5008  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name CA  and segid B)
       ( resid 24   and name C and segid B)  24.9652  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name CA  and segid B)
       ( resid 25   and name C and segid B)  24.9652  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 26   and name CA  and segid B)
       ( resid 26   and name C and segid B)  -12.5362  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name CA  and segid B)
       ( resid 27   and name C and segid B)  18.3757  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 29   and name CA  and segid B)
       ( resid 29   and name C and segid B)  -20.5722  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name CA  and segid B)
       ( resid 30   and name C and segid B)  -16.9827  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name CA  and segid B)
       ( resid 31   and name C and segid B)  9.4289  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 32   and name CA  and segid B)
       ( resid 32   and name C and segid B)  9.6432  0.2000


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 34   and name CA  and segid B)
       ( resid 34   and name C and segid B)  4.8216  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name CA  and segid B)
       ( resid 35   and name C and segid B)  2.6251  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 36   and name CA  and segid B)
       ( resid 36   and name C and segid B)  -7.8217  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name CA  and segid B)
       ( resid 37   and name C and segid B)  -20.5722  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name CA  and segid B)
       ( resid 38   and name C and segid B)  12.3219  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name CA  and segid B)
       ( resid 39   and name C and segid B)  -0.2143  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name CA  and segid B)
       ( resid 40   and name C and segid B)  16.9292  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 41   and name CA  and segid B)
       ( resid 41   and name C and segid B)  21.0008  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name CA  and segid B)
       ( resid 42   and name C and segid B)  -22.7151  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name CA  and segid B)
       ( resid 43   and name C and segid B)  6.7502  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name CA  and segid B)
       ( resid 44   and name C and segid B)  18.5899  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 46   and name CA  and segid B)
       ( resid 46   and name C and segid B)  -11.6254  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name CA  and segid B)
       ( resid 47   and name C and segid B)  17.7863  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 49   and name CA  and segid B)
       ( resid 49   and name C and segid B)  -23.4116  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name CA  and segid B)
       ( resid 50   and name C and segid B)  6.5895  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name CA  and segid B)
       ( resid 51   and name C and segid B)  15.9649  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name CA  and segid B)
       ( resid 52   and name C and segid B)  -2.3572  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name CA  and segid B)
       ( resid 53   and name C and segid B)  -15.2148  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name CA  and segid B)
       ( resid 54   and name C and segid B)  22.2865  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 55   and name CA  and segid B)
       ( resid 55   and name C and segid B)  -27.3760  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56   and name CA  and segid B)
       ( resid 56   and name C and segid B)  0.3214  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name CA  and segid B)
       ( resid 57   and name C and segid B)  0.5893  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name CA  and segid B)
       ( resid 58   and name C and segid B)  21.1079  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name CA  and segid B)
       ( resid 59   and name C and segid B)  -10.0182  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 60   and name CA  and segid B)
       ( resid 60   and name C and segid B)  4.0716  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name CA  and segid B)
       ( resid 61   and name C and segid B)  10.2325  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name CA  and segid B)
       ( resid 62   and name C and segid B)  1.1250  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 63   and name CA  and segid B)
       ( resid 63   and name C and segid B)  -14.6791  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name CA  and segid B)
       ( resid 64   and name C and segid B)  21.0543  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 65   and name CA  and segid B)
       ( resid 65   and name C and segid B)  24.4294  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name CA  and segid B)
       ( resid 66   and name C and segid B)  -16.8220  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name CA  and segid B)
       ( resid 67   and name C and segid B)  -31.8761  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name CA  and segid B)
       ( resid 68   and name C and segid B)  13.7683  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name CA  and segid B)
       ( resid 69   and name C and segid B)  12.5362  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 71   and name CA  and segid B)
       ( resid 71   and name C and segid B)  12.0540  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name CA  and segid B)
       ( resid 72   and name C and segid B)  -10.7682  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name CA  and segid B)
       ( resid 73   and name C and segid B)  -38.0906  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name CA  and segid B)
       ( resid 74   and name C and segid B)  7.6074  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name CA  and segid B)
       ( resid 75   and name C and segid B)  16.1256  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name CA  and segid B)
       ( resid 76   and name C and segid B)  -15.5898  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77   and name CA  and segid B)
       ( resid 77   and name C and segid B)  -0.8572  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 78   and name CA  and segid B)
       ( resid 78   and name C and segid B)  8.3574  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name CA  and segid B)
       ( resid 79   and name C and segid B)  7.8753  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name CA  and segid B)
       ( resid 80   and name C and segid B)  -19.4471  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name CA  and segid B)
       ( resid 81   and name C and segid B)  6.4824  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name CA  and segid B)
       ( resid 82   and name C and segid B)  14.4648  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 83   and name CA  and segid B)
       ( resid 83   and name C and segid B)  12.7505  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name CA  and segid B)
       ( resid 84   and name C and segid B)  -19.0721  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 86   and name CA  and segid B)
       ( resid 86   and name C and segid B)  9.3753  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name CA  and segid B)
       ( resid 87   and name C and segid B)  -15.3220  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 88   and name CA  and segid B)
       ( resid 88   and name C and segid B)  -13.9291  0.2000





assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name N   and segid A)
       ( resid 5    and name C  and segid A)  14.5464  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name N   and segid A)
       ( resid 7    and name C  and segid A)  -3.3430  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9    and name N   and segid A)
       ( resid 8    and name C  and segid A)  12.3780  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name N   and segid A)
       ( resid 9    and name C  and segid A)  10.1193  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name N   and segid A)
       ( resid 12   and name C  and segid A)  14.4561  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name N   and segid A)
       ( resid 16   and name C  and segid A)  4.0658  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name N   and segid A)
       ( resid 17   and name C  and segid A)  1.0842  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name N   and segid A)
       ( resid 20   and name C  and segid A)  -7.7702  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name N   and segid A)
       ( resid 21   and name C  and segid A)  -14.6368  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name N   and segid A)
       ( resid 23   and name C  and segid A)  16.8052  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name N   and segid A)
       ( resid 24   and name C  and segid A)  -29.0025  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name N   and segid A)
       ( resid 26   and name C  and segid A)  -11.0228  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name N   and segid A)
       ( resid 27   and name C  and segid A)  -4.1561  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name N   and segid A)
       ( resid 29   and name C  and segid A)  12.1973  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name N   and segid A)
       ( resid 30   and name C  and segid A)  17.6184  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name N   and segid A)
       ( resid 32   and name C  and segid A)  13.3719  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name N   and segid A)
       ( resid 34   and name C  and segid A)  1.9877  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name N   and segid A)
       ( resid 36   and name C  and segid A)  17.5280  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name N   and segid A)
       ( resid 37   and name C  and segid A)  12.3780  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name N   and segid A)
       ( resid 38   and name C  and segid A)  -13.2815  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name N   and segid A)
       ( resid 39   and name C  and segid A)  3.5237  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name N   and segid A)
       ( resid 41   and name C  and segid A)  8.4930  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name N   and segid A)
       ( resid 42   and name C  and segid A)  -14.3657  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name N   and segid A)
       ( resid 43   and name C  and segid A)  7.5895  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name N   and segid A)
       ( resid 44   and name C  and segid A)  -28.1894  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name N   and segid A)
       ( resid 46   and name C  and segid A)  0.6325  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48   and name N   and segid A)
       ( resid 47   and name C  and segid A)  -14.1850  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name N   and segid A)
       ( resid 49   and name C  and segid A)  -7.4991  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name N   and segid A)
       ( resid 50   and name C  and segid A)  11.6552  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name N   and segid A)
       ( resid 52   and name C  and segid A)  -8.0412  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name N   and segid A)
       ( resid 53   and name C  and segid A)  -7.4991  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name N   and segid A)
       ( resid 56   and name C  and segid A)  13.8236  0.2000


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name N   and segid A)
       ( resid 58   and name C  and segid A)  14.5464  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name N   and segid A)
       ( resid 60   and name C  and segid A)  3.7947  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name N   and segid A)
       ( resid 61   and name C  and segid A)  -14.4561  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name N   and segid A)
       ( resid 63   and name C  and segid A)  4.6982  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name N   and segid A)
       ( resid 65   and name C  and segid A)  11.8359  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name N   and segid A)
       ( resid 66   and name C  and segid A)  -21.1420  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name N   and segid A)
       ( resid 67   and name C  and segid A)  16.0824  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name N   and segid A)
       ( resid 68   and name C  and segid A)  -5.5114  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name N   and segid A)
       ( resid 69   and name C  and segid A)  -12.3780  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name N   and segid A)
       ( resid 71   and name C  and segid A)  -19.5157  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name N   and segid A)
       ( resid 72   and name C  and segid A)  13.8236  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name N   and segid A)
       ( resid 73   and name C  and segid A)  13.0105  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name N   and segid A)
       ( resid 74   and name C  and segid A)  -2.9816  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name N   and segid A)
       ( resid 75   and name C  and segid A)  20.1482  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name N   and segid A)
       ( resid 78   and name C  and segid A)  -14.1850  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name N   and segid A)
       ( resid 79   and name C  and segid A)  11.5649  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name N   and segid A)
       ( resid 80   and name C  and segid A)  17.7991  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name N   and segid A)
       ( resid 81   and name C  and segid A)  12.7394  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name N   and segid A)
       ( resid 83   and name C  and segid A)  21.0517  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 85   and name N   and segid A)
       ( resid 84   and name C  and segid A)  13.4622  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name N   and segid A)
       ( resid 86   and name C  and segid A)  5.8728  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 88   and name N   and segid A)
       ( resid 87   and name C  and segid A)  8.7640  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 89   and name N   and segid A)
       ( resid 88   and name C  and segid A)  16.2631  0.2000





assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name N   and segid B)
       ( resid 5    and name C  and segid B)  14.5464  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name N   and segid B)
       ( resid 7    and name C  and segid B)  -3.3430  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9    and name N   and segid B)
       ( resid 8    and name C  and segid B)  12.3780  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name N   and segid B)
       ( resid 9    and name C  and segid B)  10.1193  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name N   and segid B)
       ( resid 12   and name C  and segid B)  14.4561  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name N   and segid B)
       ( resid 16   and name C  and segid B)  4.0658  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name N   and segid B)
       ( resid 17   and name C  and segid B)  1.0842  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name N   and segid B)
       ( resid 20   and name C  and segid B)  -7.7702  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name N   and segid B)
       ( resid 21   and name C  and segid B)  -14.6368  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name N   and segid B)
       ( resid 23   and name C  and segid B)  16.8052  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name N   and segid B)
       ( resid 24   and name C  and segid B)  -29.0025  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name N   and segid B)
       ( resid 26   and name C  and segid B)  -11.0228  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name N   and segid B)
       ( resid 27   and name C  and segid B)  -4.1561  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name N   and segid B)
       ( resid 29   and name C  and segid B)  12.1973  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name N   and segid B)
       ( resid 30   and name C  and segid B)  17.6184  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name N   and segid B)
       ( resid 32   and name C  and segid B)  13.3719  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name N   and segid B)
       ( resid 34   and name C  and segid B)  1.9877  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name N   and segid B)
       ( resid 36   and name C  and segid B)  17.5280  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name N   and segid B)
       ( resid 37   and name C  and segid B)  12.3780  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name N   and segid B)
       ( resid 38   and name C  and segid B)  -13.2815  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name N   and segid B)
       ( resid 39   and name C  and segid B)  3.5237  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name N   and segid B)
       ( resid 41   and name C  and segid B)  8.4930  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name N   and segid B)
       ( resid 42   and name C  and segid B)  -14.3657  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name N   and segid B)
       ( resid 43   and name C  and segid B)  7.5895  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name N   and segid B)
       ( resid 44   and name C  and segid B)  -28.1894  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name N   and segid B)
       ( resid 46   and name C  and segid B)  0.6325  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48   and name N   and segid B)
       ( resid 47   and name C  and segid B)  -14.1850  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name N   and segid B)
       ( resid 49   and name C  and segid B)  -7.4991  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name N   and segid B)
       ( resid 50   and name C  and segid B)  11.6552  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name N   and segid B)
       ( resid 52   and name C  and segid B)  -8.0412  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name N   and segid B)
       ( resid 53   and name C  and segid B)  -7.4991  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name N   and segid B)
       ( resid 56   and name C  and segid B)  13.8236  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name N   and segid B)
       ( resid 58   and name C  and segid B)  14.5464  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name N   and segid B)
       ( resid 60   and name C  and segid B)  3.7947  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name N   and segid B)
       ( resid 61   and name C  and segid B)  -14.4561  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64   and name N   and segid B)
       ( resid 63   and name C  and segid B)  4.6982  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name N   and segid B)
       ( resid 65   and name C  and segid B)  11.8359  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67   and name N   and segid B)
       ( resid 66   and name C  and segid B)  -21.1420  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 68   and name N   and segid B)
       ( resid 67   and name C  and segid B)  16.0824  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name N   and segid B)
       ( resid 68   and name C  and segid B)  -5.5114  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name N   and segid B)
       ( resid 69   and name C  and segid B)  -12.3780  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name N   and segid B)
       ( resid 71   and name C  and segid B)  -19.5157  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name N   and segid B)
       ( resid 72   and name C  and segid B)  13.8236  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name N   and segid B)
       ( resid 73   and name C  and segid B)  13.0105  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name N   and segid B)
       ( resid 74   and name C  and segid B)  -2.9816  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name N   and segid B)
       ( resid 75   and name C  and segid B)  20.1482  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name N   and segid B)
       ( resid 78   and name C  and segid B)  -14.1850  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name N   and segid B)
       ( resid 79   and name C  and segid B)  11.5649  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name N   and segid B)
       ( resid 80   and name C  and segid B)  17.7991  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name N   and segid B)
       ( resid 81   and name C  and segid B)  12.7394  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name N   and segid B)
       ( resid 83   and name C  and segid B)  21.0517  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 85   and name N   and segid B)
       ( resid 84   and name C  and segid B)  13.4622  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name N   and segid B)
       ( resid 86   and name C  and segid B)  5.8728  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 88   and name N   and segid B)
       ( resid 87   and name C  and segid B)  8.7640  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 89   and name N   and segid B)
       ( resid 88   and name C  and segid B)  16.2631  0.2000





assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name HN  and segid A)
       ( resid 5    and name C  and segid A)  5.3495  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name HN  and segid A)
       ( resid 7    and name C  and segid A)  -11.5198  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9    and name HN  and segid A)
       ( resid 8    and name C  and segid A)  -7.1125  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name HN  and segid A)
       ( resid 9    and name C  and segid A)  2.0061  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name HN  and segid A)
       ( resid 12   and name C  and segid A)  5.2584  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name HN  and segid A)
       ( resid 16   and name C  and segid A)  13.3435  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name HN  and segid A)
       ( resid 17   and name C  and segid A)  9.0274  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name HN  and segid A)
       ( resid 20   and name C  and segid A)  5.8359  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name HN  and segid A)
       ( resid 21   and name C  and segid A)  -22.340  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name HN  and segid A)
       ( resid 23   and name C  and segid A)  4.3465  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name HN  and segid A)
       ( resid 24   and name C  and segid A)  -24.0736  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name HN  and segid A)
       ( resid 26   and name C  and segid A)  -1.7933  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name HN  and segid A)
       ( resid 27   and name C  and segid A)  -11.6413  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name HN  and segid A)
       ( resid 29   and name C  and segid A)  17.3556  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name HN  and segid A)
       ( resid 30   and name C  and segid A)  2.6444  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name HN  and segid A)
       ( resid 32   and name C  and segid A)  5.6231  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name HN  and segid A)
       ( resid 34   and name C  and segid A)  -15.658  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name HN  and segid A)
       ( resid 36   and name C  and segid A)  7.2948  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name HN  and segid A)
       ( resid 37   and name C  and segid A)  7.2036  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name HN  and segid A)
       ( resid 38   and name C  and segid A)  -22.890  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name HN  and segid A)
       ( resid 39   and name C  and segid A)  -6.4134  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name HN  and segid A)
       ( resid 41   and name C  and segid A)  7.3860  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name HN  and segid A)
       ( resid 42   and name C  and segid A)  8.3587  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name HN  and segid A)
       ( resid 43   and name C  and segid A)  -3.0395  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name HN  and segid A)
       ( resid 44   and name C  and segid A)  -15.446  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name HN  and segid A)
       ( resid 46   and name C  and segid A)  15.7447  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name HN  and segid A)
       ( resid 49   and name C  and segid A)  19.1793  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name HN  and segid A)
       ( resid 50   and name C  and segid A)  7.2036  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name HN  and segid A)
       ( resid 51   and name C  and segid A)  -17.202  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name HN  and segid A)
       ( resid 52   and name C  and segid A)  -10.6687  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name HN  and segid A)
       ( resid 53   and name C  and segid A)  5.0152  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name HN  and segid A)
       ( resid 56   and name C  and segid A)  8.0851  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name HN  and segid A)
       ( resid 57   and name C  and segid A)  -19.426  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name HN  and segid A)
       ( resid 58   and name C  and segid A)  11.2766  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name HN  and segid A)
       ( resid 60   and name C  and segid A)  0.0608  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name HN  and segid A)
       ( resid 61   and name C  and segid A)  -5.2584  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name HN  and segid A)
       ( resid 65   and name C  and segid A)  6.4438  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name HN  and segid A)
       ( resid 68   and name C  and segid A)  -16.508  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name HN  and segid A)
       ( resid 69   and name C  and segid A)  -1.0942  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name HN  and segid A)
       ( resid 71   and name C  and segid A)  -17.4200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name HN  and segid A)
       ( resid 72   and name C  and segid A)  15.3799  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name HN  and segid A)
       ( resid 73   and name C  and segid A)  17.7508  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name HN  and segid A)
       ( resid 74   and name C  and segid A)  -16.934  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name HN  and segid A)
       ( resid 75   and name C  and segid A)  -6.7173  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name HN  and segid A)
       ( resid 78   and name C  and segid A)  -18.2373  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name HN  and segid A)
       ( resid 79   and name C  and segid A)  -1.7325  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name HN  and segid A)
       ( resid 80   and name C  and segid A)  1.4894  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name HN  and segid A)
       ( resid 81   and name C  and segid A)  -0.0912  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 83   and name HN  and segid A)
       ( resid 82   and name C  and segid A)  -22.555  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name HN  and segid A)
       ( resid 83   and name C  and segid A)  16.5653  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name HN  and segid A)
       ( resid 86   and name C  and segid A)  -0.3040  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 89   and name HN  and segid A)
       ( resid 88   and name C  and segid A)  11.1854  0.2000



assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 6    and name HN  and segid B)
       ( resid 5    and name C  and segid B)  5.3495  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 8    and name HN  and segid B)
       ( resid 7    and name C  and segid B)  -11.5198  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 9    and name HN  and segid B)
       ( resid 8    and name C  and segid B)  -7.1125  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 10   and name HN  and segid B)
       ( resid 9    and name C  and segid B)  2.0061  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13   and name HN  and segid B)
       ( resid 12   and name C  and segid B)  5.2584  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17   and name HN  and segid B)
       ( resid 16   and name C  and segid B)  13.3435  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name HN  and segid B)
       ( resid 17   and name C  and segid B)  9.0274  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21   and name HN  and segid B)
       ( resid 20   and name C  and segid B)  5.8359  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name HN  and segid B)
       ( resid 21   and name C  and segid B)  -22.340  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 24   and name HN  and segid B)
       ( resid 23   and name C  and segid B)  4.3465  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 25   and name HN  and segid B)
       ( resid 24   and name C  and segid B)  -24.0736  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27   and name HN  and segid B)
       ( resid 26   and name C  and segid B)  -1.7933  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28   and name HN  and segid B)
       ( resid 27   and name C  and segid B)  -11.6413  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30   and name HN  and segid B)
       ( resid 29   and name C  and segid B)  17.3556  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31   and name HN  and segid B)
       ( resid 30   and name C  and segid B)  2.6444  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33   and name HN  and segid B)
       ( resid 32   and name C  and segid B)  5.6231  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35   and name HN  and segid B)
       ( resid 34   and name C  and segid B)  -15.658  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 37   and name HN  and segid B)
       ( resid 36   and name C  and segid B)  7.2948  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38   and name HN  and segid B)
       ( resid 37   and name C  and segid B)  7.2036  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39   and name HN  and segid B)
       ( resid 38   and name C  and segid B)  -22.890  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40   and name HN  and segid B)
       ( resid 39   and name C  and segid B)  -6.4134  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42   and name HN  and segid B)
       ( resid 41   and name C  and segid B)  7.3860  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43   and name HN  and segid B)
       ( resid 42   and name C  and segid B)  8.3587  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44   and name HN  and segid B)
       ( resid 43   and name C  and segid B)  -3.0395  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45   and name HN  and segid B)
       ( resid 44   and name C  and segid B)  -15.446  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47   and name HN  and segid B)
       ( resid 46   and name C  and segid B)  15.7447  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50   and name HN  and segid B)
       ( resid 49   and name C  and segid B)  19.1793  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51   and name HN  and segid B)
       ( resid 50   and name C  and segid B)  7.2036  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 52   and name HN  and segid B)
       ( resid 51   and name C  and segid B)  -17.202  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53   and name HN  and segid B)
       ( resid 52   and name C  and segid B)  -10.6687  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54   and name HN  and segid B)
       ( resid 53   and name C  and segid B)  5.0152  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57   and name HN  and segid B)
       ( resid 56   and name C  and segid B)  8.0851  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58   and name HN  and segid B)
       ( resid 57   and name C  and segid B)  -19.426  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59   and name HN  and segid B)
       ( resid 58   and name C  and segid B)  11.2766  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61   and name HN  and segid B)
       ( resid 60   and name C  and segid B)  0.0608  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 62   and name HN  and segid B)
       ( resid 61   and name C  and segid B)  -5.2584  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66   and name HN  and segid B)
       ( resid 65   and name C  and segid B)  6.4438  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69   and name HN  and segid B)
       ( resid 68   and name C  and segid B)  -16.508  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70   and name HN  and segid B)
       ( resid 69   and name C  and segid B)  -1.0942  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72   and name HN  and segid B)
       ( resid 71   and name C  and segid B)  -17.4200  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73   and name HN  and segid B)
       ( resid 72   and name C  and segid B)  15.3799  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74   and name HN  and segid B)
       ( resid 73   and name C  and segid B)  17.7508  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75   and name HN  and segid B)
       ( resid 74   and name C  and segid B)  -16.934  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76   and name HN  and segid B)
       ( resid 75   and name C  and segid B)  -6.7173  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79   and name HN  and segid B)
       ( resid 78   and name C  and segid B)  -18.2373  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80   and name HN  and segid B)
       ( resid 79   and name C  and segid B)  -1.7325  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81   and name HN  and segid B)
       ( resid 80   and name C  and segid B)  1.4894  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 82   and name HN  and segid B)
       ( resid 81   and name C  and segid B)  -0.0912  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 83   and name HN  and segid B)
       ( resid 82   and name C  and segid B)  -22.555  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 84   and name HN  and segid B)
       ( resid 83   and name C  and segid B)  16.5653  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87   and name HN  and segid B)
       ( resid 86   and name C  and segid B)  -0.3040  0.2000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 89   and name HN  and segid B)
       ( resid 88   and name C  and segid B)  11.1854  0.2000



6. 1H Methyl chemical shift restraints


!
! T2
OBSE (resid   2 and name HG2# and segid A)      1.226
! T3
OBSE (resid   3 and name HG2# and segid A)      1.048
! V11
OBSE (resid  11 and name HG1# and segid A)      1.090
OBSE (resid  11 and name HG2# and segid A)      1.010
! A12
OBSE (resid  12 and name HB#  and segid A)      1.540
! M15
OBSE (resid  15 and name HE#  and segid A)      0.482
! V20
OBSE (resid  20 and name HG1# and segid A)      0.980
OBSE (resid  20 and name HG2# and segid A)      1.064
! L23
OBSE (resid  23 and name HD1# and segid A)      0.865
OBSE (resid  23 and name HD2# and segid A)      0.066
! A24
OBSE (resid  24 and name HB#  and segid A)      1.330
! I26
OBSE (resid  26 and name HD#  and segid A)      0.555
OBSE (resid  26 and name HG2# and segid A)      0.721
! V29
OBSE (resid  29 and name HG1# and segid A)      0.970
OBSE (resid  29 and name HG2# and segid A)      1.082
! L30
OBSE (resid  30 and name HD1# and segid A)      0.953
OBSE (resid  30 and name HD2# and segid A)      0.779
! L34
OBSE (resid  34 and name HD1# and segid A)      0.780
OBSE (resid  34 and name HD2# and segid A)      0.530
! A42
OBSE (resid  42 and name HB#  and segid A)      1.405
! V44
OBSE (resid  44 and name HG1# and segid A)      1.150
OBSE (resid  44 and name HG2# and segid A)      0.722
! V45
OBSE (resid  45 and name HG1# and segid A)      1.190
OBSE (resid  45 and name HG2# and segid A)      1.117
! L46
OBSE (resid  46 and name HD1# and segid A)      0.895
OBSE (resid  46 and name HD2# and segid A)      0.750
! L50
OBSE (resid  50 and name HD1# and segid A)      1.050
OBSE (resid  50 and name HD2# and segid A)      0.816
! V51
OBSE (resid  51 and name HG1# and segid A)      1.010
OBSE (resid  51 and name HG2# and segid A)      1.093
! L58
OBSE (resid  58 and name HD1# and segid A)      1.027
OBSE (resid  58 and name HD2# and segid A)      0.933
! T66
OBSE (resid  66 and name HG2# and segid A)      0.674
! A69
OBSE (resid  69 and name HB#  and segid A)      1.033
! N70
! A71
OBSE (resid  71 and name HB#  and segid A)      1.440
! L81
OBSE (resid  81 and name HD1# and segid A)      0.325
OBSE (resid  81 and name HD2# and segid A)      0.448
! A87
OBSE (resid  87 and name HB#  and segid A)      0.651
! L89
OBSE (resid  89 and name HD1# and segid A)      1.120
OBSE (resid  89 and name HD2# and segid A)      0.851

!
! T2
OBSE (resid   2 and name HG2# and segid B)      1.226
! T3
OBSE (resid   3 and name HG2# and segid B)      1.048
! V11
OBSE (resid  11 and name HG1# and segid B)      1.090
OBSE (resid  11 and name HG2# and segid B)      1.010
! A12
OBSE (resid  12 and name HB#  and segid B)      1.540
! M15
OBSE (resid  15 and name HE#  and segid B)      0.482
! V20
OBSE (resid  20 and name HG1# and segid B)      0.980
OBSE (resid  20 and name HG2# and segid B)      1.064
! L23
OBSE (resid  23 and name HD1# and segid B)      0.865
OBSE (resid  23 and name HD2# and segid B)      0.066
! A24
OBSE (resid  24 and name HB#  and segid B)      1.330
! I26
OBSE (resid  26 and name HD#  and segid B)      0.555
OBSE (resid  26 and name HG2# and segid B)      0.721
! V29
OBSE (resid  29 and name HG1# and segid B)      0.970
OBSE (resid  29 and name HG2# and segid B)      1.082
! L30
OBSE (resid  30 and name HD1# and segid B)      0.953
OBSE (resid  30 and name HD2# and segid B)      0.779
! L34
OBSE (resid  34 and name HD1# and segid B)      0.780
OBSE (resid  34 and name HD2# and segid B)      0.530
! A42
OBSE (resid  42 and name HB#  and segid B)      1.405
! V44
OBSE (resid  44 and name HG1# and segid B)      1.150
OBSE (resid  44 and name HG2# and segid B)      0.722
! V45
OBSE (resid  45 and name HG1# and segid B)      1.190
OBSE (resid  45 and name HG2# and segid B)      1.117
! L46
OBSE (resid  46 and name HD1# and segid B)      0.895
OBSE (resid  46 and name HD2# and segid B)      0.750
! L50
OBSE (resid  50 and name HD1# and segid B)      1.050
OBSE (resid  50 and name HD2# and segid B)      0.816
! V51
OBSE (resid  51 and name HG1# and segid B)      1.010
OBSE (resid  51 and name HG2# and segid B)      1.093
! L58
OBSE (resid  58 and name HD1# and segid B)      1.027
OBSE (resid  58 and name HD2# and segid B)      0.933
! T66
OBSE (resid  66 and name HG2# and segid B)      0.674
! A69
OBSE (resid  69 and name HB#  and segid B)      1.033
! N70
! A71
OBSE (resid  71 and name HB#  and segid B)      1.440
! L81
OBSE (resid  81 and name HD1# and segid B)      0.325
OBSE (resid  81 and name HD2# and segid B)      0.448
! A87
OBSE (resid  87 and name HB#  and segid B)      0.651
! L89
OBSE (resid  89 and name HD1# and segid B)      1.120
OBSE (resid  89 and name HD2# and segid B)      0.851



!
! L52
OBSE (resid  52 and name HD1# and segid A)  (resid  52 and name HD2# and segid A)    0.850    0.790
! L63
OBSE (resid  63 and name HD1# and segid A)  (resid  63 and name HD2# and segid A)    0.572    0.640

! L52
OBSE (resid  52 and name HD1# and segid B)  (resid  52 and name HD2# and segid B)    0.850    0.790
! L63
OBSE (resid  63 and name HD1# and segid B)  (resid  63 and name HD2# and segid B)    0.572    0.640




7. 1H, 13C, 15N assignments



SHIFT_FL_FRMT		RES_SIAD 
FIRST_RES_IN_SEQ	1

EXP_PEAK_PICK_TBL
	Label   Exp Par Fl            Peak-Pick Fl          #-Cross-Ref
	 A        barf_40c.DAT          hsqc                   178
	 B        ft/C                  cbcaconh              1127

RES_ID		1
RES_TYPE	MET
SPIN_SYSTEM_ID	1
HETEROGENEITY	100
   HA  4.557
   CA  55.8144  
   HB1|HB2  2.088
   HB2|HB1  1.987
   CB  33.4221 
   HG1|HG2  2.557
   HG2|HG1  2.503
   CG  32.240
   C  176.405
END_RES_DEF

RES_ID		2
RES_TYPE	THR
PREV_TYPE	MET(24.5)  
SPIN_SYSTEM_ID	2
HETEROGENEITY	100
   HN  8.2312 (A.63 B.117 B.118) 
   N  114.9877 (A.63 B.117 B.118) 
   CA:-1  55.8144 (B.117) 
   CB:-1  33.4221 (B.118) 
   HA  4.449
   CA  61.9400
   HB  4.320
   CB  70.1200
   CG2  21.891
   HG2#  1.226
   C  175.0461
END_RES_DEF

RES_ID		3
RES_TYPE	THR
PREV_TYPE	THR(100.0)  
SPIN_SYSTEM_ID	3
HETEROGENEITY	100
   CA:-1  61.9116 (B.155) 
   CB:-1  70.1203 (B.154) 
   HN  8.1737 (B.154 B.155 B.205) 
   N  116.0275 (B.154 B.155 B.205) 
   HA  4.272
   CA  62.8528 (B.205) 
   HB  4.083
   CB  70.1300
   HG2#  1.048
   CG2  22.007
END_RES_DEF

RES_ID		4
RES_TYPE	SER
PREV_TYPE	THR(100.0)  
SPIN_SYSTEM_ID	4
HETEROGENEITY	100
   HN  8.3552 (A.39 B.67 B.68 B.107 B.108 B.109) 
   N  117.1937 (A.39 B.67 B.68 B.107 B.108 B.109) 
   CA:-1  62.7073 (B.67) 
   CB:-1  70.3349 (B.68 B.109) 
   HA  4.486
   CA  58.8094 (B.108) 
   HB1|HB2  4.002
   HB2|HB1  4.175
   CB  64.590
   C  175.7096
END_RES_DEF

RES_ID		5
RES_TYPE	GLN
PREV_TYPE	SER(100.0)  
SPIN_SYSTEM_ID	5
HETEROGENEITY	100
   CA:-1  58.7811 (B.175) 
   CB:-1  64.5836 (B.174) 
   HN  8.5717 (B.174 B.175 B.224) 
   N  123.2410 (B.174 B.175 B.224) 
   HA  4.020
   CA  58.7500
   CB  28.9457 (B.224) 
   HB1|HB2  2.107
   HB2|HB1  2.21
   CG  33.763
   HG1|HG2  2.450
   NE2  114.48
   HE21|HE22  7.867 
   HE22|HE21  6.863
   C  177.4594
END_RES_DEF

RES_ID		6
RES_TYPE	LYS
PREV_TYPE	CYS(23.9)  GLN(22.8)  GLU(21.4)  ARG(14.0)  TRP(10.9)  
SPIN_SYSTEM_ID	6
HETEROGENEITY	100
   HN  8.2832 (A.38 B.65 B.66 B.103 B.104 B.105 B.106) 
   N  118.2600 (A.38 B.65 B.66 B.103 B.104 B.105 B.106) 
   CA:-1  58.5584 (B.65 B.104) 
   CB:-1  28.7015 (B.66 B.106) 
   CA  59.9050 (B.103) 
   HA  4.178
   CB  32.9873 (B.105) 
   HB1|HB2  1.765
   HB2|HB1  1.826
   CG  26.170
   HG1|HG2  1.68
   HG2|HG1  1.35
   CD  29.65
   HD1|HD2  1.762
   HD2|HD1  1.647
   CE  42.53
   HE1|HE2  2.774
   HE2|HE1  2.972
END_RES_DEF

RES_ID		7
RES_TYPE	HIS
PREV_TYPE	LYS(45.1)  MET(23.4)  VAL(17.2)  PRO(8.3)  TRP(6.1)  
SPIN_SYSTEM_ID	7
HETEROGENEITY	100
   HN  8.1660 (A.43 B.75 B.76 B.117) 
   N  119.0645 (A.43 B.75 B.76 B.117) 
   CA:-1  59.9106 (B.76) 
   CB:-1  32.9945 (B.75) 
   CA  60.3000
   HA  4.210
   CB  31.5690 (B.117) 
   HB1|HB2  3.485
   HB2|HB1  3.030
   HE1  7.527
   CE1  137.64
   HD2  6.851
   CD2  118.75
   C  176.2608
END_RES_DEF

RES_ID		8
RES_TYPE	ARG
PREV_TYPE	LYS(35.9)  TRP(16.9)  VAL(14.0)  MET(11.5)  PRO(10.4)  \
		ARG(7.6)  
SPIN_SYSTEM_ID	8
HETEROGENEITY	100
   HN  8.0926 (A.48 B.91 B.92 B.130 B.131) 
   N  118.2206 (A.48 B.91 B.92 B.130 B.131) 
   CA:-1  60.2990 (B.91) 
   CB:-1  31.5612 (B.92) 
   CA  59.7204 (B.131)
   HA  4.029
   CB  30.4970 (B.130) 
   HB#  1.943
   CG  27.907
   HG#  1.672
   CD  44.053
   HD#  3.256
   C  178.5988
END_RES_DEF

RES_ID		9
RES_TYPE	ASP
PREV_TYPE	TRP(27.2)  ARG(24.4)  GLU(16.8)  LYS(10.0)  CYS(6.3)  
SPIN_SYSTEM_ID	9
HETEROGENEITY	100
   HN  8.5213 (A.36 B.61 B.62 B.99 B.100) 
   N  117.8516 (A.36 B.61 B.62 B.99 B.100) 
   CA:-1  59.5963 (B.61) 
   CB:-1  30.5387 (B.62) 
   CA  56.5494 (B.99) 
   HA  4.466
   CB  40.8421 (B.100) 
   HB1|HB2  2.750
   HB2|HB1  2.658
   C  177.6013
END_RES_DEF

RES_ID		10
RES_TYPE	PHE
PREV_TYPE	ASP(30.8)  PHE(27.1)  TYR(26.3)  LEU(14.0)  
SPIN_SYSTEM_ID	10
HETEROGENEITY	100
   HN  8.0391 (A.47 B.89 B.90 B.127 B.128 B.129) 
   N  119.0528 (A.47 B.89 B.90 B.127 B.128 B.129) 
   CA:-1  56.5586 (B.90 B.129) 
   CB:-1  40.7590 (B.89 B.128) 
   CA  62.0866 (B.127) 
   HA  3.990
   CB  40.3860
   HB1|HB2  3.357
   HB2|HB1  3.079
   CD1|CD2  132.21
   HD1|HD2  6.945
   CE1|CE2  132.11
   HE1|HE2  7.284
   CZ  128.89
   HZ  7.520
   C  177.853
END_RES_DEF

RES_ID		11
RES_TYPE	VAL
PREV_TYPE	ILE(53.9)  PHE(26.1)  TYR(19.9)  
SPIN_SYSTEM_ID	11
HETEROGENEITY	100
   HN  8.0720 (A.79 B.144 B.145 B.194 B.195) 
   N  109.4260 (A.79 B.144 B.145 B.194 B.195) 
   CA:-1  62.0930 (B.145) 
   CB:-1  40.4955 (B.144) 
   CA  63.8241 (B.194) 
   HA  4.307
   CB  32.0423 (B.195) 
   HB  2.320
   CG1|CG2  22.799
   HG1#|HG2#  1.09
   CG2|CG1  19.880
   HG2#|HG1#  1.01
   C  175.3066
END_RES_DEF

RES_ID		12
RES_TYPE	ALA
PREV_TYPE	GLU(19.5)  CYS(18.1)  GLN(17.1)  ARG(15.6)  HIS(12.7)  \
		HIH(6.7)  TRP(6.3)  
SPIN_SYSTEM_ID	12
HETEROGENEITY	100
   HN  7.1465 (A.54 A.55 B.102 B.103 B.145 B.146) 
   N  119.0146 (A.54 A.55 B.102 B.103 B.145 B.146) 
   CA:-1  63.7812 (B.102) 
   CB:-1  29.1982 (B.103) 
   CA  52.7262 (B.146) 
   HA  4.428
   CB  20.6724 (B.145) 
   HB#  1.54
   C  177.2970
END_RES_DEF

RES_ID		13
RES_TYPE	GLU
PREV_TYPE	ALA(100.0)  
SPIN_SYSTEM_ID	13
HETEROGENEITY	100
   HN  7.4426 (A.66 B.119 B.120 B.164 B.165 B.166 B.167) 
   N  114.1581 (A.66 B.119 B.120 B.164 B.165 B.166 B.167) 
   CA:-1  52.7839 (B.119 B.166) 
   CB:-1  20.6668 (B.120 B.165) 
   CA  53.7560 (B.167) 
   HA  4.94
   CB  30.5940 (B.164) 
   HB1|HB2  1.99
   HB2|HB1  1.93
   CG  33.83
   HG1|HG2  2.23
   HG2|HG1  2.17
END_RES_DEF

RES_ID		14
RES_TYPE	PRO
SPIN_SYSTEM_ID	14
HETEROGENEITY	100
   CA  64.2944
   HA  4.04
   CB  31.7786
   HB1|HB2  1.667
   HB2|HB1  2.411
   CG  27.850 
   HG1|HG2  1.94
   CD  51.044
   HD1|HD2  3.52
   C  176.2470
END_RES_DEF

RES_ID		15
RES_TYPE	MET
PREV_TYPE	PRO(49.6)  
SPIN_SYSTEM_ID	15
HETEROGENEITY	100
   HN  8.2936 (A.14 B.20 B.21 B.34 B.35 B.36 B.37) 
   N  123.0812 (A.14 B.20 B.21 B.34 B.35 B.36 B.37) 
   CA:-1  64.2944 (B.20 B.34) 
   CB:-1  31.7786 (B.21 B.37) 
   CA  57.2356 (B.35) 
   HA  4.229
   CB  34.7059 (B.36) 
   HB1|HB2  1.53
   HB2|HB1  1.72
   CG  30.379
   HG1|HG2  2.18
   HG2|HG1  1.671
   CE  16.50
   HE#  0.482
   C  176.817
END_RES_DEF

RES_ID		16
RES_TYPE	GLY
PREV_TYPE	LYS(43.0)  TRP(25.1)  MET(20.6)  ARG(6.0)  ASN(5.2)  
SPIN_SYSTEM_ID	16
HETEROGENEITY	100
   HN  10.1771 (A.62 B.184 B.185 B.161) 
   N  112.3358 (A.62 B.184 B.185 B.161) 
   CA:-1  57.1301 (B.184) 
   CB:-1  34.6152 (B.185) 
   CA  48.3906 (B.161) 
   HA1|HA2  3.71
   HA1|HA2  3.75
   C  176.5484
END_RES_DEF

RES_ID		17
RES_TYPE	GLU
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	17
HETEROGENEITY	100
   HN  8.6448 (A.4 B.3 B.7 B.8 B.9 B.1 B.4) 
   N  126.7684 (A.4 B.3 B.7 B.8 B.9 B.1 B.4) 
   CA:-1  48.3483 (B.3 B.7) 
   CA  55.0597 (B.8 B.1) 
   HA  4.568
   CB  29.4492 (B.9 B.4) 
   HB1|HB2  1.76
   HB2|HB1  2.43
   CG  36.082
   HG1|HG2  2.39
   HG2|HG1  2.19
   C  176.204
END_RES_DEF

RES_ID		18
RES_TYPE	LYS
PREV_TYPE	GLN(24.3)  HIH(15.1)  CYS(14.7)  GLU(14.6)  ARG(12.5)  \
		HIS(12.4)  
SPIN_SYSTEM_ID	18
HETEROGENEITY	100
   HN  8.4814 (A.19 B.29 B.30 B.52 B.53 B.54 B.55) 
   N  120.9350 (A.19 B.29 B.30 B.52 B.53 B.54 B.55) 
   CA:-1  55.0524 (B.29 B.55) 
   CB:-1  29.3595 (B.30 B.54) 
   CA  57.2564 (B.52) 
   HA  4.36
   CB  32.7628 (B.53) 
   HB1|HB2  1.844
   HB2|HB1  2.044
   CG  27.61
   HG1|HG2  1.93
   HG2|HG1  1.573
   CD  29.34
   CE  42.47
END_RES_DEF

RES_ID		19
RES_TYPE	PRO
SPIN_SYSTEM_ID	19
HETEROGENEITY	100
   CA  62.4816
   HA  4.772
   CB  33.3806
   HB1|HB2  2.379
   HB2|HB1  2.57
   CG  27.333
   HG1|HG2  2.18
   HG2|HG1  2.00
   CD  51.267
   HD1|HD2  3.95
   HD2|HD1  3.78
   C  177.6324
END_RES_DEF

RES_ID		20
RES_TYPE	VAL
PREV_TYPE	VAL(50.6)  PRO(49.4)  
SPIN_SYSTEM_ID	20
HETEROGENEITY	100
   HN  8.1766 (A.25 B.41 B.42 B.72 B.73) 
   N  120.6598 (A.25 B.41 B.42 B.72 B.73) 
   CA:-1  62.4816 (B.41) 
   CB:-1  33.3806 (B.42) 
   CA  65.9821 (B.72) 
   HA  3.517
   CB  32.2322 (B.73) 
   HB  1.73
   CG1|CG2  23.550
   HG1#|HG2#  1.064
   CG2|CG1  21.267
   HG2#|HG1#  0.98
   C  175.5354
END_RES_DEF

RES_ID		21
RES_TYPE	GLY
PREV_TYPE	VAL(50.4)  PRO(49.6)  
SPIN_SYSTEM_ID	21
HETEROGENEITY	100
   HN  8.2205 (A.75 B.136 B.137 B.188) 
   N  105.2901 (A.75 B.136 B.137 B.188) 
   CA:-1  66.0843 (B.136) 
   CB:-1  32.3341 (B.137) 
   CA  45.7975 (B.188) 
   HA1|HA2  4.037
   HA2|HA1  3.729
   C  174.3989
END_RES_DEF

RES_ID		22
RES_TYPE	SER
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	22
HETEROGENEITY	100
   HN  7.7258 (A.68 B.123 B.171 B.172 B.173) 
   N  114.0327 (A.68 B.123 B.171 B.172 B.173) 
   CA:-1  45.7977 (B.123 B.173) 
   CA  60.8003 (B.171) 
   HA  4.372
   CB  64.0624 (B.172) 
   HB1|HB2  4.022
   HB2|HB1  4.130
   C  174.989
END_RES_DEF

RES_ID		23
RES_TYPE	LEU
PREV_TYPE	SER(100.0)  
SPIN_SYSTEM_ID	23
HETEROGENEITY	100
   HN  7.5208 (A.26 B.43 B.44 B.74 B.75) 
   N  121.2402 (A.26 B.43 B.44 B.74 B.75) 
   CA:-1  60.7983 (B.43) 
   CB:-1  63.9409 (B.44) 
   CA  55.2209 (B.74) 
   HA  3.402
   CB  42.4608 (B.75) 
   HB1|HB2  1.895
   HB2|HB1  1.180
   CG  27.47
   HG  1.31
   CD1|CD2  25.82
   HD1#|HD2#  0.865
   CD2|CD1  25.06
   HD2#|HD1#  0.066
   C  177.4861
END_RES_DEF

RES_ID		24
RES_TYPE	ALA
PREV_TYPE	LEU(48.6)  PHE(18.4)  TYR(16.8)  ASP(16.2)  
SPIN_SYSTEM_ID	24
HETEROGENEITY	100
   HN  6.6642 (A.9 B.12 B.13) 
   N  124.8823 (A.9 B.12 B.13) 
   CA  53.6300
   HA  3.966
   CB  19.1600
   HB#  1.33
   C  175.3462
   CA:-1  55.2033 (B.12) 
   CB:-1  42.4197 (B.13) 
END_RES_DEF

RES_ID		25
RES_TYPE	GLY
PREV_TYPE	ALA(100.0)  
SPIN_SYSTEM_ID	25
HETEROGENEITY	100
   HN  8.1634 (A.77 B.140 B.141 B.190 B.191) 
   N  107.3640 (A.77 B.140 B.141 B.190 B.191) 
   CA:-1  53.6255 (B.140 B.191) 
   CB:-1  19.1150 (B.141) 
   CA  45.7080 (B.190) 
   HA1|HA2  4.524
   HA2|HA1  3.807
   C  173.2524
END_RES_DEF

RES_ID		26
RES_TYPE	ILE
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	26
HETEROGENEITY	100
   HN  7.1254 (A.53 B.101) 
   N  118.4346 (A.53 B.101) 
   CA:-1  45.7124 (B.101) 
   CA  58.4400
   HA  4.135
   CB  33.9600
   HB   2.427
   CG1  27.060
   HG11|HG12  1.07
   HG12|HG11  1.36
   CG2  18.306 
   HG2#  0.721
   CD  8.83
   HD#  0.555
   C  175.5060
END_RES_DEF

RES_ID		27
RES_TYPE	GLY
PREV_TYPE	LYS(33.6)  MET(28.1)  TRP(14.2)  VAL(12.7)  PRO(6.2)  \
		ARG(5.1)  ILE(0.0)  
SPIN_SYSTEM_ID	27
HETEROGENEITY	100
   HN  6.9580 (A.87 B.150 B.151 B.201) 
   N  111.2722 (A.87 B.150 B.151 B.201) 
   CA:-1  58.3707 (B.150) 
   CB:-1  33.9864 (B.151) 
   CA  44.7478 (B.201) 
   HA1|HA2  3.986
   HA2|HA1  4.436
   C  174.8065
END_RES_DEF

RES_ID		28
RES_TYPE	GLU
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	28
HETEROGENEITY	100
   HN  8.5846 (A.34 B.58 B.97 B.98) 
   N  119.0165 (A.34 B.58 B.97 B.98) 
   CA:-1  44.7934 (B.58) 
   CA  60.1740 (B.97)
   HA  4.015 
   CB  30.2730 (B.98) 
   HB1|HB2  2.071
   HB2|HB1  2.10
   CG  36.621
   HG1|HG2  2.31
   HG2|HG1  2.36
   C  177.4337
END_RES_DEF

RES_ID		29
RES_TYPE	VAL
PREV_TYPE	GLU(16.9)  CYS(9.4)  LYS(5.2)  
SPIN_SYSTEM_ID	29
HETEROGENEITY	100
   CA:-1  60.3136 (B.81) 
   CB:-1  30.2640 (B.82) 
   CA  66.6530
   HA  3.747
   CB  31.6720
   HB  2.19
   CG1|CG2  22.697
   HG1#|HG2#  1.082
   CG2|CG1  21.118
   HG2#|HG1#  0.97
   C  178.7948
   HN  8.1437 (B.81 B.82) 
   N  118.9669 (B.81 B.82) 
END_RES_DEF

RES_ID		30
RES_TYPE	LEU
PREV_TYPE	PRO(60.4)  VAL(39.6)  
SPIN_SYSTEM_ID	30
HETEROGENEITY	100
   HN  7.8311 (A.46 B.87 B.88) 
   N  119.0696 (A.46 B.87 B.88) 
   CA:-1  66.5880 (B.87) 
   CB:-1  31.7762 (B.88) 
   CA  58.2600
   HA  3.99
   CB  42.1700
   HB1|HB2  1.795
   HB2|HB1  1.464
   CG  27.65 
   HG  1.88
   CD1|CD2  23.482
   HD1#|HD2#  0.7791
   CD2|CD1  25.271
   HD2#|HD1#  0.953
   C  179.4540
END_RES_DEF

RES_ID		31
RES_TYPE	GLY
PREV_TYPE	LEU(51.6)  ILE(15.2)  PHE(13.7)  TYR(12.9)  ASP(6.6)  
SPIN_SYSTEM_ID	31
HETEROGENEITY	100
   HN  8.6522 (A.73 B.132 B.133 B.186) 
   N  106.3445 (A.73 B.132 B.133 B.186) 
   CA:-1  58.2576 (B.132) 
   CB:-1  42.1352 (B.133) 
   CA  47.5469 (B.186)
   HA1|HA2  3.410
   HA2|HA1  3.867
   C  175.4933 
END_RES_DEF

RES_ID		32
RES_TYPE	LYS
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	32
HETEROGENEITY	100
   HN  7.5185 (A.27 B.45 B.76 B.77 B.78 B.231 B.232) 
   N  120.7604 (A.27 B.45 B.76 B.77 B.78 B.231 B.232) 
   CA:-1  47.5760
   CA  59.2120
   HA  4.182
   CB  32.3770
   HB1|HB2  1.955
   CG  25.158
   HG1|HG2  1.60
   HG2|HG1  1.53
   CD  29.212
   HD1|HD2  1.74
   CE  42.321
   HE1|HE2  3.022
   C  179.3199
END_RES_DEF

RES_ID		33
RES_TYPE	LYS
PREV_TYPE	LYS(42.0)  MET(29.8)  TRP(9.1)  VAL(7.1)  
SPIN_SYSTEM_ID	33
HETEROGENEITY	100
   HN  7.3593 (A.56 B.104 B.105 B.147 B.148) 
   N  118.0851 (A.56 B.104 B.105 B.147 B.148) 
   CA:-1  59.1978 (B.105 B.147) 
   CB:-1  32.2621 (B.104 B.148) 
   CA  59.3500
   HA  4.142
   CB  32.6000
   HB1|HB2  1.98
   CG  22.959
   HG1|HG2  1.841
   CD  29.433
   HD1|HD2  1.656
   CE  42.25
   C  178.2324
END_RES_DEF

RES_ID		34
RES_TYPE	LEU
PREV_TYPE	LYS(16.8)  ARG(12.2)  HIS(12.0)  GLU(7.3)  
SPIN_SYSTEM_ID	34
HETEROGENEITY	100
   HN  8.1825 (A.42 B.73 B.74 B.115 B.116) 
   N  119.5380 (A.42 B.73 B.74 B.115 B.116) 
   CA:-1  59.4505 (B.74) 
   CB:-1  32.7004 (B.73) 
   CA  58.9500 (B.116) 
   HA  3.925
   CB  40.7202 (B.115) 
   HB1|HB2  2.06
   HB2|HB1  1.99
   CG  27.79
   HG 1.54
   CD1|CD2  23.08
   HD1#|HD2#  0.53
   CD2|CD1  26.69
   HD2#|HD1#  0.780
   C  179.8527
END_RES_DEF

RES_ID		35
RES_TYPE	GLU
PREV_TYPE	ILE(30.7)  PHE(20.4)  LEU(20.0)  TYR(18.3)  ASP(10.6)  
SPIN_SYSTEM_ID	35
HETEROGENEITY	100
   HN  8.7276 (A.21 B.33 B.34 B.60 B.61) 
   N  121.2846 (A.21 B.33 B.34 B.60 B.61) 
   CA:-1  58.9536 (B.33) 
   CB:-1  40.7234 (B.34) 
   CA  60.8437 (B.60) 
   HA  3.429
   CB  29.7358 (B.61) 
   HB1|HB2  2.30
   HB2|HB1  2.10
   CG  37.023
   HG1|HG2  2.53
   HG2|HG1  2.13
   C  180.9294
END_RES_DEF

RES_ID		36
RES_TYPE	GLU
PREV_TYPE	TRP(42.6)  GLU(16.0)  CYS(14.6)  ARG(13.5)  
SPIN_SYSTEM_ID	36
HETEROGENEITY	100
   HN  8.1836 (A.41 B.71 B.72 B.113 B.114 B.222) 
   N  120.0003 (A.41 B.71 B.72 B.113 B.114 B.222) 
   CA:-1  60.8873 (B.71 B.222) 
   CB:-1  29.6482 (B.72 B.114) 
   CA  59.1705 (B.113) 
   HA  4.115
   CB  29.8000
   HB1|HB2  2.17
   HB2|HB1  2.276
   CG  36.754
   HG1|HG2  2.400
   HG1|HG2  2.540
   C  178.1452
END_RES_DEF

RES_ID		37
RES_TYPE	ARG
PREV_TYPE	GLU(23.2)  
SPIN_SYSTEM_ID	37
HETEROGENEITY	100
   HN  7.3657 (A.58 B.108 B.109 B.151 B.152 B.153) 
   N  116.2862 (A.58 B.108 B.109 B.151 B.152 B.153) 
   CA:-1  59.1981 (B.108 B.152) 
   CB:-1  29.8756 (B.109) 
   CA  55.3438 (B.151) 
   HA  4.528
   CB  30.5770 (B.153) 
   HB1|HB2  1.98
   HB2|HB1  2.44
   CG  27.690
   HG1|HG2  1.89
   CD  43.080
   HD1|HD2  3.33
   HD2|HD1  3.26
   C  175.6889
END_RES_DEF

RES_ID		38
RES_TYPE	GLY
PREV_TYPE	ARG(19.1)  GLU(17.6)  HIS(16.5)  CYS(15.2)  GLN(13.2)  \
		TRP(7.0)  
SPIN_SYSTEM_ID	38
HETEROGENEITY	100
   HN  7.8317 (A.76 B.138 B.139 B.189) 
   N  105.8745 (A.76 B.138 B.139 B.189) 
   CA:-1  55.3643 (B.138) 
   CB:-1  30.6300 (B.139) 
   CA  45.2359 (B.189) 
   HA1|HA2  4.255
   HA2|HA1  3.705
   C  174.2643
END_RES_DEF

RES_ID		39
RES_TYPE	PHE
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	39
HETEROGENEITY	100
   HN  8.3557 (A.15 B.22 B.38 B.39 B.40 B.41) 
   N  122.6136 (A.15 B.22 B.38 B.39 B.40 B.41) 
   CA:-1  45.1759 (B.22 B.40) 
   CA  56.2492 (B.39) 
   HA  4.396
   CB  38.3889 (B.41)
   HB1|HB2  2.765
   HB2|HB1  3.055
   CD1|CD2  132.17
   HD1|HD2  7.065
   CE1|CE2  132.237
   HE1|HE2  7.473
   CZ  130.78
   HZ  7.544
   C  173.3227 
END_RES_DEF

RES_ID		40
RES_TYPE	ASP
PREV_TYPE	ASN(43.7)  TYR(22.4)  PHE(21.1)  ASP(9.6)  
SPIN_SYSTEM_ID	40
HETEROGENEITY	100
   HN  8.1486 (A.70 B.126 B.127 B.178 B.179 B.181) 
   N  112.6051 (A.70 B.126 B.127 B.178 B.179 B.181) 
   CA:-1  56.1573 (B.126 B.178) 
   CB:-1  38.3789 (B.127) 
   CA  54.9733 (B.181) 
   HA  4.328
   CB  40.6029 (B.179) 
   HB1|HB2  2.865
   HB2|HB1  2.604
   C  177.2549
END_RES_DEF

RES_ID		41
RES_TYPE	LYS
PREV_TYPE	ASP(49.2)  LEU(18.3)  PHE(14.4)  TYR(13.5)  
SPIN_SYSTEM_ID	41
HETEROGENEITY	100
   HN  7.0657 (A.52 B.99 B.100 B.140 B.141) 
   N  118.8066 (A.52 B.99 B.100 B.140 B.141) 
   CA:-1  54.8754 (B.100) 
   CB:-1  40.5999 (B.99) 
   CA  53.9919 (B.140) 
   HA  4.622
   CB  35.9977 (B.141) 
   HB1|HB2  1.82
   HB2|HB1  0.845
   CG  24.837
   HG1|HG2  1.28
   HG2|HG1  1.34
   CD  29.350
   HD1|HD2  1.60
   HD2|HD1  1.50
   CE  43.034
   HE1|HE2  3.06
   C  176.5959
END_RES_DEF

RES_ID		42
RES_TYPE	ALA
PREV_TYPE	MET(33.0)  LYS(28.8)  ASN(17.6)  ARG(8.2)  HIS(5.4)  
SPIN_SYSTEM_ID	42
HETEROGENEITY	100
   HN  8.4541 (A.5 B.4 B.5 B.10 B.11 B.12 B.13) 
   N  125.6646 (A.5 B.4 B.5 B.10 B.11 B.12 B.13) 
   CA:-1  53.9402 (B.4 B.11) 
   CB:-1  35.9563 (B.5 B.13) 
   CA  56.7643 (B.12) 
   HA  3.812
   CB  17.3484 (B.10)
   HB#  1.405
   C  180.0342 
END_RES_DEF

RES_ID		43
RES_TYPE	TYR
PREV_TYPE	ALA(100.0)  
SPIN_SYSTEM_ID	43
HETEROGENEITY	100
   HN  9.2633 (A.61 B.114 B.115 B.159 B.160) 
   N  113.6297 (A.61 B.114 B.115 B.159 B.160) 
   CA:-1  56.7322 (B.114) 
   CB:-1  17.3368 (B.115) 
   CA  60.2453 (B.159) 
   HA  4.549
   CB  36.8221 (B.160) 
   HB1|HB2  3.339
   HB2|HB1  2.759
   CD1|CD2  134.95
   HD1|HD2  7.155
   CE1|CE2  118.385
   HE1|HE2  6.830
   C  176.8443
END_RES_DEF

RES_ID		44
RES_TYPE	VAL
PREV_TYPE	ILE(30.1)  VAL(22.6)  TYR(20.4)  PHE(15.1)  PRO(11.7)  
SPIN_SYSTEM_ID	44
HETEROGENEITY	100
   HN  7.2715 (A.8 B.10 B.11 B.19 B.20) 
   N  124.1921 (A.8 B.10 B.11 B.19 B.20) 
   CA:-1  60.2997 (B.10) 
   CB:-1  36.7632 (B.11) 
   CA  65.2779 (B.19) 
   HA  3.626
   CB  32.3668 (B.20) 
   HB  2.041
   CG1|CG2  23.889
   HG1#|HG2#  1.15
   CG2|CG1  23.148
   HG2#|HG1  0.722
   C  178.1669
END_RES_DEF

RES_ID		45
RES_TYPE	VAL
PREV_TYPE	VAL(58.9)  PRO(41.1)  
SPIN_SYSTEM_ID	45
HETEROGENEITY	100
   HN  6.9040 (A.12 B.16 B.17 B.27 B.29) 
   N  118.5186 (A.12 B.16 B.17 B.27 B.29) 
   CA:-1  65.2238 (B.16) 
   CB:-1  32.5100 (B.17) 
   CA  66.6357 (B.27) 
   HA  3.728
   CB  31.3713 (B.29) 
   HB  2.23
   CG1|CG2  24.75
   HG1#|HG2#  1.117
   CG2|CG1  22.64
   HG2#|HG1#  1.19
   C  179.9119
END_RES_DEF

RES_ID		46
RES_TYPE	LEU
PREV_TYPE	VAL(100.0)  
SPIN_SYSTEM_ID	46
HETEROGENEITY	100
   CA:-1  66.6603 (B.163) 
   CB:-1  31.3700
   CA  58.7100
   HA  3.933
   CB  40.1100
   HB1|HB2  2.25
   HB2|HB1  1.06
   CG  27.635
   HG  1.50
   CD1|CD2  24.04
   HD1#|HD2#  0.895
   CD2|CD1  26.03
   HD2#|HD1#  0.750
   C  178.2479
   HN  8.1913 (B.163) 
   N  119.5822 (B.163) 
END_RES_DEF

RES_ID		47
RES_TYPE	GLY
PREV_TYPE	PHE(30.5)  TYR(27.8)  ILE(20.6)  ASP(14.4)  LEU(6.8)  
SPIN_SYSTEM_ID	47
HETEROGENEITY	100
   HN  8.4546 (A.74 B.134 B.135 B.187) 
   N  105.8470 (A.74 B.134 B.135 B.187) 
   CA:-1  58.7130 (B.134) 
   CB:-1  40.1090 (B.135) 
   CA  50.2463 (B.187)
   HA1|HA2  3.923
   HA2|HA1  3.984
   C  174.0185 
END_RES_DEF

RES_ID		48
RES_TYPE	GLN
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	48
HETEROGENEITY	100
   HN  7.4804 (A.10 B.14 B.22 B.23) 
   N  122.3478 (A.10 B.14 B.22 B.23) 
   CA:-1  50.2083 (B.14) 
   CA  58.1353 (B.22) 
   HA  3.933
   CB  27.8196 (B.23) 
   HB1|HB2  1.799
   HB2|HB1  1.400
   CG  31.55
   HG1|HG2  2.378
   NE2  112.045
   HE21|HE22  7.47
   HE22|HE21  6.81
   C  179.8900
END_RES_DEF

RES_ID		49
RES_TYPE	PHE
PREV_TYPE	GLN(36.6)  GLN(32.6)  GLU(17.5)  TRP(7.7)  ARG(5.7)  
SPIN_SYSTEM_ID	49
HETEROGENEITY	100
   CA  61.6600
   HA  3.956
   CB  39.5000
   HB1|HB2  3.503
   HB2|HB1  2.642
   CD1|CD2  131.85
   HD1|HD2  6.486
   CE1|CE2  131.516
   HE1|HE2  6.909
   CZ  127.63
   HZ  6.601
   C  176.4741
   CA:-1  58.1354 (B.80) 
   CB:-1  28.8199 (B.79) 
   HN  8.1915 (B.79 B.80) 
   N  119.2876 (B.79 B.80) 
END_RES_DEF

RES_ID		50
RES_TYPE	LEU
PREV_TYPE	ILE(38.0)  PHE(32.8)  TYR(29.2)  
SPIN_SYSTEM_ID	50
HETEROGENEITY	100
   HN  8.4115 (A.37 B.63 B.64 B.101 B.102) 
   N  117.8928 (A.37 B.63 B.64 B.101 B.102) 
   CA:-1  61.6562 (B.63) 
   CB:-1  39.5017 (B.64) 
   CA  58.0405 (B.101) 
   HA  4.003
   CB  40.9941 (B.102) 
   HB1|HB2  2.28
   HB2|HB1  1.84
   CG  26.65
   HG  2.27
   CD1|CD2  26.00
   HD1#|HD2#  1.05
   CD2|CD1  22.377
   HD2#|HD1#  0.816
   C  181.0049
END_RES_DEF

RES_ID		51
RES_TYPE	VAL
PREV_TYPE	LEU(28.7)  PHE(20.4)  TYR(19.4)  ASP(18.3)  ILE(13.2)  
SPIN_SYSTEM_ID	51
HETEROGENEITY	100
   HN  8.8314 (A.22 B.35 B.36) 
   N  121.1055 (A.22 B.35 B.36) 
   CA:-1  58.1343 (B.35) 
   CB:-1  41.0302 (B.36) 
   CA  66.7180
   HA  4.031
   CB  31.6600
   HB  2.152
   CG1|CG2  23.082
   HG1#|HG2#  1.093
   CG2|CG1  21.591
   HG2#|HG1#  1.01
   C  178.0316
END_RES_DEF

RES_ID		52
RES_TYPE	LEU
PREV_TYPE	VAL(37.1)  
SPIN_SYSTEM_ID	52
HETEROGENEITY	100
   HN  7.4927 (A.57 B.106 B.107 B.149 B.150) 
   N  117.5475 (A.57 B.106 B.107 B.149 B.150) 
   CA:-1  66.6735 (B.106) 
   CB:-1  31.5765 (B.107) 
   CA  54.5521 (B.149) 
   HA  4.329
   CB  40.3899 (B.150) 
   HB1|HB2  1.85
   CG  26.183
   HG  1.88
   CD1|CD2  21.90
   HD1#|HD2#  0.85
   CD2|CD1  26.09
   HD2#|HD1#  0.79
   C  175.8365
END_RES_DEF

RES_ID		53
RES_TYPE	LYS
PREV_TYPE	LEU(16.1)  PHE(10.9)  TYR(10.3)  ASN(7.2)  
SPIN_SYSTEM_ID	53
HETEROGENEITY	100
   HN  8.2470 (A.59 B.110 B.111 B.154 B.156) 
   N  115.8767 (A.59 B.110 B.111 B.154 B.156) 
   CA:-1  54.5493 (B.110) 
   CB:-1  40.3924 (B.111) 
   CA  57.5106 (B.156) 
   HA  3.965
   CB  28.4608 (B.154) 
   HB1|HB2  1.96
   HB2|HB1  2.03
   CG  26.225
   HG1|HG2  1.47
   HG2|HG1  1.32
   CD  29.465
   HD1|HD2  1.75
   HD2|HD1  1.75
   CE  42.60
   HE1|HE2  2.961
   HE2|HE1  3.063
   C  175.808
END_RES_DEF

RES_ID		54
RES_TYPE	LYS
PREV_TYPE	CYS(24.7)  GLN(23.8)  GLU(15.6)  HIH(12.6)  ARG(9.4)  \
		TRP(8.7)  HIS(5.2)  
SPIN_SYSTEM_ID	54
HETEROGENEITY	100
   HN  8.2823 (A.78 B.142 B.143 B.192 B.193) 
   N  108.1188 (A.78 B.142 B.143 B.192 B.193) 
   CA:-1  57.5924 (B.142) 
   CB:-1  28.4978 (B.143) 
   CA  55.9897 (B.192) 
   HA  1.956
   CB  29.7170 (B.193)
   HB1|HB2  1.963
   HB2|HB1  1.37
   CG  24.930
   HG1|HG2  0.49
   HG2|HG1  0.60
   CD  30.39
   HD1|HD2  1.27
   HD2|HD1  1.35
   CE  41.34
   HE1|HE2  2.18
   HE2|HE1  1.89
   C  174.8432 
END_RES_DEF

RES_ID		55
RES_TYPE	ASP
PREV_TYPE	LYS(100.0)  
SPIN_SYSTEM_ID	55
HETEROGENEITY	100
   CA:-1  55.3953 (B.156) 
   CB:-1  32.1565 (B.157) 
   HN  7.1438 (B.156 B.157 B.206 B.207 B.209 B.211) 
   N  119.1554 (B.156 B.157 B.206 B.207 B.209 B.211) 
   CA  55.3625 (B.206 B.209) 
   HA  4.475
   CB  44.0806 (B.207 B.211) 
   HB1|HB2  2.979
   HB2|HB1  2.58
   C  176.1598
END_RES_DEF

RES_ID		56
RES_TYPE	GLU
PREV_TYPE	LEU(57.6)  PHE(17.6)  TYR(14.0)  ASP(10.8)  
SPIN_SYSTEM_ID	56
HETEROGENEITY	100
   HN  8.6471 (A.3 B.1 B.2 B.3 B.4) 
   N  128.2092 (A.3 B.1 B.2 B.3 B.4) 
   CA:-1  55.3613 (B.1 B.2) 
   CB:-1  44.0847 (B.2 B.3) 
   CA  60.3954 (B.1) 
   HA  3.262
   CB  30.2147 (B.4) 
   HB1|HB2  1.51
   HB2|HB1  1.35
   CG  35.548
   HG1|HG2  1.75
   HG1|HG2  0.83
   C  177.9539
END_RES_DEF

RES_ID		57
RES_TYPE	ASP
PREV_TYPE	TRP(39.0)  ARG(18.2)  GLU(16.8)  CYS(10.0)  
SPIN_SYSTEM_ID	57
HETEROGENEITY	100
   HN  7.9587 (A.49 B.93 B.94 B.132 B.133) 
   N  118.2519 (A.49 B.93 B.94 B.132 B.133) 
   CA:-1  60.4170 (B.93) 
   CB:-1  30.1870 (B.94) 
   CA  58.0226 (B.132) 
   HA  4.351
   CB  40.7587 (B.133) 
   HB1|HB2  2.643
   HB2|HB1  2.7800
   C  179.7577
END_RES_DEF

RES_ID		58
RES_TYPE	LEU
PREV_TYPE	ASP(22.0)  LEU(20.6)  ILE(10.9)  
SPIN_SYSTEM_ID	58
HETEROGENEITY	100
   HN  8.9229 (A.32 B.54 B.55 B.92 B.93 B.94) 
   N  119.3339 (A.32 B.54 B.55 B.92 B.93 B.94) 
   CA:-1  58.0376 (B.55 B.93) 
   CB:-1  40.7550 (B.54 B.94) 
   CA  57.9800
   HA  4.177
   CB  42.7435 (B.92) 
   HB1|HB2  1.985
   HB2|HB1  1.643
   CG  27.27
   HG  1.882
   CD1|CD2  22.76
   HD1#|HD2#  0.933
   CD2|CD1  25.711
   HD2#|HD1#  1.027
   C  180.8617
END_RES_DEF

RES_ID		59
RES_TYPE	PHE
PREV_TYPE	LEU(55.5)  PHE(15.4)  TYR(14.2)  ILE(10.9)  
SPIN_SYSTEM_ID	59
HETEROGENEITY	100
   HN  8.8933 (A.30 B.50 B.51 B.86 B.87) 
   N  120.2547 (A.30 B.50 B.51 B.86 B.87) 
   CA:-1  57.9561 (B.50) 
   CB:-1  42.7486 (B.51) 
   CA  62.7590 (B.86) 
   HA  4.34
   CB  39.9638 (B.87) 
   HB1|HB2  3.31  
   HB2|HB1  3.455
   CD1|CD2  131.56
   HD1|HD2  7.302
   C  176.8546
END_RES_DEF

RES_ID		60
RES_TYPE	ARG
PREV_TYPE	PHE(100.0)  
SPIN_SYSTEM_ID	60
HETEROGENEITY	100
   HN  8.8142
   N  119.0361
   CA:-1  52.6022
   CB:-1  39.9689
   CA  61.0500
   HA  3.835
   CB  29.8500
   HB1|HB2  2.04
   HB2|HB1  1.50
   CG  27.887
   HG1|HG2  2.13
   CE  43.58
   HE1|HE2  3.20
   C  179.0392
END_RES_DEF

RES_ID		61
RES_TYPE	GLU
PREV_TYPE	TRP(46.4)  GLU(13.4)  ARG(12.7)  CYS(11.4)  VAL(6.2)  
SPIN_SYSTEM_ID	61
HETEROGENEITY	100
   HN  7.9351 (A.45 B.85 B.86) 
   N  119.2810 (A.45 B.85 B.86) 
   CA:-1  60.9607 (B.85) 
   CB:-1  29.9113 (B.86) 
   CA  59.5400
   HA  3.985
   CB  29.6800
   HB1|HB2  2.138
   CG  36.272
   HG1|HG2  2.385
   C  177.9138
END_RES_DEF

RES_ID		62
RES_TYPE	TRP
PREV_TYPE	GLU(24.5)  ARG(23.7)  TRP(21.6)  CYS(15.3)  GLN(7.1)  
SPIN_SYSTEM_ID	62
HETEROGENEITY	100
   HN  8.1099 (A.24 B.39 B.40 B.70 B.71) 
   N  120.8135 (A.24 B.39 B.40 B.70 B.71) 
   CA:-1  59.5717 (B.39) 
   CB:-1  29.6600 (B.40) 
   CA  62.4303 (B.70) 
   HA  4.194
   CB  27.7114 (B.71) 
   HB1|HB2  3.39
   HB2|HB1  3.31
   CD1  126.98
   HD1  7.282
   CZ2  115.17
   HZ2  6.02
   CH2  122.701
   HH2  6.03
   CZ3  121.51
   HZ3  6.490
   CE3  119.73
   HE3  6.805
   NE1  131.657
   HE1  9.876
   C  179.6055
END_RES_DEF

RES_ID		63
RES_TYPE	LEU
PREV_TYPE	CYS(61.4)  TRP(38.6)  
SPIN_SYSTEM_ID	63
HETEROGENEITY	100
   HN  8.5741 (A.16 B.23 B.24 B.42 B.43 B.44 B.45) 
   N  122.8417 (A.16 B.23 B.24 B.42 B.43 B.44 B.45) 
   CA:-1  62.4318 (B.23 B.44) 
   CB:-1  27.6337 (B.24 B.45) 
   CA  57.98 (B.42) 
   HA  2.873
   CB  42.2613 (B.43) 
   HB1|HB2  1.26
   HB2|HB1  1.19
   CG  26.89
   HG  1.10
   CD1|CD2  25.57
   HD1#|HD2#  0.572
   CD2|CD1  26.17
   HD2#|HD1#  0.64
   C  179.740
END_RES_DEF

RES_ID		64
RES_TYPE	LYS
PREV_TYPE	LEU(50.8)  PHE(15.3)  TYR(14.4)  ILE(11.9)  ASP(7.5)  
SPIN_SYSTEM_ID	64
HETEROGENEITY	100
   HN  7.9952 (A.23 B.37 B.38 B.66 B.67 B.68 B.69) 
   N  120.9844 (A.23 B.37 B.38 B.66 B.67 B.68 B.69) 
   CA:-1  57.9858 (B.37 B.68) 
   CB:-1  42.2270 (B.38 B.69) 
   CA  60.3564 (B.67) 
   HA  3.942
   CB  32.0787 (B.66) 
   HB1|HB2  1.923
   CG  24.297
   HG1|HG2  1.47
   HG2|HG1  1.29
   CD  29.368
   HD1|HD2  1.62
   HD2|HD1  1.69
   CE  42.373
   HE1|HE2  2.93
   C  179.4601
END_RES_DEF

RES_ID		65
RES_TYPE	ASP
PREV_TYPE	LYS(39.9)  VAL(22.0)  PRO(14.9)  MET(11.3)  TRP(8.7)  
SPIN_SYSTEM_ID	65
HETEROGENEITY	100
   HN  8.2484 (A.40 B.69 B.70 B.110 B.111 B.112) 
   N  119.6397 (A.40 B.69 B.70 B.110 B.111 B.112) 
   CA:-1  60.3800 (B.69 B.110) 
   CB:-1  32.0403 (B.70 B.111) 
   CA  57.3790 (B.112) 
   HA  4.248
   CB  41.3730
   HB1|HB2  2.649
   HB2|HB1  2.515
   C  177.9469
END_RES_DEF

RES_ID		66
RES_TYPE	THR
PREV_TYPE	LEU(26.5)  PHE(23.4)  TYR(22.5)  ASP(22.5)  ILE(5.1)  
SPIN_SYSTEM_ID	66
HETEROGENEITY	100
   HN  7.8332 (A.69 B.124 B.125 B.174 B.175 B.176 B.177) 
   N  112.9168 (A.69 B.124 B.125 B.174 B.175 B.176 B.177) 
   CA:-1  57.3037 (B.124 B.176) 
   CB:-1  41.3005 (B.125 B.177) 
   CA  65.8117 (B.175) 
   HA  3.723
   CB  68.5253 (B.174) 
   HB  2.83
   CG2  21.169
   HG2#  0.674
   C  174.9030
END_RES_DEF

RES_ID		67
RES_TYPE	CYS
PREV_TYPE	THR(100.0)  
SPIN_SYSTEM_ID	67
HETEROGENEITY	100
   HN  7.7801 (A.81 B.146 B.147 B.198 B.199) 
   N  110.0805 (A.81 B.146 B.147 B.198 B.199) 
   CA:-1  65.7008 (B.147) 
   CB:-1  68.5666 (B.146) 
   CA  56.4357 (B.199)
   HA  4.905 
   CB  31.4557 (B.198)
   HB1|HB2  3.060
   HB2|HB1  2.339
   C  173.2759 
END_RES_DEF

RES_ID		68
RES_TYPE	GLY
PREV_TYPE	TRP(17.7)  ARG(16.6)  GLU(13.0)  LYS(12.2)  HIS(12.2)  \
		MET(11.7)  CYS(11.3)  GLN(5.3)  
SPIN_SYSTEM_ID	68
HETEROGENEITY	100
   HN  7.8541 (A.82 B.148 B.149 B.200) 
   N  110.2433 (A.82 B.148 B.149 B.200) 
   CA:-1  56.4128 (B.148) 
   CB:-1  31.4641 (B.149) 
   CA  46.5402 (B.200)
   HA1|HA2  3.897
   HA2|HA1  3.980
   C  174.5191 
END_RES_DEF

RES_ID		69
RES_TYPE	ALA
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	69
HETEROGENEITY	100
   HN  6.5942 (A.11 B.15 B.24 B.25 B.26) 
   N  121.4111 (A.11 B.15 B.24 B.25 B.26) 
   CA:-1  46.5376 (B.15 B.25) 
   CA  52.7033 (B.26)
   HA  4.143
   CB  20.7181 (B.24) 
   HB#  1.033
   C  176.7892
END_RES_DEF

RES_ID		70
RES_TYPE	ASN
PREV_TYPE	ALA(100.0)  
SPIN_SYSTEM_ID	70
HETEROGENEITY	100
   HN  8.9360 (A.31 B.52 B.53 B.88 B.89 B.90 B.91) 
   N  120.4948 (A.31 B.52 B.53 B.88 B.89 B.90 B.91) 
   CA:-1  52.5954 (B.52 B.89) 
   CB:-1  20.7130 (B.53 B.91) 
   CA  51.2044 (B.88) 
   HA  4.73
   CB  38.7664 (B.90) 
   HB1|HB2  2.92
   HB2|HB1  3.45
   ND2  110.49
   HD21|HD22  7.395
   HD22|HD21  6.967
   C  175.4043
END_RES_DEF

RES_ID		71
RES_TYPE	ALA
PREV_TYPE	ASN(93.1)  ASP(6.9)  
SPIN_SYSTEM_ID	71
HETEROGENEITY	100
   CA:-1  51.2482 (B.166) 
   CB:-1  38.7994 (B.167) 
   HN  8.3391 (B.166 B.167 B.217 B.218) 
   N  119.9072 (B.166 B.167 B.217 B.218) 
   CA  56.0873 (B.218) 
   HA  3.974
   CB  18.8866 (B.217) 
   HB#  1.440
   C  179.8670
END_RES_DEF

RES_ID		72
RES_TYPE	LYS
PREV_TYPE	ALA(100.0)  
SPIN_SYSTEM_ID	72
HETEROGENEITY	100
   HN  7.9047 (A.44 B.83 B.84 B.120 B.121 B.122 B.123) 
   N  119.9681 (A.44 B.83 B.84 B.120 B.121 B.122 B.123) 
   CA:-1  55.9747 (B.83 B.123) 
   CB:-1  18.8619 (B.84 B.121) 
   CA  59.7918 (B.122) 
   HA  4.020
   CB  32.6653 (B.120)
   HB1|HB2  1.90 
   CG  25.271
   HG1|HG2  1.49
   CD  29.122
   HD1|HD2  1.69
   HD2|HD1  1.79
   CE  42.749
   HE1|HE2  3.07
   C  178.3717
END_RES_DEF

RES_ID		73
RES_TYPE	GLN
PREV_TYPE	LYS(47.1)  MET(21.3)  VAL(17.0)  PRO(8.6)  TRP(5.9)  
SPIN_SYSTEM_ID	73
HETEROGENEITY	100
   HN  8.5667 (A.35 B.59 B.60) 
   N  118.6372 (A.35 B.59 B.60) 
   CA:-1  59.6898 (B.59) 
   CB:-1  32.6281 (B.60) 
   CA  59.2210
   HA  4.084
   CB  28.3510
   HB1|HB2  2.10
   HB2|HB1  1.95
   CG  34.287
   HG1|HG2  2.75
   HG2|HG1  2.634
   NE2  111.413
   HE21|HE22  6.668
   HE22|HE21  7.500
   C  179.4766
END_RES_DEF

RES_ID		74
RES_TYPE	SER
PREV_TYPE	GLN(29.5)  CYS(27.8)  GLU(20.5)  ARG(9.7)  TRP(8.7)  
SPIN_SYSTEM_ID	74
HETEROGENEITY	100
   HN  8.6995 (A.71 B.128 B.129) 
   N  112.2862 (A.71 B.128 B.129) 
   CA:-1  59.0814 (B.128) 
   CB:-1  28.3607 (B.129) 
   CA  61.8400
   HA  4.097
   CB  62.7400
   HB1|HB2  3.952
   HB2|HB1  3.786
   C  176.4406
END_RES_DEF

RES_ID		75
RES_TYPE	ARG
PREV_TYPE	SER(100.0)  
SPIN_SYSTEM_ID	75
HETEROGENEITY	100
   HN  8.1142 (A.6 B.6 B.7 B.14) 
   N  125.2927 (A.6 B.6 B.7 B.14) 
   CA:-1  61.9422 (B.6) 
   CB:-1  62.6199 (B.7) 
   CA  60.3550
   HA  4.114
   CB  30.1760 (B.14) 
   HB1|HB2  2.16
   HB2|HB1  2.08
   CG  27.573
   HG1|HG2  1.78
   HG2|HG1  1.87
   CD  43.779
   HD1|HD2  3.260
   C  179.5064
END_RES_DEF

RES_ID		76
RES_TYPE	ASP
PREV_TYPE	CYS(10.9)  
SPIN_SYSTEM_ID	76
HETEROGENEITY	100
   HN  8.6575 (A.17 B.25 B.26 B.46 B.47 B.48 B.49) 
   N  122.3688 (A.17 B.25 B.26 B.46 B.47 B.48 B.49) 
   CA:-1  60.2568 (B.25 B.48) 
   CB:-1  30.1076 (B.26 B.49) 
   CA  57.4394 (B.47) 
   HA  4.429
   CB  39.4886 (B.46)
   HB1|HB2  2.774
   HB2|HB1  2.296
   C  178.8485 
END_RES_DEF

RES_ID		77
RES_TYPE	CYS
PREV_TYPE	PHE(35.7)  TYR(34.7)  ASP(22.1)  
SPIN_SYSTEM_ID	77
HETEROGENEITY	100
   HN  8.2428 (A.13 B.18 B.19 B.30 B.31 B.32 B.33) 
   N  123.2362 (A.13 B.18 B.19 B.30 B.31 B.32 B.33) 
   CA:-1  57.3016 (B.18 B.33) 
   CB:-1  39.4831 (B.19 B.32) 
   CA  63.1891 (B.30) 
   HA  4.383
   CB  27.4539 (B.31) 
   HB1|HB2  2.885
   HB2|HB1  3.22
   C  176.597
END_RES_DEF

RES_ID		78
RES_TYPE	PHE
SPIN_SYSTEM_ID	78
HETEROGENEITY	100
   HN  8.8142 (A.33 B.56 B.57) 
   N  119.0361 (A.33 B.56 B.57) 
   CA:-1  63.0032 (B.56) 
   CB:-1  27.4499 (B.57) 
   CA  62.3500
   HA  3.701
   CB  39.7400
   HB1|HB2  3.45
   HB2|HB1  3.37
   CD1|CD2  131.95
   HD1|HD2  7.237
   C  176.5131
END_RES_DEF

RES_ID		79
RES_TYPE	GLY
PREV_TYPE	ILE(44.5)  PHE(28.8)  TYR(26.7)  
SPIN_SYSTEM_ID	79
HETEROGENEITY	100
   HN  8.7579 (A.72 B.130 B.131 B.183 B.184 B.185) 
   N  104.5800 (A.72 B.130 B.131 B.183 B.184 B.185) 
   CA:-1  62.3489 (B.130 B.185) 
   CB:-1  39.6793 (B.131 B.184) 
   CA  47.5285 (B.183) 
   HA1|HA2  3.575
   HA2|HA1  4.112
   C  175.8882
END_RES_DEF

RES_ID		80
RES_TYPE	CYS
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	80
HETEROGENEITY	100
   HN  7.5599 (A.29 B.49 B.83 B.84 B.85) 
   N  119.7295 (A.29 B.49 B.83 B.84 B.85) 
   CA:-1  47.5613 (B.49 B.84) 
   CA  61.7238 (B.83) 
   HA  4.140
   CB  27.3614 (B.85) 
   HB1|HB2  2.914
   HB2|HB1  3.026
   C  175.521
END_RES_DEF

RES_ID		81
RES_TYPE	LEU
PREV_TYPE	CYS(50.0)  GLN(24.4)  TRP(13.9)  GLU(11.8)  
SPIN_SYSTEM_ID	81
HETEROGENEITY	100
   HN  7.4249 (A.28 B.47 B.48 B.79 B.80 B.81 B.82) 
   N  120.5205 (A.28 B.47 B.48 B.79 B.80 B.81 B.82) 
   CA:-1  61.7340 (B.47 B.80) 
   CB:-1  27.3500 (B.48 B.82) 
   CA  57.8405 (B.79) 
   HA  3.855
   CB  40.7362 (B.81) 
   HB1|HB2  0.76
   HB2|HB1  -0.15
   CG  26.28
   HG  1.417
   CD1|CD2  23.248
   HD1#|HD2#  0.448
   CD2|CD1  28.091
   HD2#|HD1#  0.325
   C  178.7006
END_RES_DEF

RES_ID		82
RES_TYPE	ARG
PREV_TYPE	PHE(24.9)  ASP(23.9)  TYR(23.5)  LEU(18.9)  ILE(8.9)  
SPIN_SYSTEM_ID	82
HETEROGENEITY	100
   HN  8.5543 (A.20 B.31 B.32 B.56 B.57 B.58 B.59) 
   N  120.5055 (A.20 B.31 B.32 B.56 B.57 B.58 B.59) 
   CA:-1  57.8876 (B.31 B.58) 
   CB:-1  40.7180 (B.32 B.59) 
   CA  59.9303 (B.56) 
   HA  3.761
   CB  29.7653 (B.57) 
   HB1|HB2  1.235
   HB2|HB1  1.66
   CG  26.765
   HG1|HG2  1.64
   CD  43.833
   HD1|HD2  3.21
   HD2|HD1  3.31
   C  178.768
END_RES_DEF

RES_ID		83
RES_TYPE	GLU
PREV_TYPE	TRP(26.2)  GLU(23.0)  ARG(20.8)  CYS(16.0)  GLN(5.9)  
SPIN_SYSTEM_ID	83
HETEROGENEITY	100
   HN  7.9184 (A.50 B.95 B.96 B.134 B.135) 
   N  117.7332 (A.50 B.95 B.96 B.134 B.135) 
   CA:-1  59.9921 (B.95 B.135) 
   CB:-1  29.6544 (B.96 B.134) 
   CA  60.1000
   HA  4.098
   CB  29.7500
   HB1|HB2  2.152
   HB2|HB1  2.23
   CG  37.418
   HG1|HG2  2.355
   HG2|HG1  2.62
   C  179.3490
END_RES_DEF

RES_ID		84
RES_TYPE	TRP
PREV_TYPE	TRP(30.6)  GLU(21.0)  ARG(20.6)  CYS(13.8)  
SPIN_SYSTEM_ID	84
HETEROGENEITY	100
   HN  8.3530 (A.18 B.27 B.28) 
   N  121.3145 (A.18 B.27 B.28) 
   CA:-1  60.1338 (B.27) 
   CB:-1  29.8522 (B.28) 
   CA  64.1000
   HA  4.116
   CB  30.2100
   HB1|HB2  3.495
   HB2|HB1  3.72
   CD1  128.66
   HD1  7.528
   CZ2  114.28
   HZ2  7.387
   CH2  125.15
   HH2  7.237
   CZ3  121.660
   HZ3  7.059
   CE3  121.656
   HE3  7.769
   NE1  129.30
   HE1  9.339
   C   178.7989  
END_RES_DEF

RES_ID		85
RES_TYPE	CYS
PREV_TYPE	PRO(60.9)  VAL(39.1)  
SPIN_SYSTEM_ID	85
HETEROGENEITY	100
   HN  8.6915 (A.60 B.112 B.113) 
   N  115.8503 (A.60 B.112 B.113) 
   CA:-1  64.0987 (B.112) 
   CB:-1  30.2112 (B.113) 
   CA  64.5400
   HA  4.23
   CB  26.8800
   HB1|HB2  2.87
   HB2|HB1  3.37
   C  177.4679
END_RES_DEF

RES_ID		86
RES_TYPE	ASP
SPIN_SYSTEM_ID	86
HETEROGENEITY	100
   CA:-1  64.6626 (B.78 B.187) 
   CB:-1  26.9169 (B.77 B.188) 
   HN  8.1686 (B.77 B.78 B.187 B.188 B.202 B.203) 
   N  119.1031 (B.77 B.78 B.187 B.188 B.202 B.203) 
   CA  57.3102 (B.202) 
   HA  4.235
   CB  40.5306 (B.203)
   HB1|HB2  2.61
   HB2|HB1  2.70
   C  177.1675
END_RES_DEF

RES_ID		87
RES_TYPE	ALA
PREV_TYPE	ASP(30.0)  PHE(27.8)  TYR(26.5)  LEU(11.7)  
SPIN_SYSTEM_ID	87
HETEROGENEITY	100
   HN  7.1929 (A.51 B.97 B.98 B.136 B.137 B.138 B.139) 
   N  119.7539 (A.51 B.97 B.98 B.136 B.137 B.138 B.139) 
   CA:-1  57.3075 (B.97 B.137) 
   CB:-1  40.4899 (B.98 B.139) 
   CA  54.0898 (B.136) 
   HA  3.953
   CB  19.6459 (B.138) 
   HB#  0.651
   C  179.4758
END_RES_DEF

RES_ID		88
RES_TYPE	PHE
PREV_TYPE	ALA(100.0)  
SPIN_SYSTEM_ID	88
HETEROGENEITY	100
   HN  7.5996 (A.67 B.121 B.122 B.168 B.169 B.170) 
   N  114.4095 (A.67 B.121 B.122 B.168 B.169 B.170) 
   CA:-1  54.0909 (B.121) 
   CB:-1  19.6026 (B.122 B.170) 
   CA  59.6346 (B.168) 
   HA  4.456
   CB  42.0467 (B.169) 
   HB1|HB2  2.60
   HB2|HB1  0.74
   CD1|CD2  132.36
   HD1|HD2  6.336
   CE1|CE2  130.672
   HE1|HE2  6.989
   CZ  127.76
   HZ  6.699
   C  175.0814
END_RES_DEF

RES_ID		89
RES_TYPE	LEU
PREV_TYPE	PHE(10.1)  
SPIN_SYSTEM_ID	89
HETEROGENEITY	100
   HN  8.0368 (A.7 B.8 B.9 B.15 B.16 B.17 B.18) 
   N  124.1079 (A.7 B.8 B.9 B.15 B.16 B.17 B.18) 
   CA:-1  59.5628 (B.8 B.15) 
   CB:-1  42.0257 (B.9 B.18) 
   CA  58.3964 (B.16) 
   HA  4.56
   CB  44.9108 (B.17) 
   HB1|HB2  2.05
   HB2|HB1  1.512
   CG  28.20
   HG  1.79
   CD1|CD2  27.45
   HD1#|HD2#  0.851
   CD2|CD1  25.21
   HD2#|HD1#  1.12
END_RES_DEF

## the minore form

RES_ID          305
RES_TYPE        GLN
PREV_TYPE       SER
SPIN_SYSTEM_ID  305
HETEROGENEITY   100
   HN  8.3098
   N  122.0089
   CA:-1  58.6310
   CB:-1  64.1674
   CA  56.2333
   CB  30.0831
   C  177.6013
END_RES_DEF


RES_ID		308
RES_TYPE	ARG
PREV_TYPE	LYS
SPIN_SYSTEM_ID	308
HETEROGENEITY	100
   CA  56.2984 
   CB  31.0780 
   C  178.5988
END_RES_DEF

RES_ID		309
RES_TYPE	ASP
PREV_TYPE	TRP
SPIN_SYSTEM_ID	309
HETEROGENEITY	100
   HN  8.3503 
   N  120.7936
   CA:-1  56.1133 
   CB:-1  30.0230 
   CA  54.4844 
   CB  41.6141
   C  177.6013
END_RES_DEF

RES_ID		310
RES_TYPE	PHE
PREV_TYPE	ASP
SPIN_SYSTEM_ID	310
HETEROGENEITY	100
   HN  8.0301 
   N  119.8968
   CA:-1  54.4840 
   CB:-1  41.6140
   CA  57.9150
   CB  39.9100
   C  177.853
END_RES_DEF

RES_ID		311
RES_TYPE	VAL
PREV_TYPE	PHE
SPIN_SYSTEM_ID	311
HETEROGENEITY	100
   HN  7.9040 
   N  122.1780
   CA:-1 57.9150 
   CB:-1 39.9100 
   CA  62.2281 
   CB  33.0763
   C  175.3066
END_RES_DEF

RES_ID		312
RES_TYPE	ALA
PREV_TYPE	VAL
SPIN_SYSTEM_ID	312
HETEROGENEITY	100
   HN  8.11800
   N  127.1200
   CA:-1  62.2281
   CB:-1  33.0763 
   CA  52.3850 
   CB  19.7340 
   C  177.2970
END_RES_DEF

RES_ID		313
RES_TYPE	GLU
PREV_TYPE	ALA(100.0)  
SPIN_SYSTEM_ID	313
HETEROGENEITY	100
   HN  8.1600 
   N  120.9900
   CA:-1  52.3850 
   CB:-1  19.7340 
   CA  54.4040 
   CB  30.1870 
END_RES_DEF

RES_ID		314
RES_TYPE	PRO
SPIN_SYSTEM_ID	314
HETEROGENEITY	100
   CA  63.5200
   CB  32.1900
   C  176.2470
END_RES_DEF

RES_ID		315
RES_TYPE	MET
PREV_TYPE	PRO(49.6)  
SPIN_SYSTEM_ID	315
HETEROGENEITY	100
   HN  8.4110 
   N  120.140
   CA:-1  63.5200 
   CB:-1  32.1900 
   CA  55.8800 
   CB  33.0800 
   C  176.817
END_RES_DEF

RES_ID		316
RES_TYPE	GLY
PREV_TYPE	MET
SPIN_SYSTEM_ID	316
HETEROGENEITY	100
   HN  8.26000 
   N  109.4500 
   CA:-1  55.8800  
   CB:-1  33.0800  
   CA  45.5580 
   C  176.5484
END_RES_DEF

RES_ID		317
RES_TYPE	GLU
PREV_TYPE	GLY(100.0)  
SPIN_SYSTEM_ID	317
HETEROGENEITY	100
   HN  8.6448 
   N  126.7684 
   CA:-1  45.5580  
   C  176.204
END_RES_DEF


RES_ID          *
RES_TYPE        UNK
PREV_TYPE       UNK(100.0)
SPIN_SYSTEM_ID  318
HETEROGENEITY   100
   HN  8.1725
   N  121.4741
   CA:-1  56.3040
   CB:-1  29.6631
   CA  56.709
   CB  33.145
   C  176.204
END_RES_DEF
 
RES_ID          *
RES_TYPE        UNK
PREV_TYPE       UNK(100.0)
SPIN_SYSTEM_ID  319
HETEROGENEITY   100
   HN  8.3597
   N  121.1941
   CA:-1  53.2425
   CB:-1  31.1571
   CA  56.146
   CB  33.459
END_RES_DEF

RES_ID          *
RES_TYPE        UNK
PREV_TYPE       UNK(100.0)
SPIN_SYSTEM_ID  320
HETEROGENEITY   100
   HN  7.8157
   N  114.0740
   CA:-1  53.2425
   CB:-1  31.1571
   CA  56.146
   CB  33.459
END_RES_DEF

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           HT3      MET   1 119.572 -13.267  13.461
    2   2H    MET   1           HT2      MET   1 120.913 -12.697  14.334
    3   3H    MET   1           HT1      MET   1 119.342 -12.466  14.938
    4    HA   MET   1           HA       MET   1 119.539 -10.431  14.052
    5   1HB   MET   1           HB2      MET   1 121.569 -11.683  12.180
    6   2HB   MET   1           HB1      MET   1 121.121  -9.977  12.147
    7   1HG   MET   1           HG2      MET   1 122.149 -11.372  14.630
    8   2HG   MET   1           HG1      MET   1 123.195 -10.501  13.509
    9   1HE   MET   1           HE2      MET   1 123.104  -9.987  16.432
   10   2HE   MET   1           HE1      MET   1 122.199  -8.599  17.032
   11   3HE   MET   1           HE3      MET   1 121.385 -10.150  16.784
   12    H    THR   2           HN       THR   2 118.342  -9.380  12.403
   13    HA   THR   2           HA       THR   2 116.688 -11.207  10.756
   14    HB   THR   2           HB       THR   2 116.361  -8.208  10.944
   15    HG1  THR   2           HG1      THR   2 116.148  -8.527  13.006
   16   1HG2  THR   2          HG23      THR   2 114.423 -10.518  10.618
   17   2HG2  THR   2          HG22      THR   2 113.978  -8.812  10.666
   18   3HG2  THR   2          HG21      THR   2 114.955  -9.430   9.336
   19    H    THR   3           HN       THR   3 119.589  -9.808  10.317
   20    HA   THR   3           HA       THR   3 119.273  -8.450   7.789
   21    HB   THR   3           HB       THR   3 121.730  -8.671   7.627
   22    HG1  THR   3           HG1      THR   3 121.239 -10.786   9.154
   23   1HG2  THR   3          HG22      THR   3 120.585  -7.943  10.329
   24   2HG2  THR   3          HG21      THR   3 122.265  -7.636   9.887
   25   3HG2  THR   3          HG23      THR   3 120.961  -6.859   8.989
   26    H    SER   4           HN       SER   4 120.082  -9.270   5.703
   27    HA   SER   4           HA       SER   4 119.022 -11.885   5.090
   28   1HB   SER   4           HB2      SER   4 120.788 -10.036   3.457
   29   2HB   SER   4           HB1      SER   4 119.987 -11.474   2.830
   30    HG   SER   4           HG       SER   4 118.804  -9.132   3.912
   31    H    GLN   5           HN       GLN   5 120.221 -13.710   4.333
   32    HA   GLN   5           HA       GLN   5 122.413 -14.480   5.934
   33   1HB   GLN   5           HB2      GLN   5 120.940 -16.063   4.714
   34   2HB   GLN   5           HB1      GLN   5 121.659 -15.540   3.192
   35   1HG   GLN   5           HG2      GLN   5 123.872 -16.302   3.965
   36   2HG   GLN   5           HG1      GLN   5 123.166 -16.811   5.498
   37   1HE2  GLN   5          HE22      GLN   5 122.467 -19.976   4.144
   38   2HE2  GLN   5          HE21      GLN   5 123.035 -19.060   5.456
   39    H    LYS   6           HN       LYS   6 122.353 -12.561   3.028
   40    HA   LYS   6           HA       LYS   6 124.992 -13.045   2.088
   41   1HB   LYS   6           HB2      LYS   6 123.238 -10.585   1.938
   42   2HB   LYS   6           HB1      LYS   6 124.790 -10.723   1.110
   43   1HG   LYS   6           HG2      LYS   6 123.983 -12.724  -0.081
   44   2HG   LYS   6           HG1      LYS   6 122.430 -12.589   0.744
   45   1HD   LYS   6           HD2      LYS   6 122.091 -10.358  -0.262
   46   2HD   LYS   6           HD1      LYS   6 123.640 -10.504  -1.093
   47   1HE   LYS   6           HE2      LYS   6 122.862 -12.341  -2.417
   48   2HE   LYS   6           HE1      LYS   6 121.410 -12.518  -1.432
   49   1HZ   LYS   6           HZ2      LYS   6 122.033 -10.058  -2.963
   50   2HZ   LYS   6           HZ1      LYS   6 121.101 -11.330  -3.596
   51   3HZ   LYS   6           HZ3      LYS   6 120.560 -10.484  -2.230
   52    H    HIS   7           HN       HIS   7 123.756 -10.867   4.609
   53    HA   HIS   7           HA       HIS   7 126.110  -9.348   5.012
   54   1HB   HIS   7           HB2      HIS   7 124.065  -8.700   6.121
   55   2HB   HIS   7           HB1      HIS   7 123.971 -10.243   6.965
   56    HD2  HIS   7           HD2      HIS   7 125.618 -10.457   9.255
   57    HE1  HIS   7           HE1      HIS   7 127.118  -6.515   9.131
   58    HE2  HIS   7           HE2      HIS   7 126.972  -8.624  10.521
   59    H    ARG   8           HN       ARG   8 125.138 -12.405   6.593
   60    HA   ARG   8           HA       ARG   8 127.562 -12.659   8.107
   61   1HB   ARG   8           HB2      ARG   8 125.420 -14.634   7.289
   62   2HB   ARG   8           HB1      ARG   8 126.766 -15.055   8.351
   63   1HG   ARG   8           HG2      ARG   8 126.087 -13.275   9.920
   64   2HG   ARG   8           HG1      ARG   8 124.738 -12.858   8.861
   65   1HD   ARG   8           HD2      ARG   8 125.163 -15.560  10.171
   66   2HD   ARG   8           HD1      ARG   8 124.008 -14.338  10.706
   67    HE   ARG   8           HE       ARG   8 123.318 -14.729   8.068
   68   1HH1  ARG   8          HH21      ARG   8 123.904 -16.772  10.782
   69   2HH1  ARG   8          HH22      ARG   8 122.747 -17.968  10.300
   70   1HH2  ARG   8          HH11      ARG   8 121.802 -16.276   7.423
   71   2HH2  ARG   8          HH12      ARG   8 121.557 -17.687   8.397
   72    H    ASP   9           HN       ASP   9 126.558 -13.729   4.908
   73    HA   ASP   9           HA       ASP   9 128.806 -15.519   4.520
   74   1HB   ASP   9           HB2      ASP   9 126.889 -14.224   2.581
   75   2HB   ASP   9           HB1      ASP   9 128.149 -15.347   2.085
   76    H    PHE  10           HN       PHE  10 128.176 -12.105   3.731
   77    HA   PHE  10           HA       PHE  10 130.548 -11.752   2.142
   78   1HB   PHE  10           HB2      PHE  10 128.608 -10.215   2.087
   79   2HB   PHE  10           HB1      PHE  10 128.963  -9.719   3.739
   80    HD1  PHE  10           HD1      PHE  10 130.061  -9.565   0.227
   81    HD2  PHE  10           HD2      PHE  10 130.891  -8.299   4.248
   82    HE1  PHE  10           HE1      PHE  10 131.638  -7.858  -0.637
   83    HE2  PHE  10           HE2      PHE  10 132.471  -6.594   3.377
   84    HZ   PHE  10           HZ       PHE  10 132.845  -6.374   0.940
   85    H    VAL  11           HN       VAL  11 129.879 -11.309   5.611
   86    HA   VAL  11           HA       VAL  11 132.622 -10.362   6.106
   87    HB   VAL  11           HB       VAL  11 131.927 -10.242   8.440
   88   1HG1  VAL  11          HG13      VAL  11 129.846  -9.309   6.445
   89   2HG1  VAL  11          HG12      VAL  11 129.827  -8.841   8.144
   90   3HG1  VAL  11          HG11      VAL  11 131.184  -8.378   7.117
   91   1HG2  VAL  11          HG21      VAL  11 129.598 -11.872   7.421
   92   2HG2  VAL  11          HG23      VAL  11 130.691 -12.250   8.752
   93   3HG2  VAL  11          HG22      VAL  11 129.498 -10.962   8.929
   94    H    ALA  12           HN       ALA  12 131.778 -13.236   5.140
   95    HA   ALA  12           HA       ALA  12 133.354 -14.748   7.210
   96   1HB   ALA  12           HB3      ALA  12 131.100 -15.651   5.405
   97   2HB   ALA  12           HB2      ALA  12 132.103 -16.754   6.347
   98   3HB   ALA  12           HB1      ALA  12 131.089 -15.566   7.166
   99    H    GLU  13           HN       GLU  13 133.439 -13.583   4.027
  100    HA   GLU  13           HA       GLU  13 135.784 -15.263   3.484
  101   1HB   GLU  13           HB2      GLU  13 134.808 -15.800   1.134
  102   2HB   GLU  13           HB1      GLU  13 134.258 -16.764   2.504
  103   1HG   GLU  13           HG2      GLU  13 132.219 -15.527   2.676
  104   2HG   GLU  13           HG1      GLU  13 132.796 -14.290   1.558
  105    HA   PRO  14           HA       PRO  14 137.447 -11.607   1.581
  106   1HB   PRO  14           HB2      PRO  14 137.779 -13.309  -0.882
  107   2HB   PRO  14           HB1      PRO  14 138.943 -12.213  -0.109
  108   1HG   PRO  14           HG2      PRO  14 139.091 -14.864   0.215
  109   2HG   PRO  14           HG1      PRO  14 139.505 -13.739   1.521
  110   1HD   PRO  14           HD2      PRO  14 137.135 -15.521   1.278
  111   2HD   PRO  14           HD1      PRO  14 137.872 -14.808   2.731
  112    H    MET  15           HN       MET  15 136.858  -9.998  -0.070
  113    HA   MET  15           HA       MET  15 134.072 -10.350  -1.023
  114   1HB   MET  15           HB2      MET  15 134.343  -7.897  -1.644
  115   2HB   MET  15           HB1      MET  15 134.470  -8.261   0.077
  116   1HG   MET  15           HG2      MET  15 136.854  -8.111   0.030
  117   2HG   MET  15           HG1      MET  15 136.887  -8.100  -1.734
  118   1HE   MET  15           HE3      MET  15 135.499  -6.546   1.365
  119   2HE   MET  15           HE2      MET  15 137.086  -5.778   1.369
  120   3HE   MET  15           HE1      MET  15 135.639  -4.794   1.158
  121    H    GLY  16           HN       GLY  16 137.296 -10.409  -2.227
  122   1HA   GLY  16           HA2      GLY  16 138.162 -10.572  -4.413
  123   2HA   GLY  16           HA1      GLY  16 136.687 -11.483  -4.732
  124    H    GLU  17           HN       GLU  17 136.087 -10.672  -6.713
  125    HA   GLU  17           HA       GLU  17 135.908  -7.702  -7.050
  126   1HB   GLU  17           HB2      GLU  17 136.001  -9.978  -9.040
  127   2HB   GLU  17           HB1      GLU  17 135.678  -8.305  -9.494
  128   1HG   GLU  17           HG2      GLU  17 137.835  -7.620  -8.504
  129   2HG   GLU  17           HG1      GLU  17 138.158  -9.296  -8.058
  130    H    LYS  18           HN       LYS  18 133.854  -9.371  -5.616
  131    HA   LYS  18           HA       LYS  18 131.590  -9.808  -7.280
  132   1HB   LYS  18           HB2      LYS  18 131.822  -9.077  -4.348
  133   2HB   LYS  18           HB1      LYS  18 130.291  -9.505  -5.108
  134   1HG   LYS  18           HG2      LYS  18 131.226 -11.681  -5.787
  135   2HG   LYS  18           HG1      LYS  18 132.765 -11.254  -5.038
  136   1HD   LYS  18           HD2      LYS  18 131.647 -11.050  -2.848
  137   2HD   LYS  18           HD1      LYS  18 130.109 -11.486  -3.594
  138   1HE   LYS  18           HE2      LYS  18 130.936 -13.680  -4.177
  139   2HE   LYS  18           HE1      LYS  18 132.570 -13.251  -3.668
  140   1HZ   LYS  18           HZ2      LYS  18 131.417 -12.753  -1.426
  141   2HZ   LYS  18           HZ1      LYS  18 130.187 -13.764  -2.020
  142   3HZ   LYS  18           HZ3      LYS  18 131.764 -14.364  -1.842
  143    HA   PRO  19           HA       PRO  19 130.386  -5.691  -8.372
  144   1HB   PRO  19           HB2      PRO  19 127.622  -5.898  -8.399
  145   2HB   PRO  19           HB1      PRO  19 128.678  -6.531  -9.678
  146   1HG   PRO  19           HG2      PRO  19 127.423  -7.974  -7.381
  147   2HG   PRO  19           HG1      PRO  19 127.589  -8.479  -9.074
  148   1HD   PRO  19           HD2      PRO  19 129.239  -9.427  -7.154
  149   2HD   PRO  19           HD1      PRO  19 129.819  -9.122  -8.805
  150    H    VAL  20           HN       VAL  20 129.572  -3.732  -7.532
  151    HA   VAL  20           HA       VAL  20 129.744  -3.321  -4.766
  152    HB   VAL  20           HB       VAL  20 129.908  -1.490  -6.377
  153   1HG1  VAL  20          HG11      VAL  20 128.029  -2.488  -7.842
  154   2HG1  VAL  20          HG13      VAL  20 126.914  -1.653  -6.761
  155   3HG1  VAL  20          HG12      VAL  20 128.090  -0.733  -7.698
  156   1HG2  VAL  20          HG21      VAL  20 129.081  -1.116  -3.985
  157   2HG2  VAL  20          HG23      VAL  20 128.702   0.162  -5.140
  158   3HG2  VAL  20          HG22      VAL  20 127.460  -0.997  -4.668
  159    H    GLY  21           HN       GLY  21 126.804  -3.713  -6.732
  160   1HA   GLY  21           HA2      GLY  21 124.886  -3.363  -4.700
  161   2HA   GLY  21           HA1      GLY  21 124.637  -4.376  -6.121
  162    H    SER  22           HN       SER  22 127.323  -5.641  -4.671
  163    HA   SER  22           HA       SER  22 125.768  -7.849  -3.528
  164   1HB   SER  22           HB2      SER  22 127.863  -8.228  -4.844
  165   2HB   SER  22           HB1      SER  22 128.770  -7.406  -3.577
  166    HG   SER  22           HG       SER  22 128.641  -9.142  -2.400
  167    H    LEU  23           HN       LEU  23 127.437  -5.008  -2.415
  168    HA   LEU  23           HA       LEU  23 127.946  -5.817   0.281
  169   1HB   LEU  23           HB2      LEU  23 127.307  -3.064  -0.823
  170   2HB   LEU  23           HB1      LEU  23 127.988  -3.381   0.771
  171    HG   LEU  23           HG       LEU  23 129.295  -4.252  -1.824
  172   1HD1  LEU  23          HD11      LEU  23 129.838  -1.826  -0.085
  173   2HD1  LEU  23          HD13      LEU  23 130.847  -2.349  -1.434
  174   3HD1  LEU  23          HD12      LEU  23 129.194  -1.808  -1.727
  175   1HD2  LEU  23          HD21      LEU  23 130.076  -4.327   1.095
  176   2HD2  LEU  23          HD23      LEU  23 130.202  -5.601  -0.117
  177   3HD2  LEU  23          HD22      LEU  23 131.321  -4.244  -0.148
  178    H    ALA  24           HN       ALA  24 126.665  -5.822   2.077
  179    HA   ALA  24           HA       ALA  24 123.835  -6.088   1.750
  180   1HB   ALA  24           HB1      ALA  24 125.342  -6.994   3.641
  181   2HB   ALA  24           HB3      ALA  24 125.168  -5.398   4.370
  182   3HB   ALA  24           HB2      ALA  24 123.745  -6.401   4.095
  183    H    GLY  25           HN       GLY  25 122.208  -4.632   1.918
  184   1HA   GLY  25           HA2      GLY  25 121.179  -2.584   2.750
  185   2HA   GLY  25           HA1      GLY  25 122.783  -1.875   2.923
  186    H    ILE  26           HN       ILE  26 123.391  -3.088   0.125
  187    HA   ILE  26           HA       ILE  26 122.244  -0.783  -1.402
  188    HB   ILE  26           HB       ILE  26 124.429  -2.716  -2.239
  189   1HG1  ILE  26          HG12      ILE  26 125.230  -1.532  -0.283
  190   2HG1  ILE  26          HG11      ILE  26 125.969  -0.790  -1.700
  191   1HG2  ILE  26          HG22      ILE  26 123.583   0.004  -3.279
  192   2HG2  ILE  26          HG21      ILE  26 124.937  -0.947  -3.889
  193   3HG2  ILE  26          HG23      ILE  26 123.287  -1.542  -4.076
  194   1HD1  ILE  26          HD13      ILE  26 123.922   0.842  -1.606
  195   2HD1  ILE  26          HD12      ILE  26 123.768   0.275   0.055
  196   3HD1  ILE  26          HD11      ILE  26 125.250   1.072  -0.470
  197    H    GLY  27           HN       GLY  27 120.457  -1.250  -2.660
  198   1HA   GLY  27           HA2      GLY  27 119.863  -4.078  -3.275
  199   2HA   GLY  27           HA1      GLY  27 118.782  -2.708  -3.524
  200    H    GLU  28           HN       GLU  28 118.898  -4.369  -5.600
  201    HA   GLU  28           HA       GLU  28 120.988  -4.081  -7.478
  202   1HB   GLU  28           HB2      GLU  28 118.019  -4.513  -7.875
  203   2HB   GLU  28           HB1      GLU  28 119.186  -4.585  -9.195
  204   1HG   GLU  28           HG2      GLU  28 120.415  -6.369  -8.021
  205   2HG   GLU  28           HG1      GLU  28 119.258  -6.295  -6.691
  206    H    VAL  29           HN       VAL  29 118.140  -2.000  -6.956
  207    HA   VAL  29           HA       VAL  29 118.640  -0.309  -9.228
  208    HB   VAL  29           HB       VAL  29 117.140   0.153  -6.637
  209   1HG1  VAL  29          HG11      VAL  29 117.507   1.926  -9.055
  210   2HG1  VAL  29          HG13      VAL  29 116.080   2.057  -8.026
  211   3HG1  VAL  29          HG12      VAL  29 117.683   2.345  -7.352
  212   1HG2  VAL  29          HG21      VAL  29 116.252  -0.423  -9.481
  213   2HG2  VAL  29          HG23      VAL  29 116.197  -1.555  -8.130
  214   3HG2  VAL  29          HG22      VAL  29 115.170  -0.122  -8.121
  215    H    LEU  30           HN       LEU  30 119.515  -0.009  -5.799
  216    HA   LEU  30           HA       LEU  30 120.864   2.505  -6.062
  217   1HB   LEU  30           HB2      LEU  30 121.299   0.275  -4.051
  218   2HB   LEU  30           HB1      LEU  30 121.898   1.923  -3.881
  219    HG   LEU  30           HG       LEU  30 118.961   1.254  -4.234
  220   1HD1  LEU  30          HD13      LEU  30 120.635   1.555  -1.736
  221   2HD1  LEU  30          HD12      LEU  30 118.890   1.813  -1.727
  222   3HD1  LEU  30          HD11      LEU  30 119.546   0.237  -2.167
  223   1HD2  LEU  30          HD21      LEU  30 120.529   3.748  -3.544
  224   2HD2  LEU  30          HD23      LEU  30 119.278   3.539  -4.769
  225   3HD2  LEU  30          HD22      LEU  30 118.841   3.584  -3.065
  226    H    GLY  31           HN       GLY  31 121.939  -0.839  -6.433
  227   1HA   GLY  31           HA2      GLY  31 124.740  -0.343  -6.570
  228   2HA   GLY  31           HA1      GLY  31 123.921  -1.696  -7.351
  229    H    LYS  32           HN       LYS  32 122.214  -0.176  -9.071
  230    HA   LYS  32           HA       LYS  32 123.967   0.231 -11.293
  231   1HB   LYS  32           HB2      LYS  32 121.091   1.048 -10.830
  232   2HB   LYS  32           HB1      LYS  32 121.930   1.268 -12.367
  233   1HG   LYS  32           HG2      LYS  32 122.285  -1.096 -12.608
  234   2HG   LYS  32           HG1      LYS  32 121.733  -1.405 -10.962
  235   1HD   LYS  32           HD2      LYS  32 119.951  -1.967 -12.537
  236   2HD   LYS  32           HD1      LYS  32 119.477  -0.559 -11.589
  237   1HE   LYS  32           HE2      LYS  32 119.894   0.931 -13.392
  238   2HE   LYS  32           HE1      LYS  32 120.818  -0.279 -14.284
  239   1HZ   LYS  32           HZ2      LYS  32 117.937  -0.556 -13.634
  240   2HZ   LYS  32           HZ1      LYS  32 118.510   0.092 -15.097
  241   3HZ   LYS  32           HZ3      LYS  32 118.854  -1.519 -14.692
  242    H    LYS  33           HN       LYS  33 122.443   2.598  -9.077
  243    HA   LYS  33           HA       LYS  33 123.288   4.902 -10.563
  244   1HB   LYS  33           HB2      LYS  33 122.665   4.528  -7.620
  245   2HB   LYS  33           HB1      LYS  33 122.969   6.101  -8.361
  246   1HG   LYS  33           HG2      LYS  33 121.102   5.727  -9.931
  247   2HG   LYS  33           HG1      LYS  33 120.794   4.157  -9.189
  248   1HD   LYS  33           HD2      LYS  33 120.347   5.260  -7.028
  249   2HD   LYS  33           HD1      LYS  33 120.652   6.832  -7.768
  250   1HE   LYS  33           HE2      LYS  33 118.220   6.299  -7.646
  251   2HE   LYS  33           HE1      LYS  33 118.780   6.511  -9.305
  252   1HZ   LYS  33           HZ2      LYS  33 118.756   3.840  -8.060
  253   2HZ   LYS  33           HZ1      LYS  33 117.339   4.482  -8.742
  254   3HZ   LYS  33           HZ3      LYS  33 118.714   4.252  -9.708
  255    H    LEU  34           HN       LEU  34 124.803   3.166  -7.840
  256    HA   LEU  34           HA       LEU  34 127.089   4.868  -7.623
  257   1HB   LEU  34           HB2      LEU  34 126.672   1.950  -6.942
  258   2HB   LEU  34           HB1      LEU  34 128.151   2.817  -6.561
  259    HG   LEU  34           HG       LEU  34 125.434   3.818  -5.687
  260   1HD1  LEU  34          HD11      LEU  34 125.821   1.539  -4.782
  261   2HD1  LEU  34          HD13      LEU  34 127.368   2.075  -4.126
  262   3HD1  LEU  34          HD12      LEU  34 125.864   2.762  -3.512
  263   1HD2  LEU  34          HD23      LEU  34 128.316   4.469  -5.013
  264   2HD2  LEU  34          HD22      LEU  34 127.009   5.567  -5.446
  265   3HD2  LEU  34          HD21      LEU  34 127.033   4.816  -3.857
  266    H    GLU  35           HN       GLU  35 126.432   2.022  -9.604
  267    HA   GLU  35           HA       GLU  35 129.062   1.711 -10.671
  268   1HB   GLU  35           HB2      GLU  35 127.273   0.031 -11.008
  269   2HB   GLU  35           HB1      GLU  35 126.413   1.162 -12.052
  270   1HG   GLU  35           HG2      GLU  35 128.320   1.193 -13.614
  271   2HG   GLU  35           HG1      GLU  35 129.206   0.089 -12.563
  272    H    GLU  36           HN       GLU  36 126.367   3.767 -11.702
  273    HA   GLU  36           HA       GLU  36 127.672   4.764 -14.066
  274   1HB   GLU  36           HB2      GLU  36 125.449   5.895 -12.340
  275   2HB   GLU  36           HB1      GLU  36 125.981   6.637 -13.850
  276   1HG   GLU  36           HG2      GLU  36 125.475   4.545 -15.060
  277   2HG   GLU  36           HG1      GLU  36 124.940   3.803 -13.552
  278    H    ARG  37           HN       ARG  37 128.031   5.392 -10.705
  279    HA   ARG  37           HA       ARG  37 129.321   8.020 -11.148
  280   1HB   ARG  37           HB2      ARG  37 128.758   6.415  -8.651
  281   2HB   ARG  37           HB1      ARG  37 129.645   7.941  -8.640
  282   1HG   ARG  37           HG2      ARG  37 127.727   9.044  -9.742
  283   2HG   ARG  37           HG1      ARG  37 126.832   7.528  -9.700
  284   1HD   ARG  37           HD2      ARG  37 127.190   7.530  -7.183
  285   2HD   ARG  37           HD1      ARG  37 127.773   9.182  -7.339
  286    HE   ARG  37           HE       ARG  37 125.030   8.337  -7.268
  287   1HH1  ARG  37          HH21      ARG  37 127.106  10.489  -9.005
  288   2HH1  ARG  37          HH22      ARG  37 125.797  11.433  -9.630
  289   1HH2  ARG  37          HH11      ARG  37 123.341   9.572  -8.060
  290   2HH2  ARG  37          HH12      ARG  37 123.676  10.923  -9.090
  291    H    GLY  38           HN       GLY  38 130.382   4.927 -11.589
  292   1HA   GLY  38           HA2      GLY  38 132.700   4.576 -12.231
  293   2HA   GLY  38           HA1      GLY  38 133.200   5.779 -11.054
  294    H    PHE  39           HN       PHE  39 130.888   3.772  -9.623
  295    HA   PHE  39           HA       PHE  39 133.063   2.170  -8.317
  296   1HB   PHE  39           HB2      PHE  39 130.228   2.752  -7.433
  297   2HB   PHE  39           HB1      PHE  39 131.394   1.799  -6.524
  298    HD1  PHE  39           HD2      PHE  39 133.324   2.861  -5.453
  299    HD2  PHE  39           HD1      PHE  39 130.440   5.165  -7.636
  300    HE1  PHE  39           HE2      PHE  39 134.239   4.942  -4.460
  301    HE2  PHE  39           HE1      PHE  39 131.348   7.247  -6.646
  302    HZ   PHE  39           HZ       PHE  39 133.252   7.138  -5.055
  303    H    ASP  40           HN       ASP  40 132.952   0.866 -10.399
  304    HA   ASP  40           HA       ASP  40 130.546  -0.748 -10.819
  305   1HB   ASP  40           HB2      ASP  40 131.887  -1.845 -12.580
  306   2HB   ASP  40           HB1      ASP  40 131.953  -0.088 -12.725
  307    H    LYS  41           HN       LYS  41 133.257  -0.948  -8.772
  308    HA   LYS  41           HA       LYS  41 132.650  -3.833  -8.212
  309   1HB   LYS  41           HB2      LYS  41 135.371  -2.492  -8.154
  310   2HB   LYS  41           HB1      LYS  41 135.037  -4.158  -7.691
  311   1HG   LYS  41           HG2      LYS  41 134.433  -3.047 -10.447
  312   2HG   LYS  41           HG1      LYS  41 135.940  -3.868 -10.047
  313   1HD   LYS  41           HD2      LYS  41 134.423  -5.804  -9.206
  314   2HD   LYS  41           HD1      LYS  41 133.141  -5.007 -10.115
  315   1HE   LYS  41           HE2      LYS  41 134.219  -6.711 -11.505
  316   2HE   LYS  41           HE1      LYS  41 134.540  -5.105 -12.157
  317   1HZ   LYS  41           HZ3      LYS  41 136.532  -5.677 -10.293
  318   2HZ   LYS  41           HZ2      LYS  41 136.380  -7.042 -11.293
  319   3HZ   LYS  41           HZ1      LYS  41 136.692  -5.518 -11.974
  320    H    ALA  42           HN       ALA  42 132.808  -4.428  -6.026
  321    HA   ALA  42           HA       ALA  42 131.959  -2.445  -4.153
  322   1HB   ALA  42           HB1      ALA  42 131.417  -4.856  -3.970
  323   2HB   ALA  42           HB3      ALA  42 133.106  -5.191  -3.590
  324   3HB   ALA  42           HB2      ALA  42 132.128  -4.224  -2.486
  325    H    TYR  43           HN       TYR  43 135.171  -3.933  -4.658
  326    HA   TYR  43           HA       TYR  43 136.377  -2.882  -2.330
  327   1HB   TYR  43           HB2      TYR  43 138.534  -3.225  -3.404
  328   2HB   TYR  43           HB1      TYR  43 137.465  -4.584  -3.731
  329    HD1  TYR  43           HD1      TYR  43 138.759  -1.398  -5.161
  330    HD2  TYR  43           HD2      TYR  43 136.959  -5.212  -5.958
  331    HE1  TYR  43           HE1      TYR  43 139.116  -1.059  -7.581
  332    HE2  TYR  43           HE2      TYR  43 137.314  -4.872  -8.390
  333    HH   TYR  43           HH       TYR  43 138.094  -3.522  -9.960
  334    H    VAL  44           HN       VAL  44 135.388  -1.124  -5.153
  335    HA   VAL  44           HA       VAL  44 137.250   1.103  -4.680
  336    HB   VAL  44           HB       VAL  44 134.666   1.066  -6.289
  337   1HG1  VAL  44          HG13      VAL  44 135.602   3.326  -5.606
  338   2HG1  VAL  44          HG12      VAL  44 137.057   2.917  -6.511
  339   3HG1  VAL  44          HG11      VAL  44 135.512   3.064  -7.346
  340   1HG2  VAL  44          HG22      VAL  44 136.391  -0.600  -7.043
  341   2HG2  VAL  44          HG21      VAL  44 136.066   0.655  -8.236
  342   3HG2  VAL  44          HG23      VAL  44 137.527   0.733  -7.249
  343    H    VAL  45           HN       VAL  45 134.075   0.107  -3.768
  344    HA   VAL  45           HA       VAL  45 133.317   2.632  -2.470
  345    HB   VAL  45           HB       VAL  45 132.121  -0.151  -2.219
  346   1HG1  VAL  45          HG11      VAL  45 131.223   2.565  -1.224
  347   2HG1  VAL  45          HG13      VAL  45 130.135   1.183  -1.353
  348   3HG1  VAL  45          HG12      VAL  45 131.523   1.116  -0.266
  349   1HG2  VAL  45          HG22      VAL  45 131.436   2.272  -3.902
  350   2HG2  VAL  45          HG21      VAL  45 131.846   0.652  -4.467
  351   3HG2  VAL  45          HG23      VAL  45 130.314   0.938  -3.641
  352    H    LEU  46           HN       LEU  46 134.760  -0.446  -1.577
  353    HA   LEU  46           HA       LEU  46 134.700  -0.143   1.262
  354   1HB   LEU  46           HB2      LEU  46 135.382  -2.253   0.099
  355   2HB   LEU  46           HB1      LEU  46 136.841  -1.448  -0.464
  356    HG   LEU  46           HG       LEU  46 137.392  -1.001   1.995
  357   1HD1  LEU  46          HD11      LEU  46 135.012  -2.822   2.301
  358   2HD1  LEU  46          HD13      LEU  46 136.284  -2.780   3.520
  359   3HD1  LEU  46          HD12      LEU  46 135.373  -1.320   3.149
  360   1HD2  LEU  46          HD23      LEU  46 137.518  -3.593   0.544
  361   2HD2  LEU  46          HD22      LEU  46 138.804  -2.638   1.273
  362   3HD2  LEU  46          HD21      LEU  46 137.814  -3.686   2.282
  363    H    GLY  47           HN       GLY  47 136.871   1.005  -1.255
  364   1HA   GLY  47           HA2      GLY  47 138.919   2.103   0.385
  365   2HA   GLY  47           HA1      GLY  47 138.532   2.665  -1.240
  366    H    GLN  48           HN       GLN  48 135.851   3.546  -0.761
  367    HA   GLN  48           HA       GLN  48 136.331   6.176   0.241
  368   1HB   GLN  48           HB2      GLN  48 134.425   5.501  -1.257
  369   2HB   GLN  48           HB1      GLN  48 133.669   4.720   0.131
  370   1HG   GLN  48           HG2      GLN  48 132.715   6.937  -0.108
  371   2HG   GLN  48           HG1      GLN  48 133.737   6.928   1.329
  372   1HE2  GLN  48          HE22      GLN  48 135.472   9.723   0.078
  373   2HE2  GLN  48          HE21      GLN  48 134.684   8.986   1.389
  374    H    PHE  49           HN       PHE  49 135.004   3.277   1.792
  375    HA   PHE  49           HA       PHE  49 134.285   4.435   4.300
  376   1HB   PHE  49           HB2      PHE  49 133.626   2.158   3.575
  377   2HB   PHE  49           HB1      PHE  49 135.304   1.641   3.673
  378    HD1  PHE  49           HD1      PHE  49 132.796   3.431   5.828
  379    HD2  PHE  49           HD2      PHE  49 135.909   0.476   5.607
  380    HE1  PHE  49           HE1      PHE  49 132.447   2.881   8.221
  381    HE2  PHE  49           HE2      PHE  49 135.563  -0.067   7.999
  382    HZ   PHE  49           HZ       PHE  49 133.831   1.133   9.307
  383    H    LEU  50           HN       LEU  50 137.309   3.120   3.064
  384    HA   LEU  50           HA       LEU  50 138.796   3.391   5.535
  385   1HB   LEU  50           HB2      LEU  50 139.825   3.424   2.678
  386   2HB   LEU  50           HB1      LEU  50 140.798   3.147   4.121
  387    HG   LEU  50           HG       LEU  50 138.498   1.400   3.200
  388   1HD1  LEU  50          HD12      LEU  50 140.727   1.406   1.874
  389   2HD1  LEU  50          HD11      LEU  50 141.410   0.619   3.295
  390   3HD1  LEU  50          HD13      LEU  50 140.091  -0.147   2.409
  391   1HD2  LEU  50          HD23      LEU  50 140.296   1.366   5.617
  392   2HD2  LEU  50          HD22      LEU  50 138.555   1.094   5.521
  393   3HD2  LEU  50          HD21      LEU  50 139.670  -0.151   4.971
  394    H    VAL  51           HN       VAL  51 138.300   5.521   2.744
  395    HA   VAL  51           HA       VAL  51 140.127   7.570   3.522
  396    HB   VAL  51           HB       VAL  51 137.583   7.700   1.878
  397   1HG1  VAL  51          HG13      VAL  51 139.719   9.768   2.435
  398   2HG1  VAL  51          HG12      VAL  51 138.691   9.841   1.004
  399   3HG1  VAL  51          HG11      VAL  51 137.973   9.936   2.612
  400   1HG2  VAL  51          HG22      VAL  51 139.490   6.282   1.045
  401   2HG2  VAL  51          HG21      VAL  51 139.098   7.634  -0.016
  402   3HG2  VAL  51          HG23      VAL  51 140.501   7.727   1.048
  403    H    LEU  52           HN       LEU  52 136.843   6.871   4.576
  404    HA   LEU  52           HA       LEU  52 136.613   9.483   5.953
  405   1HB   LEU  52           HB2      LEU  52 134.754   7.089   5.926
  406   2HB   LEU  52           HB1      LEU  52 134.378   8.676   6.594
  407    HG   LEU  52           HG       LEU  52 135.054   8.108   3.692
  408   1HD1  LEU  52          HD13      LEU  52 132.826   7.272   4.515
  409   2HD1  LEU  52          HD12      LEU  52 132.426   8.936   4.944
  410   3HD1  LEU  52          HD11      LEU  52 132.708   8.504   3.257
  411   1HD2  LEU  52          HD23      LEU  52 134.523  10.633   5.256
  412   2HD2  LEU  52          HD22      LEU  52 135.729  10.333   4.003
  413   3HD2  LEU  52          HD21      LEU  52 134.039  10.545   3.561
  414    H    LYS  53           HN       LYS  53 138.522   7.093   6.729
  415    HA   LYS  53           HA       LYS  53 139.238   6.098   8.731
  416   1HB   LYS  53           HB2      LYS  53 138.117   8.715   9.780
  417   2HB   LYS  53           HB1      LYS  53 139.241   7.666  10.646
  418   1HG   LYS  53           HG2      LYS  53 140.895   7.932   8.833
  419   2HG   LYS  53           HG1      LYS  53 139.777   8.982   7.964
  420   1HD   LYS  53           HD2      LYS  53 139.805  10.574   9.851
  421   2HD   LYS  53           HD1      LYS  53 140.929   9.525  10.715
  422   1HE   LYS  53           HE2      LYS  53 141.497  10.701   7.982
  423   2HE   LYS  53           HE1      LYS  53 142.042  11.427   9.493
  424   1HZ   LYS  53           HZ1      LYS  53 142.668   8.651   8.649
  425   2HZ   LYS  53           HZ3      LYS  53 143.711   9.972   8.437
  426   3HZ   LYS  53           HZ2      LYS  53 143.287   9.469  10.004
  427    H    LYS  54           HN       LYS  54 136.563   5.369   7.900
  428    HA   LYS  54           HA       LYS  54 134.740   4.156   8.700
  429   1HB   LYS  54           HB2      LYS  54 136.234   4.151  11.334
  430   2HB   LYS  54           HB1      LYS  54 135.000   3.012  10.807
  431   1HG   LYS  54           HG2      LYS  54 136.449   2.276   8.959
  432   2HG   LYS  54           HG1      LYS  54 137.690   3.416   9.474
  433   1HD   LYS  54           HD2      LYS  54 137.794   2.271  11.678
  434   2HD   LYS  54           HD1      LYS  54 136.617   1.092  11.097
  435   1HE   LYS  54           HE2      LYS  54 138.125   0.315   9.387
  436   2HE   LYS  54           HE1      LYS  54 139.253   1.632   9.710
  437   1HZ   LYS  54           HZ1      LYS  54 139.050   0.534  12.126
  438   2HZ   LYS  54           HZ3      LYS  54 138.833  -0.843  11.159
  439   3HZ   LYS  54           HZ2      LYS  54 140.238   0.098  10.993
  440    H    ASP  55           HN       ASP  55 134.957   7.245   9.242
  441    HA   ASP  55           HA       ASP  55 133.440   7.655  11.671
  442   1HB   ASP  55           HB2      ASP  55 133.794   9.337   9.184
  443   2HB   ASP  55           HB1      ASP  55 132.868   9.884  10.582
  444    H    GLU  56           HN       GLU  56 131.393   6.943  11.979
  445    HA   GLU  56           HA       GLU  56 129.781   5.800   9.938
  446   1HB   GLU  56           HB2      GLU  56 129.662   5.258  12.366
  447   2HB   GLU  56           HB1      GLU  56 128.894   6.820  12.644
  448   1HG   GLU  56           HG2      GLU  56 127.047   6.190  11.134
  449   2HG   GLU  56           HG1      GLU  56 127.815   4.628  10.845
  450    H    ASP  57           HN       ASP  57 129.574   9.055  11.419
  451    HA   ASP  57           HA       ASP  57 127.092   9.730  10.098
  452   1HB   ASP  57           HB2      ASP  57 129.293  11.438  11.294
  453   2HB   ASP  57           HB1      ASP  57 127.790  12.105  10.657
  454    H    LEU  58           HN       LEU  58 130.480  10.268   9.307
  455    HA   LEU  58           HA       LEU  58 129.881  11.830   6.929
  456   1HB   LEU  58           HB2      LEU  58 132.402  10.286   7.608
  457   2HB   LEU  58           HB1      LEU  58 132.252  11.486   6.330
  458    HG   LEU  58           HG       LEU  58 131.819  12.028   9.286
  459   1HD1  LEU  58          HD11      LEU  58 134.198  11.551   8.578
  460   2HD1  LEU  58          HD13      LEU  58 134.088  12.934   7.491
  461   3HD1  LEU  58          HD12      LEU  58 133.947  13.168   9.233
  462   1HD2  LEU  58          HD23      LEU  58 131.578  13.699   6.784
  463   2HD2  LEU  58          HD22      LEU  58 130.518  13.648   8.194
  464   3HD2  LEU  58          HD21      LEU  58 132.073  14.465   8.294
  465    H    PHE  59           HN       PHE  59 130.526   8.410   7.545
  466    HA   PHE  59           HA       PHE  59 130.524   7.620   4.787
  467   1HB   PHE  59           HB2      PHE  59 131.421   6.148   6.515
  468   2HB   PHE  59           HB1      PHE  59 129.830   6.028   7.268
  469    HD1  PHE  59           HD1      PHE  59 131.877   5.075   4.347
  470    HD2  PHE  59           HD2      PHE  59 128.046   4.724   6.258
  471    HE1  PHE  59           HE1      PHE  59 131.284   3.213   2.817
  472    HE2  PHE  59           HE2      PHE  59 127.452   2.865   4.729
  473    HZ   PHE  59           HZ       PHE  59 129.070   2.111   3.007
  474    H    ARG  60           HN       ARG  60 127.898   7.592   7.244
  475    HA   ARG  60           HA       ARG  60 125.919   6.563   5.478
  476   1HB   ARG  60           HB2      ARG  60 125.651   8.333   7.914
  477   2HB   ARG  60           HB1      ARG  60 124.270   7.659   7.050
  478   1HG   ARG  60           HG2      ARG  60 125.149   5.378   7.432
  479   2HG   ARG  60           HG1      ARG  60 126.514   6.058   8.315
  480   1HD   ARG  60           HD2      ARG  60 123.595   6.391   9.064
  481   2HD   ARG  60           HD1      ARG  60 124.743   5.319   9.870
  482    HE   ARG  60           HE       ARG  60 125.971   7.777  10.031
  483   1HH1  ARG  60          HH21      ARG  60 122.838   6.535  10.771
  484   2HH1  ARG  60          HH22      ARG  60 122.570   7.634  12.082
  485   1HH2  ARG  60          HH11      ARG  60 125.632   9.216  11.730
  486   2HH2  ARG  60          HH12      ARG  60 124.150   9.151  12.624
  487    H    GLU  61           HN       GLU  61 126.793   9.983   6.169
  488    HA   GLU  61           HA       GLU  61 124.719  11.056   4.497
  489   1HB   GLU  61           HB2      GLU  61 127.394  12.193   5.348
  490   2HB   GLU  61           HB1      GLU  61 126.200  13.107   4.425
  491   1HG   GLU  61           HG2      GLU  61 124.537  12.735   6.216
  492   2HG   GLU  61           HG1      GLU  61 125.746  11.848   7.145
  493    H    TRP  62           HN       TRP  62 127.989   9.897   3.849
  494    HA   TRP  62           HA       TRP  62 128.214  10.915   1.200
  495   1HB   TRP  62           HB2      TRP  62 130.177  10.000   2.252
  496   2HB   TRP  62           HB1      TRP  62 129.388   8.441   2.495
  497    HD1  TRP  62           HD1      TRP  62 130.807  10.669  -0.297
  498    HE1  TRP  62           HE1      TRP  62 131.246   9.200  -2.373
  499    HE3  TRP  62           HE3      TRP  62 128.792   6.253   1.301
  500    HZ2  TRP  62           HZ2      TRP  62 130.799   6.502  -3.240
  501    HZ3  TRP  62           HZ3      TRP  62 128.820   4.256  -0.163
  502    HH2  TRP  62           HH2      TRP  62 129.816   4.375  -2.429
  503    H    LEU  63           HN       LEU  63 126.970   7.772   2.355
  504    HA   LEU  63           HA       LEU  63 126.337   6.826  -0.282
  505   1HB   LEU  63           HB2      LEU  63 126.657   5.311   1.627
  506   2HB   LEU  63           HB1      LEU  63 125.240   5.995   2.418
  507    HG   LEU  63           HG       LEU  63 123.834   5.225   0.521
  508   1HD1  LEU  63          HD11      LEU  63 126.508   4.299  -0.506
  509   2HD1  LEU  63          HD13      LEU  63 125.046   3.421  -0.953
  510   3HD1  LEU  63          HD12      LEU  63 125.212   5.123  -1.371
  511   1HD2  LEU  63          HD21      LEU  63 124.159   3.804   2.522
  512   2HD2  LEU  63          HD23      LEU  63 123.938   2.831   1.068
  513   3HD2  LEU  63          HD22      LEU  63 125.551   3.048   1.746
  514    H    LYS  64           HN       LYS  64 124.289   8.191   2.295
  515    HA   LYS  64           HA       LYS  64 121.853   8.115   0.818
  516   1HB   LYS  64           HB2      LYS  64 121.912   8.513   3.251
  517   2HB   LYS  64           HB1      LYS  64 122.674  10.080   2.977
  518   1HG   LYS  64           HG2      LYS  64 120.696  10.838   1.714
  519   2HG   LYS  64           HG1      LYS  64 119.938   9.265   1.945
  520   1HD   LYS  64           HD2      LYS  64 119.982   9.599   4.385
  521   2HD   LYS  64           HD1      LYS  64 120.746  11.172   4.157
  522   1HE   LYS  64           HE2      LYS  64 118.390  11.571   4.452
  523   2HE   LYS  64           HE1      LYS  64 118.750  11.830   2.746
  524   1HZ   LYS  64           HZ3      LYS  64 118.132   9.107   3.254
  525   2HZ   LYS  64           HZ2      LYS  64 116.877  10.113   3.800
  526   3HZ   LYS  64           HZ1      LYS  64 117.390  10.192   2.183
  527    H    ASP  65           HN       ASP  65 124.206  10.764   1.189
  528    HA   ASP  65           HA       ASP  65 122.793  12.549  -0.581
  529   1HB   ASP  65           HB2      ASP  65 125.713  12.506   0.243
  530   2HB   ASP  65           HB1      ASP  65 124.920  13.838  -0.595
  531    H    THR  66           HN       THR  66 125.096   9.964  -1.072
  532    HA   THR  66           HA       THR  66 125.780  10.778  -3.783
  533    HB   THR  66           HB       THR  66 126.276   8.227  -2.229
  534    HG1  THR  66           HG1      THR  66 127.920   9.322  -1.574
  535   1HG2  THR  66          HG21      THR  66 127.116   9.030  -5.024
  536   2HG2  THR  66          HG23      THR  66 127.936   7.774  -4.098
  537   3HG2  THR  66          HG22      THR  66 126.242   7.577  -4.538
  538    H    CYS  67           HN       CYS  67 123.404   8.507  -2.365
  539    HA   CYS  67           HA       CYS  67 122.382   8.069  -5.162
  540   1HB   CYS  67           HB2      CYS  67 121.887   5.736  -4.512
  541   2HB   CYS  67           HB1      CYS  67 123.613   6.091  -4.448
  542    HG   CYS  67           HG       CYS  67 123.414   5.219  -2.125
  543    H    GLY  68           HN       GLY  68 121.576   8.505  -1.761
  544   1HA   GLY  68           HA2      GLY  68 119.439   9.554  -1.184
  545   2HA   GLY  68           HA1      GLY  68 118.697   8.734  -2.559
  546    H    ALA  69           HN       ALA  69 120.930   6.800  -0.817
  547    HA   ALA  69           HA       ALA  69 119.121   4.757  -0.170
  548   1HB   ALA  69           HB3      ALA  69 121.579   4.496  -0.078
  549   2HB   ALA  69           HB2      ALA  69 121.635   5.548   1.337
  550   3HB   ALA  69           HB1      ALA  69 120.832   3.981   1.435
  551    H    ASN  70           HN       ASN  70 118.052   4.193   1.861
  552    HA   ASN  70           HA       ASN  70 117.144   6.579   3.332
  553   1HB   ASN  70           HB2      ASN  70 116.365   3.653   3.480
  554   2HB   ASN  70           HB1      ASN  70 115.607   4.931   4.430
  555   1HD2  ASN  70          HD22      ASN  70 114.292   6.510   1.350
  556   2HD2  ASN  70          HD21      ASN  70 115.220   6.993   2.686
  557    H    ALA  71           HN       ALA  71 116.957   6.339   5.779
  558    HA   ALA  71           HA       ALA  71 119.533   6.107   6.950
  559   1HB   ALA  71           HB1      ALA  71 117.588   7.400   7.889
  560   2HB   ALA  71           HB3      ALA  71 116.882   5.864   8.395
  561   3HB   ALA  71           HB2      ALA  71 118.420   6.395   9.077
  562    H    LYS  72           HN       LYS  72 116.958   3.715   6.580
  563    HA   LYS  72           HA       LYS  72 118.129   1.830   8.448
  564   1HB   LYS  72           HB2      LYS  72 116.230   1.317   6.135
  565   2HB   LYS  72           HB1      LYS  72 116.554   0.214   7.470
  566   1HG   LYS  72           HG2      LYS  72 115.440   3.006   7.850
  567   2HG   LYS  72           HG1      LYS  72 114.428   1.571   7.707
  568   1HD   LYS  72           HD2      LYS  72 115.819   0.605   9.653
  569   2HD   LYS  72           HD1      LYS  72 116.406   2.252   9.891
  570   1HE   LYS  72           HE2      LYS  72 114.494   1.943  11.331
  571   2HE   LYS  72           HE1      LYS  72 114.017   3.017  10.017
  572   1HZ   LYS  72           HZ1      LYS  72 113.628   0.113   9.753
  573   2HZ   LYS  72           HZ3      LYS  72 112.514   1.032  10.641
  574   3HZ   LYS  72           HZ2      LYS  72 112.785   1.383   9.001
  575    H    GLN  73           HN       GLN  73 118.309   2.320   4.955
  576    HA   GLN  73           HA       GLN  73 119.830  -0.032   4.367
  577   1HB   GLN  73           HB2      GLN  73 119.522   2.614   2.931
  578   2HB   GLN  73           HB1      GLN  73 120.422   1.252   2.264
  579   1HG   GLN  73           HG2      GLN  73 118.406  -0.162   2.419
  580   2HG   GLN  73           HG1      GLN  73 117.502   1.201   3.082
  581   1HE2  GLN  73          HE22      GLN  73 118.419   2.836  -0.314
  582   2HE2  GLN  73          HE21      GLN  73 119.210   2.995   1.180
  583    H    SER  74           HN       SER  74 120.770   3.277   5.262
  584    HA   SER  74           HA       SER  74 123.550   2.940   4.707
  585   1HB   SER  74           HB2      SER  74 123.771   5.065   5.593
  586   2HB   SER  74           HB1      SER  74 122.030   5.063   5.336
  587    HG   SER  74           HG       SER  74 121.833   5.257   7.407
  588    H    ARG  75           HN       ARG  75 121.588   2.308   7.623
  589    HA   ARG  75           HA       ARG  75 123.767   1.794   9.382
  590   1HB   ARG  75           HB2      ARG  75 120.940   0.717   9.348
  591   2HB   ARG  75           HB1      ARG  75 122.085   0.369  10.642
  592   1HG   ARG  75           HG2      ARG  75 122.376   2.870  10.926
  593   2HG   ARG  75           HG1      ARG  75 121.024   3.081   9.811
  594   1HD   ARG  75           HD2      ARG  75 120.981   1.622  12.466
  595   2HD   ARG  75           HD1      ARG  75 120.144   3.126  12.069
  596    HE   ARG  75           HE       ARG  75 119.150   1.349  10.212
  597   1HH1  ARG  75          HH21      ARG  75 119.551   1.377  13.636
  598   2HH1  ARG  75          HH22      ARG  75 118.157   0.395  13.940
  599   1HH2  ARG  75          HH11      ARG  75 117.331   0.063  10.589
  600   2HH2  ARG  75          HH12      ARG  75 116.902  -0.351  12.215
  601    H    ASP  76           HN       ASP  76 122.087  -0.367   7.085
  602    HA   ASP  76           HA       ASP  76 123.396  -2.745   7.991
  603   1HB   ASP  76           HB2      ASP  76 122.135  -2.018   5.337
  604   2HB   ASP  76           HB1      ASP  76 122.752  -3.628   5.707
  605    H    CYS  77           HN       CYS  77 124.282  -0.375   5.459
  606    HA   CYS  77           HA       CYS  77 126.514  -1.925   4.506
  607   1HB   CYS  77           HB2      CYS  77 125.842   1.021   4.332
  608   2HB   CYS  77           HB1      CYS  77 127.248   0.301   3.546
  609    HG   CYS  77           HG       CYS  77 125.246   0.243   1.844
  610    H    PHE  78           HN       PHE  78 126.208   0.656   6.982
  611    HA   PHE  78           HA       PHE  78 129.004   0.965   7.408
  612   1HB   PHE  78           HB2      PHE  78 127.355   2.517   8.366
  613   2HB   PHE  78           HB1      PHE  78 126.765   1.240   9.432
  614    HD1  PHE  78           HD1      PHE  78 129.561   3.526   8.707
  615    HD2  PHE  78           HD2      PHE  78 128.103   0.434  11.307
  616    HE1  PHE  78           HE1      PHE  78 131.355   4.051  10.337
  617    HE2  PHE  78           HE2      PHE  78 129.897   0.958  12.937
  618    HZ   PHE  78           HZ       PHE  78 131.524   2.765  12.452
  619    H    GLY  79           HN       GLY  79 126.725  -0.979   9.388
  620   1HA   GLY  79           HA2      GLY  79 128.740  -2.283  10.898
  621   2HA   GLY  79           HA1      GLY  79 127.109  -2.905  10.648
  622    H    CYS  80           HN       CYS  80 127.388  -3.007   7.724
  623    HA   CYS  80           HA       CYS  80 128.527  -5.661   7.526
  624   1HB   CYS  80           HB2      CYS  80 126.702  -4.844   6.040
  625   2HB   CYS  80           HB1      CYS  80 127.844  -3.728   5.292
  626    HG   CYS  80           HG       CYS  80 128.157  -5.718   3.782
  627    H    LEU  81           HN       LEU  81 129.625  -2.450   6.356
  628    HA   LEU  81           HA       LEU  81 132.123  -3.510   5.368
  629   1HB   LEU  81           HB2      LEU  81 131.267  -0.699   6.111
  630   2HB   LEU  81           HB1      LEU  81 132.799  -1.089   5.331
  631    HG   LEU  81           HG       LEU  81 130.078  -1.815   4.203
  632   1HD1  LEU  81          HD12      LEU  81 130.404   0.629   4.292
  633   2HD1  LEU  81          HD11      LEU  81 131.941   0.456   3.446
  634   3HD1  LEU  81          HD13      LEU  81 130.433   0.042   2.630
  635   1HD2  LEU  81          HD21      LEU  81 132.924  -2.193   3.291
  636   2HD2  LEU  81          HD23      LEU  81 131.546  -3.284   3.146
  637   3HD2  LEU  81          HD22      LEU  81 131.685  -1.897   2.072
  638    H    ARG  82           HN       ARG  82 131.109  -1.992   8.433
  639    HA   ARG  82           HA       ARG  82 133.730  -1.820   9.562
  640   1HB   ARG  82           HB2      ARG  82 131.808  -0.625  10.534
  641   2HB   ARG  82           HB1      ARG  82 131.083  -2.166  10.996
  642   1HG   ARG  82           HG2      ARG  82 132.901  -2.660  12.499
  643   2HG   ARG  82           HG1      ARG  82 133.834  -1.285  11.908
  644   1HD   ARG  82           HD2      ARG  82 132.129   0.259  12.785
  645   2HD   ARG  82           HD1      ARG  82 131.176  -1.108  13.360
  646    HE   ARG  82           HE       ARG  82 133.683  -1.449  14.533
  647   1HH1  ARG  82          HH21      ARG  82 131.257   0.995  14.372
  648   2HH1  ARG  82          HH22      ARG  82 131.652   1.676  15.914
  649   1HH2  ARG  82          HH11      ARG  82 134.217  -0.572  16.546
  650   2HH2  ARG  82          HH12      ARG  82 133.328   0.789  17.146
  651    H    GLU  83           HN       GLU  83 131.306  -4.437   9.652
  652    HA   GLU  83           HA       GLU  83 132.849  -6.092  11.427
  653   1HB   GLU  83           HB2      GLU  83 130.582  -6.683   9.510
  654   2HB   GLU  83           HB1      GLU  83 131.330  -7.930  10.511
  655   1HG   GLU  83           HG2      GLU  83 130.797  -6.634  12.538
  656   2HG   GLU  83           HG1      GLU  83 130.051  -5.382  11.551
  657    H    TRP  84           HN       TRP  84 132.676  -5.858   7.863
  658    HA   TRP  84           HA       TRP  84 134.281  -8.151   7.306
  659   1HB   TRP  84           HB2      TRP  84 132.985  -6.826   5.611
  660   2HB   TRP  84           HB1      TRP  84 134.198  -5.553   5.742
  661    HD1  TRP  84           HD1      TRP  84 133.622  -9.023   4.349
  662    HE1  TRP  84           HE1      TRP  84 135.615  -9.692   2.862
  663    HE3  TRP  84           HE3      TRP  84 136.824  -5.177   5.381
  664    HZ2  TRP  84           HZ2      TRP  84 138.225  -8.729   2.199
  665    HZ3  TRP  84           HZ3      TRP  84 139.057  -5.080   4.308
  666    HH2  TRP  84           HH2      TRP  84 139.764  -6.855   2.719
  667    H    CYS  85           HN       CYS  85 135.114  -4.748   7.888
  668    HA   CYS  85           HA       CYS  85 137.931  -4.996   7.520
  669   1HB   CYS  85           HB2      CYS  85 136.253  -3.103   9.176
  670   2HB   CYS  85           HB1      CYS  85 138.010  -2.973   9.099
  671    HG   CYS  85           HG       CYS  85 136.063  -2.371   6.770
  672    H    ASP  86           HN       ASP  86 135.881  -5.475  10.363
  673    HA   ASP  86           HA       ASP  86 137.934  -5.839  12.288
  674   1HB   ASP  86           HB2      ASP  86 135.157  -7.033  12.083
  675   2HB   ASP  86           HB1      ASP  86 136.197  -7.237  13.493
  676    H    ALA  87           HN       ALA  87 136.605  -8.035   9.868
  677    HA   ALA  87           HA       ALA  87 138.080 -10.335  10.979
  678   1HB   ALA  87           HB2      ALA  87 135.772 -10.414   9.813
  679   2HB   ALA  87           HB1      ALA  87 136.679 -10.273   8.306
  680   3HB   ALA  87           HB3      ALA  87 136.954 -11.648   9.376
  681    H    PHE  88           HN       PHE  88 138.332  -8.119   8.222
  682    HA   PHE  88           HA       PHE  88 140.853  -9.505   7.385
  683   1HB   PHE  88           HB2      PHE  88 139.024  -7.577   5.946
  684   2HB   PHE  88           HB1      PHE  88 140.566  -8.132   5.295
  685    HD1  PHE  88           HD2      PHE  88 140.931 -10.575   4.863
  686    HD2  PHE  88           HD1      PHE  88 137.086  -8.990   5.941
  687    HE1  PHE  88           HE2      PHE  88 139.848 -12.659   4.066
  688    HE2  PHE  88           HE1      PHE  88 136.002 -11.078   5.146
  689    HZ   PHE  88           HZ       PHE  88 137.385 -12.907   4.204
  690    H    LEU  89           HN       LEU  89 140.040  -6.125   6.745
  691    HA   LEU  89           HA       LEU  89 142.667  -5.323   7.749
  692   1HB   LEU  89           HB2      LEU  89 141.623  -4.328   5.684
  693   2HB   LEU  89           HB1      LEU  89 140.375  -3.621   6.706
  694    HG   LEU  89           HG       LEU  89 142.391  -2.562   8.012
  695   1HD1  LEU  89          HD12      LEU  89 144.102  -3.923   6.729
  696   2HD1  LEU  89          HD11      LEU  89 143.690  -2.966   5.309
  697   3HD1  LEU  89          HD13      LEU  89 144.381  -2.190   6.728
  698   1HD2  LEU  89          HD23      LEU  89 141.642  -1.644   5.219
  699   2HD2  LEU  89          HD22      LEU  89 140.767  -1.266   6.703
  700   3HD2  LEU  89          HD21      LEU  89 142.395  -0.634   6.455
  701   1H    MET   1           HT3      MET   1 166.620 -10.373  -0.922
  702   2H    MET   1           HT2      MET   1 165.306 -11.030  -1.776
  703   3H    MET   1           HT1      MET   1 166.796 -10.793  -2.556
  704    HA   MET   1           HA       MET   1 165.853  -8.918  -3.306
  705   1HB   MET   1           HB2      MET   1 164.070  -9.096  -0.860
  706   2HB   MET   1           HB1      MET   1 163.956  -7.818  -2.071
  707   1HG   MET   1           HG2      MET   1 163.778 -10.763  -2.751
  708   2HG   MET   1           HG1      MET   1 162.364  -9.760  -2.425
  709   1HE   MET   1           HE2      MET   1 162.702 -11.400  -4.876
  710   2HE   MET   1           HE1      MET   1 163.204 -10.616  -6.371
  711   3HE   MET   1           HE3      MET   1 164.417 -11.199  -5.223
  712    H    THR   2           HN       THR   2 166.419  -6.718  -3.003
  713    HA   THR   2           HA       THR   2 168.306  -6.251  -0.765
  714    HB   THR   2           HB       THR   2 167.706  -4.315  -3.008
  715    HG1  THR   2           HG1      THR   2 168.296  -5.869  -4.286
  716   1HG2  THR   2          HG23      THR   2 170.199  -4.984  -1.416
  717   2HG2  THR   2          HG22      THR   2 170.097  -3.762  -2.683
  718   3HG2  THR   2          HG21      THR   2 169.183  -3.561  -1.190
  719    H    THR   3           HN       THR   3 165.082  -5.961  -1.066
  720    HA   THR   3           HA       THR   3 164.600  -3.239  -0.239
  721    HB   THR   3           HB       THR   3 162.337  -4.060   0.329
  722    HG1  THR   3           HG1      THR   3 163.673  -6.331   0.640
  723   1HG2  THR   3          HG22      THR   3 163.570  -5.069  -2.241
  724   2HG2  THR   3          HG21      THR   3 161.833  -5.101  -1.934
  725   3HG2  THR   3          HG23      THR   3 162.691  -3.561  -1.986
  726    H    SER   4           HN       SER   4 163.797  -2.600   1.915
  727    HA   SER   4           HA       SER   4 165.520  -3.548   4.029
  728   1HB   SER   4           HB2      SER   4 163.054  -1.785   4.136
  729   2HB   SER   4           HB1      SER   4 164.166  -2.038   5.477
  730    HG   SER   4           HG       SER   4 164.703  -0.873   2.945
  731    H    GLN   5           HN       GLN   5 164.856  -4.606   5.973
  732    HA   GLN   5           HA       GLN   5 163.261  -6.908   5.628
  733   1HB   GLN   5           HB2      GLN   5 164.967  -6.634   7.411
  734   2HB   GLN   5           HB1      GLN   5 163.914  -5.476   8.223
  735   1HG   GLN   5           HG2      GLN   5 162.180  -7.210   8.466
  736   2HG   GLN   5           HG1      GLN   5 163.217  -8.370   7.639
  737   1HE2  GLN   5          HE22      GLN   5 164.667  -9.283  10.706
  738   2HE2  GLN   5          HE21      GLN   5 164.034  -9.768   9.207
  739    H    LYS   6           HN       LYS   6 162.311  -3.639   6.369
  740    HA   LYS   6           HA       LYS   6 159.847  -4.154   7.692
  741   1HB   LYS   6           HB2      LYS   6 160.705  -1.881   5.887
  742   2HB   LYS   6           HB1      LYS   6 159.175  -1.901   6.766
  743   1HG   LYS   6           HG2      LYS   6 160.393  -2.131   8.896
  744   2HG   LYS   6           HG1      LYS   6 161.925  -2.110   8.022
  745   1HD   LYS   6           HD2      LYS   6 161.408   0.145   7.163
  746   2HD   LYS   6           HD1      LYS   6 159.879   0.126   8.042
  747   1HE   LYS   6           HE2      LYS   6 160.991   0.082  10.163
  748   2HE   LYS   6           HE1      LYS   6 162.551  -0.246   9.409
  749   1HZ   LYS   6           HZ2      LYS   6 160.985   2.213   8.877
  750   2HZ   LYS   6           HZ1      LYS   6 162.167   2.114  10.094
  751   3HZ   LYS   6           HZ3      LYS   6 162.605   1.902   8.470
  752    H    HIS   7           HN       HIS   7 160.688  -4.064   4.241
  753    HA   HIS   7           HA       HIS   7 158.060  -4.107   3.191
  754   1HB   HIS   7           HB2      HIS   7 159.936  -3.787   1.706
  755   2HB   HIS   7           HB1      HIS   7 160.627  -5.343   2.157
  756    HD2  HIS   7           HD2      HIS   7 159.469  -7.583   0.870
  757    HE1  HIS   7           HE1      HIS   7 156.817  -5.404  -1.583
  758    HE2  HIS   7           HE2      HIS   7 157.806  -7.689  -1.134
  759    H    ARG   8           HN       ARG   8 160.151  -6.876   4.055
  760    HA   ARG   8           HA       ARG   8 158.165  -8.855   3.446
  761   1HB   ARG   8           HB2      ARG   8 160.679  -8.900   5.131
  762   2HB   ARG   8           HB1      ARG   8 159.693 -10.334   4.829
  763   1HG   ARG   8           HG2      ARG   8 159.999 -10.035   2.399
  764   2HG   ARG   8           HG1      ARG   8 160.987  -8.604   2.698
  765   1HD   ARG   8           HD2      ARG   8 161.614 -11.405   3.681
  766   2HD   ARG   8           HD1      ARG   8 162.397 -10.600   2.319
  767    HE   ARG   8           HE       ARG   8 162.784  -8.827   4.391
  768   1HH1  ARG   8          HH21      ARG   8 163.259 -12.211   3.939
  769   2HH1  ARG   8          HH22      ARG   8 164.652 -12.288   4.965
  770   1HH2  ARG   8          HH11      ARG   8 164.600  -8.904   5.730
  771   2HH2  ARG   8          HH12      ARG   8 165.414 -10.413   5.978
  772    H    ASP   9           HN       ASP   9 158.992  -7.035   6.342
  773    HA   ASP   9           HA       ASP   9 157.379  -8.656   8.126
  774   1HB   ASP   9           HB2      ASP   9 158.505  -5.869   8.387
  775   2HB   ASP   9           HB1      ASP   9 157.598  -6.665   9.667
  776    H    PHE  10           HN       PHE  10 156.792  -5.687   6.251
  777    HA   PHE  10           HA       PHE  10 154.231  -5.125   7.437
  778   1HB   PHE  10           HB2      PHE  10 155.568  -3.462   6.183
  779   2HB   PHE  10           HB1      PHE  10 155.316  -4.383   4.704
  780    HD1  PHE  10           HD1      PHE  10 153.736  -2.219   7.233
  781    HD2  PHE  10           HD2      PHE  10 153.131  -4.423   3.593
  782    HE1  PHE  10           HE1      PHE  10 151.601  -1.014   6.858
  783    HE2  PHE  10           HE2      PHE  10 150.993  -3.215   3.226
  784    HZ   PHE  10           HZ       PHE  10 150.229  -1.515   4.854
  785    H    VAL  11           HN       VAL  11 155.211  -7.000   4.572
  786    HA   VAL  11           HA       VAL  11 152.409  -7.597   3.896
  787    HB   VAL  11           HB       VAL  11 153.357  -8.902   2.067
  788   1HG1  VAL  11          HG13      VAL  11 154.741  -6.257   2.593
  789   2HG1  VAL  11          HG12      VAL  11 154.850  -7.112   1.055
  790   3HG1  VAL  11          HG11      VAL  11 153.287  -6.538   1.635
  791   1HG2  VAL  11          HG21      VAL  11 155.907  -8.521   3.640
  792   2HG2  VAL  11          HG23      VAL  11 155.188 -10.030   3.081
  793   3HG2  VAL  11          HG22      VAL  11 155.934  -8.928   1.924
  794    H    ALA  12           HN       ALA  12 153.968  -8.545   6.466
  795    HA   ALA  12           HA       ALA  12 153.244 -11.456   6.229
  796   1HB   ALA  12           HB3      ALA  12 155.387 -10.086   7.868
  797   2HB   ALA  12           HB2      ALA  12 154.922 -11.774   8.078
  798   3HB   ALA  12           HB1      ALA  12 155.622 -11.235   6.551
  799    H    GLU  13           HN       GLU  13 152.350  -8.537   7.703
  800    HA   GLU  13           HA       GLU  13 150.594 -10.010   9.535
  801   1HB   GLU  13           HB2      GLU  13 151.343  -8.436  11.464
  802   2HB   GLU  13           HB1      GLU  13 152.355  -9.829  11.086
  803   1HG   GLU  13           HG2      GLU  13 153.909  -8.487   9.860
  804   2HG   GLU  13           HG1      GLU  13 152.823  -7.097   9.875
  805    HA   PRO  14           HA       PRO  14 147.626  -6.848   8.568
  806   1HB   PRO  14           HB2      PRO  14 147.492  -6.372  11.539
  807   2HB   PRO  14           HB1      PRO  14 146.167  -6.561  10.371
  808   1HG   PRO  14           HG2      PRO  14 146.900  -8.559  11.994
  809   2HG   PRO  14           HG1      PRO  14 146.344  -8.856  10.337
  810   1HD   PRO  14           HD2      PRO  14 149.091  -9.095  11.452
  811   2HD   PRO  14           HD1      PRO  14 148.382  -9.864  10.013
  812    H    MET  15           HN       MET  15 147.444  -4.476   8.565
  813    HA   MET  15           HA       MET  15 150.036  -3.163   9.157
  814   1HB   MET  15           HB2      MET  15 148.946  -1.220   7.935
  815   2HB   MET  15           HB1      MET  15 149.178  -2.682   6.977
  816   1HG   MET  15           HG2      MET  15 146.878  -3.296   7.179
  817   2HG   MET  15           HG1      MET  15 146.595  -2.084   8.432
  818   1HE   MET  15           HE3      MET  15 147.852  -2.776   4.982
  819   2HE   MET  15           HE2      MET  15 146.119  -2.768   4.664
  820   3HE   MET  15           HE1      MET  15 147.148  -1.536   3.936
  821    H    GLY  16           HN       GLY  16 146.846  -3.396  10.442
  822   1HA   GLY  16           HA2      GLY  16 145.782  -2.285  12.222
  823   2HA   GLY  16           HA1      GLY  16 147.408  -2.187  12.897
  824    H    GLU  17           HN       GLU  17 147.443  -0.105  13.674
  825    HA   GLU  17           HA       GLU  17 146.632   2.122  11.843
  826   1HB   GLU  17           HB2      GLU  17 146.971   1.972  14.845
  827   2HB   GLU  17           HB1      GLU  17 146.689   3.480  13.975
  828   1HG   GLU  17           HG2      GLU  17 144.588   2.560  13.060
  829   2HG   GLU  17           HG1      GLU  17 144.868   1.054  13.935
  830    H    LYS  18           HN       LYS  18 149.282   0.704  11.729
  831    HA   LYS  18           HA       LYS  18 151.317   2.283  12.938
  832   1HB   LYS  18           HB2      LYS  18 151.284   0.673  10.370
  833   2HB   LYS  18           HB1      LYS  18 152.748   1.404  11.022
  834   1HG   LYS  18           HG2      LYS  18 152.449   0.148  13.122
  835   2HG   LYS  18           HG1      LYS  18 150.976  -0.578  12.478
  836   1HD   LYS  18           HD2      LYS  18 152.276  -1.590  10.641
  837   2HD   LYS  18           HD1      LYS  18 153.750  -0.871  11.289
  838   1HE   LYS  18           HE2      LYS  18 153.572  -2.168  13.320
  839   2HE   LYS  18           HE1      LYS  18 151.976  -2.759  12.858
  840   1HZ   LYS  18           HZ2      LYS  18 153.222  -3.605  10.777
  841   2HZ   LYS  18           HZ1      LYS  18 154.607  -3.464  11.749
  842   3HZ   LYS  18           HZ3      LYS  18 153.338  -4.482  12.227
  843    HA   PRO  19           HA       PRO  19 151.012   6.106  10.730
  844   1HB   PRO  19           HB2      PRO  19 153.670   6.874  10.557
  845   2HB   PRO  19           HB1      PRO  19 152.693   7.001  12.034
  846   1HG   PRO  19           HG2      PRO  19 154.647   4.883  11.241
  847   2HG   PRO  19           HG1      PRO  19 154.409   5.662  12.817
  848   1HD   PRO  19           HD2      PRO  19 153.426   3.198  12.303
  849   2HD   PRO  19           HD1      PRO  19 152.551   4.345  13.339
  850    H    VAL  20           HN       VAL  20 151.285   7.071   8.678
  851    HA   VAL  20           HA       VAL  20 151.388   5.386   6.443
  852    HB   VAL  20           HB       VAL  20 150.436   7.633   6.349
  853   1HG1  VAL  20          HG11      VAL  20 152.304   8.590   7.856
  854   2HG1  VAL  20          HG13      VAL  20 153.245   8.752   6.374
  855   3HG1  VAL  20          HG12      VAL  20 151.719   9.616   6.549
  856   1HG2  VAL  20          HG21      VAL  20 151.432   6.503   4.285
  857   2HG2  VAL  20          HG23      VAL  20 151.235   8.253   4.182
  858   3HG2  VAL  20          HG22      VAL  20 152.826   7.562   4.496
  859    H    GLY  21           HN       GLY  21 153.998   7.418   7.761
  860   1HA   GLY  21           HA2      GLY  21 155.973   6.863   5.834
  861   2HA   GLY  21           HA1      GLY  21 156.324   7.255   7.516
  862    H    SER  22           HN       SER  22 154.400   4.581   7.692
  863    HA   SER  22           HA       SER  22 156.707   2.845   8.207
  864   1HB   SER  22           HB2      SER  22 154.668   2.833   9.660
  865   2HB   SER  22           HB1      SER  22 153.740   2.211   8.298
  866    HG   SER  22           HG       SER  22 154.569   0.310   8.640
  867    H    LEU  23           HN       LEU  23 154.413   3.407   5.652
  868    HA   LEU  23           HA       LEU  23 154.566   0.865   4.352
  869   1HB   LEU  23           HB2      LEU  23 154.155   3.624   3.161
  870   2HB   LEU  23           HB1      LEU  23 153.841   2.106   2.324
  871    HG   LEU  23           HG       LEU  23 152.513   2.899   4.934
  872   1HD1  LEU  23          HD11      LEU  23 151.497   3.116   2.083
  873   2HD1  LEU  23          HD13      LEU  23 150.521   3.380   3.528
  874   3HD1  LEU  23          HD12      LEU  23 151.865   4.461   3.163
  875   1HD2  LEU  23          HD21      LEU  23 152.215   0.597   2.998
  876   2HD2  LEU  23          HD23      LEU  23 152.321   0.557   4.758
  877   3HD2  LEU  23          HD22      LEU  23 150.843   1.108   3.978
  878    H    ALA  24           HN       ALA  24 156.026   0.037   2.917
  879    HA   ALA  24           HA       ALA  24 158.725   0.991   2.991
  880   1HB   ALA  24           HB1      ALA  24 157.856  -1.379   2.450
  881   2HB   ALA  24           HB3      ALA  24 157.626  -0.781   0.808
  882   3HB   ALA  24           HB2      ALA  24 159.237  -0.794   1.523
  883    H    GLY  25           HN       GLY  25 159.830   2.343   1.659
  884   1HA   GLY  25           HA2      GLY  25 160.272   3.443  -0.466
  885   2HA   GLY  25           HA1      GLY  25 158.568   3.273  -0.884
  886    H    ILE  26           HN       ILE  26 157.976   4.208   2.023
  887    HA   ILE  26           HA       ILE  26 158.121   7.128   1.381
  888    HB   ILE  26           HB       ILE  26 156.550   5.744   3.579
  889   1HG1  ILE  26          HG12      ILE  26 155.705   4.918   1.464
  890   2HG1  ILE  26          HG11      ILE  26 154.580   6.138   2.054
  891   1HG2  ILE  26          HG22      ILE  26 156.351   8.505   2.340
  892   2HG2  ILE  26          HG21      ILE  26 155.288   7.870   3.596
  893   3HG2  ILE  26          HG23      ILE  26 156.997   8.139   3.939
  894   1HD1  ILE  26          HD13      ILE  26 156.003   7.796   0.612
  895   2HD1  ILE  26          HD12      ILE  26 156.565   6.336  -0.200
  896   3HD1  ILE  26          HD11      ILE  26 154.849   6.738  -0.198
  897    H    GLY  27           HN       GLY  27 159.773   8.256   2.384
  898   1HA   GLY  27           HA2      GLY  27 161.118   7.022   4.708
  899   2HA   GLY  27           HA1      GLY  27 161.675   8.433   3.808
  900    H    GLU  28           HN       GLU  28 161.786   8.738   6.445
  901    HA   GLU  28           HA       GLU  28 159.469   9.549   7.843
  902   1HB   GLU  28           HB2      GLU  28 162.339  10.487   8.064
  903   2HB   GLU  28           HB1      GLU  28 161.078  10.974   9.197
  904   1HG   GLU  28           HG2      GLU  28 160.642   8.610   9.738
  905   2HG   GLU  28           HG1      GLU  28 161.895   8.114   8.599
  906    H    VAL  29           HN       VAL  29 161.572  11.458   5.687
  907    HA   VAL  29           HA       VAL  29 160.255  13.961   6.203
  908    HB   VAL  29           HB       VAL  29 161.887  12.967   3.854
  909   1HG1  VAL  29          HG11      VAL  29 160.652  15.669   4.401
  910   2HG1  VAL  29          HG13      VAL  29 162.094  15.499   3.398
  911   3HG1  VAL  29          HG12      VAL  29 160.589  14.715   2.919
  912   1HG2  VAL  29          HG21      VAL  29 162.500  14.826   6.174
  913   2HG2  VAL  29          HG23      VAL  29 163.093  13.176   5.984
  914   3HG2  VAL  29          HG22      VAL  29 163.615  14.434   4.864
  915    H    LEU  30           HN       LEU  30 159.818  11.521   3.657
  916    HA   LEU  30           HA       LEU  30 157.734  12.918   2.270
  917   1HB   LEU  30           HB2      LEU  30 158.306   9.941   2.428
  918   2HB   LEU  30           HB1      LEU  30 157.254  10.707   1.240
  919    HG   LEU  30           HG       LEU  30 160.173  11.452   1.598
  920   1HD1  LEU  30          HD13      LEU  30 158.860   9.397  -0.189
  921   2HD1  LEU  30          HD12      LEU  30 160.421  10.117  -0.583
  922   3HD1  LEU  30          HD11      LEU  30 160.231   9.181   0.899
  923   1HD2  LEU  30          HD21      LEU  30 158.021  12.107  -0.426
  924   2HD2  LEU  30          HD23      LEU  30 159.087  13.211   0.442
  925   3HD2  LEU  30          HD22      LEU  30 159.727  12.212  -0.857
  926    H    GLY  31           HN       GLY  31 157.713  10.646   4.973
  927   1HA   GLY  31           HA2      GLY  31 154.908  10.168   5.069
  928   2HA   GLY  31           HA1      GLY  31 155.988  10.083   6.461
  929    H    LYS  32           HN       LYS  32 156.873  12.800   6.434
  930    HA   LYS  32           HA       LYS  32 154.787  14.034   7.948
  931   1HB   LYS  32           HB2      LYS  32 157.302  15.165   6.705
  932   2HB   LYS  32           HB1      LYS  32 156.230  16.097   7.750
  933   1HG   LYS  32           HG2      LYS  32 156.597  14.604   9.599
  934   2HG   LYS  32           HG1      LYS  32 157.444  13.448   8.571
  935   1HD   LYS  32           HD2      LYS  32 159.073  14.733   9.865
  936   2HD   LYS  32           HD1      LYS  32 159.212  15.154   8.159
  937   1HE   LYS  32           HE2      LYS  32 158.101  17.231   8.467
  938   2HE   LYS  32           HE1      LYS  32 157.483  16.756  10.050
  939   1HZ   LYS  32           HZ2      LYS  32 160.368  17.054   9.430
  940   2HZ   LYS  32           HZ1      LYS  32 159.420  18.297  10.095
  941   3HZ   LYS  32           HZ3      LYS  32 159.656  16.857  10.960
  942    H    LYS  33           HN       LYS  33 155.793  14.539   4.544
  943    HA   LYS  33           HA       LYS  33 154.075  16.798   4.119
  944   1HB   LYS  33           HB2      LYS  33 155.191  14.732   2.201
  945   2HB   LYS  33           HB1      LYS  33 154.312  16.172   1.683
  946   1HG   LYS  33           HG2      LYS  33 155.962  17.601   2.832
  947   2HG   LYS  33           HG1      LYS  33 156.845  16.165   3.350
  948   1HD   LYS  33           HD2      LYS  33 157.229  15.545   0.994
  949   2HD   LYS  33           HD1      LYS  33 156.349  16.982   0.471
  950   1HE   LYS  33           HE2      LYS  33 158.817  17.329   0.459
  951   2HE   LYS  33           HE1      LYS  33 157.990  18.426   1.566
  952   1HZ   LYS  33           HZ2      LYS  33 159.020  15.833   2.517
  953   2HZ   LYS  33           HZ1      LYS  33 160.056  17.174   2.388
  954   3HZ   LYS  33           HZ3      LYS  33 158.699  17.247   3.403
  955    H    LEU  34           HN       LEU  34 153.576  13.310   3.561
  956    HA   LEU  34           HA       LEU  34 150.930  13.545   2.506
  957   1HB   LEU  34           HB2      LEU  34 152.326  11.306   3.985
  958   2HB   LEU  34           HB1      LEU  34 150.719  11.137   3.295
  959    HG   LEU  34           HG       LEU  34 153.085  12.057   1.650
  960   1HD1  LEU  34          HD11      LEU  34 153.557   9.824   2.627
  961   2HD1  LEU  34          HD13      LEU  34 152.029   9.230   1.977
  962   3HD1  LEU  34          HD12      LEU  34 153.317   9.736   0.882
  963   1HD2  LEU  34          HD23      LEU  34 150.271  11.096   1.066
  964   2HD2  LEU  34          HD22      LEU  34 151.096  12.529   0.459
  965   3HD2  LEU  34          HD21      LEU  34 151.536  10.940  -0.151
  966    H    GLU  35           HN       GLU  35 152.154  13.252   5.803
  967    HA   GLU  35           HA       GLU  35 149.627  12.941   7.098
  968   1HB   GLU  35           HB2      GLU  35 151.782  12.646   8.283
  969   2HB   GLU  35           HB1      GLU  35 152.092  14.376   8.142
  970   1HG   GLU  35           HG2      GLU  35 150.069  14.860   9.465
  971   2HG   GLU  35           HG1      GLU  35 149.728  13.134   9.585
  972    H    GLU  36           HN       GLU  36 151.376  15.853   6.088
  973    HA   GLU  36           HA       GLU  36 149.504  17.712   7.241
  974   1HB   GLU  36           HB2      GLU  36 151.486  17.972   4.961
  975   2HB   GLU  36           HB1      GLU  36 150.541  19.325   5.586
  976   1HG   GLU  36           HG2      GLU  36 151.491  18.953   7.835
  977   2HG   GLU  36           HG1      GLU  36 152.440  17.605   7.208
  978    H    ARG  37           HN       ARG  37 149.443  15.695   4.455
  979    HA   ARG  37           HA       ARG  37 147.355  17.312   3.113
  980   1HB   ARG  37           HB2      ARG  37 148.727  14.723   2.372
  981   2HB   ARG  37           HB1      ARG  37 147.424  15.436   1.418
  982   1HG   ARG  37           HG2      ARG  37 148.737  17.521   1.213
  983   2HG   ARG  37           HG1      ARG  37 150.051  16.780   2.121
  984   1HD   ARG  37           HD2      ARG  37 150.070  14.946   0.364
  985   2HD   ARG  37           HD1      ARG  37 148.985  15.946  -0.593
  986    HE   ARG  37           HE       ARG  37 151.837  16.223  -0.393
  987   1HH1  ARG  37          HH21      ARG  37 148.969  18.156  -0.393
  988   2HH1  ARG  37          HH22      ARG  37 149.816  19.620  -0.754
  989   1HH2  ARG  37          HH11      ARG  37 152.928  18.114  -0.884
  990   2HH2  ARG  37          HH12      ARG  37 152.047  19.597  -1.037
  991    H    GLY  38           HN       GLY  38 147.263  15.245   5.684
  992   1HA   GLY  38           HA2      GLY  38 145.102  14.724   6.679
  993   2HA   GLY  38           HA1      GLY  38 144.417  14.541   5.071
  994    H    PHE  39           HN       PHE  39 147.417  12.982   5.146
  995    HA   PHE  39           HA       PHE  39 146.056  10.346   5.587
  996   1HB   PHE  39           HB2      PHE  39 148.666  11.025   4.215
  997   2HB   PHE  39           HB1      PHE  39 147.994   9.405   4.363
  998    HD1  PHE  39           HD2      PHE  39 146.002   8.751   3.101
  999    HD2  PHE  39           HD1      PHE  39 147.690  12.672   2.718
 1000    HE1  PHE  39           HE2      PHE  39 144.635   9.136   1.068
 1001    HE2  PHE  39           HE1      PHE  39 146.330  13.064   0.683
 1002    HZ   PHE  39           HZ       PHE  39 144.798  11.294  -0.144
 1003    H    ASP  40           HN       ASP  40 146.275  10.967   7.959
 1004    HA   ASP  40           HA       ASP  40 148.977  10.967   9.078
 1005   1HB   ASP  40           HB2      ASP  40 147.809  11.031  11.255
 1006   2HB   ASP  40           HB1      ASP  40 147.178  12.255  10.153
 1007    H    LYS  41           HN       LYS  41 146.773   8.562   8.090
 1008    HA   LYS  41           HA       LYS  41 148.325   6.488   9.605
 1009   1HB   LYS  41           HB2      LYS  41 145.359   6.450   8.970
 1010   2HB   LYS  41           HB1      LYS  41 146.259   5.153   9.749
 1011   1HG   LYS  41           HG2      LYS  41 146.084   7.964  10.873
 1012   2HG   LYS  41           HG1      LYS  41 144.985   6.666  11.338
 1013   1HD   LYS  41           HD2      LYS  41 147.135   5.316  11.888
 1014   2HD   LYS  41           HD1      LYS  41 147.959   6.873  11.830
 1015   1HE   LYS  41           HE2      LYS  41 147.284   6.365  14.129
 1016   2HE   LYS  41           HE1      LYS  41 146.389   7.759  13.525
 1017   1HZ   LYS  41           HZ3      LYS  41 144.959   5.470  12.833
 1018   2HZ   LYS  41           HZ2      LYS  41 145.386   5.313  14.470
 1019   3HZ   LYS  41           HZ1      LYS  41 144.521   6.677  13.941
 1020    H    ALA  42           HN       ALA  42 148.680   4.549   8.477
 1021    HA   ALA  42           HA       ALA  42 149.120   4.828   5.670
 1022   1HB   ALA  42           HB1      ALA  42 150.401   3.297   7.135
 1023   2HB   ALA  42           HB3      ALA  42 148.970   2.280   7.300
 1024   3HB   ALA  42           HB2      ALA  42 149.744   2.467   5.726
 1025    H    TYR  43           HN       TYR  43 146.496   3.175   7.445
 1026    HA   TYR  43           HA       TYR  43 145.359   1.880   5.207
 1027   1HB   TYR  43           HB2      TYR  43 143.285   1.709   6.470
 1028   2HB   TYR  43           HB1      TYR  43 144.665   1.385   7.513
 1029    HD1  TYR  43           HD1      TYR  43 142.258   4.044   6.492
 1030    HD2  TYR  43           HD2      TYR  43 145.024   2.666   9.473
 1031    HE1  TYR  43           HE1      TYR  43 141.475   5.814   8.036
 1032    HE2  TYR  43           HE2      TYR  43 144.242   4.441  11.019
 1033    HH   TYR  43           HH       TYR  43 142.868   6.153  11.306
 1034    H    VAL  44           HN       VAL  44 145.357   5.282   5.882
 1035    HA   VAL  44           HA       VAL  44 142.973   5.814   4.241
 1036    HB   VAL  44           HB       VAL  44 145.183   7.722   5.099
 1037   1HG1  VAL  44          HG13      VAL  44 143.698   8.428   3.162
 1038   2HG1  VAL  44          HG12      VAL  44 142.329   8.316   4.265
 1039   3HG1  VAL  44          HG11      VAL  44 143.615   9.480   4.574
 1040   1HG2  VAL  44          HG22      VAL  44 143.972   6.599   6.994
 1041   2HG2  VAL  44          HG21      VAL  44 143.719   8.342   6.937
 1042   3HG2  VAL  44          HG23      VAL  44 142.462   7.248   6.357
 1043    H    VAL  45           HN       VAL  45 146.399   5.555   3.886
 1044    HA   VAL  45           HA       VAL  45 146.502   6.552   1.126
 1045    HB   VAL  45           HB       VAL  45 148.528   4.946   2.725
 1046   1HG1  VAL  45          HG11      VAL  45 148.666   6.323   0.031
 1047   2HG1  VAL  45          HG13      VAL  45 150.100   5.856   0.944
 1048   3HG1  VAL  45          HG12      VAL  45 148.970   4.623   0.385
 1049   1HG2  VAL  45          HG22      VAL  45 148.177   7.903   2.171
 1050   2HG2  VAL  45          HG21      VAL  45 148.219   7.102   3.741
 1051   3HG2  VAL  45          HG23      VAL  45 149.685   7.214   2.769
 1052    H    LEU  46           HN       LEU  46 146.231   3.467   2.791
 1053    HA   LEU  46           HA       LEU  46 146.599   1.737   0.550
 1054   1HB   LEU  46           HB2      LEU  46 146.445   0.941   2.919
 1055   2HB   LEU  46           HB1      LEU  46 144.745   1.389   2.938
 1056    HG   LEU  46           HG       LEU  46 144.435  -0.186   0.945
 1057   1HD1  LEU  46          HD11      LEU  46 147.279  -0.828   1.702
 1058   2HD1  LEU  46          HD13      LEU  46 146.243  -2.041   0.952
 1059   3HD1  LEU  46          HD12      LEU  46 146.598  -0.540   0.102
 1060   1HD2  LEU  46          HD23      LEU  46 144.917  -0.919   3.785
 1061   2HD2  LEU  46          HD22      LEU  46 143.515  -1.210   2.763
 1062   3HD2  LEU  46          HD21      LEU  46 144.915  -2.270   2.649
 1063    H    GLY  47           HN       GLY  47 143.849   3.526   1.806
 1064   1HA   GLY  47           HA2      GLY  47 141.814   2.459   0.123
 1065   2HA   GLY  47           HA1      GLY  47 141.764   4.061   0.856
 1066    H    GLN  48           HN       GLN  48 144.086   5.166  -0.423
 1067    HA   GLN  48           HA       GLN  48 142.952   6.047  -2.891
 1068   1HB   GLN  48           HB2      GLN  48 144.741   7.241  -1.582
 1069   2HB   GLN  48           HB1      GLN  48 145.891   6.021  -2.128
 1070   1HG   GLN  48           HG2      GLN  48 146.063   7.942  -3.599
 1071   2HG   GLN  48           HG1      GLN  48 145.311   6.623  -4.497
 1072   1HE2  GLN  48          HE22      GLN  48 142.631   8.746  -5.323
 1073   2HE2  GLN  48          HE21      GLN  48 143.788   7.619  -5.845
 1074    H    PHE  49           HN       PHE  49 145.321   3.510  -2.156
 1075    HA   PHE  49           HA       PHE  49 145.990   2.772  -4.832
 1076   1HB   PHE  49           HB2      PHE  49 147.211   1.995  -2.817
 1077   2HB   PHE  49           HB1      PHE  49 145.807   1.055  -2.330
 1078    HD1  PHE  49           HD1      PHE  49 147.917   1.547  -5.401
 1079    HD2  PHE  49           HD2      PHE  49 145.877  -1.228  -2.830
 1080    HE1  PHE  49           HE1      PHE  49 148.755  -0.342  -6.771
 1081    HE2  PHE  49           HE2      PHE  49 146.710  -3.114  -4.204
 1082    HZ   PHE  49           HZ       PHE  49 148.151  -2.672  -6.175
 1083    H    LEU  50           HN       LEU  50 143.388   1.799  -2.674
 1084    HA   LEU  50           HA       LEU  50 142.248  -0.197  -4.440
 1085   1HB   LEU  50           HB2      LEU  50 140.868   1.459  -2.302
 1086   2HB   LEU  50           HB1      LEU  50 140.244  -0.024  -3.021
 1087    HG   LEU  50           HG       LEU  50 142.814   0.203  -1.432
 1088   1HD1  LEU  50          HD12      LEU  50 140.521   0.411  -0.229
 1089   2HD1  LEU  50          HD11      LEU  50 140.331  -1.299  -0.613
 1090   3HD1  LEU  50          HD13      LEU  50 141.678  -0.765   0.392
 1091   1HD2  LEU  50          HD23      LEU  50 141.478  -2.054  -2.915
 1092   2HD2  LEU  50          HD22      LEU  50 143.184  -1.608  -2.873
 1093   3HD2  LEU  50          HD21      LEU  50 142.449  -2.400  -1.484
 1094    H    VAL  51           HN       VAL  51 141.667   3.268  -3.985
 1095    HA   VAL  51           HA       VAL  51 139.415   3.487  -5.726
 1096    HB   VAL  51           HB       VAL  51 141.530   5.516  -4.953
 1097   1HG1  VAL  51          HG13      VAL  51 138.958   5.801  -6.521
 1098   2HG1  VAL  51          HG12      VAL  51 139.701   7.160  -5.677
 1099   3HG1  VAL  51          HG11      VAL  51 140.572   6.346  -6.976
 1100   1HG2  VAL  51          HG22      VAL  51 140.058   4.554  -3.152
 1101   2HG2  VAL  51          HG21      VAL  51 139.859   6.291  -3.377
 1102   3HG2  VAL  51          HG23      VAL  51 138.662   5.173  -4.032
 1103    H    LEU  52           HN       LEU  52 142.873   3.365  -6.397
 1104    HA   LEU  52           HA       LEU  52 142.464   4.196  -9.208
 1105   1HB   LEU  52           HB2      LEU  52 144.952   3.241  -7.762
 1106   2HB   LEU  52           HB1      LEU  52 144.907   3.937  -9.381
 1107    HG   LEU  52           HG       LEU  52 144.040   5.345  -6.837
 1108   1HD1  LEU  52          HD13      LEU  52 146.509   4.947  -7.117
 1109   2HD1  LEU  52          HD12      LEU  52 146.428   5.867  -8.620
 1110   3HD1  LEU  52          HD11      LEU  52 146.058   6.653  -7.086
 1111   1HD2  LEU  52          HD23      LEU  52 143.973   6.091  -9.760
 1112   2HD2  LEU  52          HD22      LEU  52 142.757   6.370  -8.512
 1113   3HD2  LEU  52          HD21      LEU  52 144.216   7.352  -8.549
 1114    H    LYS  53           HN       LYS  53 141.533   1.490  -7.875
 1115    HA   LYS  53           HA       LYS  53 141.443  -0.761  -8.537
 1116   1HB   LYS  53           HB2      LYS  53 141.832   0.586 -11.228
 1117   2HB   LYS  53           HB1      LYS  53 141.225  -1.053 -10.987
 1118   1HG   LYS  53           HG2      LYS  53 139.330  -0.162  -9.682
 1119   2HG   LYS  53           HG1      LYS  53 139.932   1.476  -9.918
 1120   1HD   LYS  53           HD2      LYS  53 139.675   1.212 -12.359
 1121   2HD   LYS  53           HD1      LYS  53 139.068  -0.425 -12.114
 1122   1HE   LYS  53           HE2      LYS  53 137.783   2.038 -10.908
 1123   2HE   LYS  53           HE1      LYS  53 137.257   1.300 -12.420
 1124   1HZ   LYS  53           HZ1      LYS  53 137.417  -0.134  -9.826
 1125   2HZ   LYS  53           HZ3      LYS  53 135.995   0.539 -10.459
 1126   3HZ   LYS  53           HZ2      LYS  53 136.772  -0.729 -11.281
 1127    H    LYS  54           HN       LYS  54 144.071   0.186  -7.765
 1128    HA   LYS  54           HA       LYS  54 146.273  -0.575  -7.722
 1129   1HB   LYS  54           HB2      LYS  54 145.241  -2.864  -9.413
 1130   2HB   LYS  54           HB1      LYS  54 146.682  -2.851  -8.401
 1131   1HG   LYS  54           HG2      LYS  54 145.287  -2.521  -6.399
 1132   2HG   LYS  54           HG1      LYS  54 143.840  -2.530  -7.405
 1133   1HD   LYS  54           HD2      LYS  54 144.413  -4.824  -8.170
 1134   2HD   LYS  54           HD1      LYS  54 145.802  -4.816  -7.082
 1135   1HE   LYS  54           HE2      LYS  54 144.383  -4.635  -5.145
 1136   2HE   LYS  54           HE1      LYS  54 142.959  -4.356  -6.148
 1137   1HZ   LYS  54           HZ1      LYS  54 143.834  -6.666  -7.140
 1138   2HZ   LYS  54           HZ3      LYS  54 144.329  -6.834  -5.526
 1139   3HZ   LYS  54           HZ2      LYS  54 142.693  -6.554  -5.887
 1140    H    ASP  55           HN       ASP  55 145.190   1.007 -10.208
 1141    HA   ASP  55           HA       ASP  55 146.826   0.090 -12.413
 1142   1HB   ASP  55           HB2      ASP  55 145.612   2.779 -11.747
 1143   2HB   ASP  55           HB1      ASP  55 146.510   2.482 -13.236
 1144    H    GLU  56           HN       GLU  56 149.012   0.065 -12.384
 1145    HA   GLU  56           HA       GLU  56 150.597   1.236 -10.335
 1146   1HB   GLU  56           HB2      GLU  56 151.218  -0.748 -11.702
 1147   2HB   GLU  56           HB1      GLU  56 151.494   0.323 -13.075
 1148   1HG   GLU  56           HG2      GLU  56 153.213   1.541 -11.785
 1149   2HG   GLU  56           HG1      GLU  56 152.938   0.469 -10.410
 1150    H    ASP  57           HN       ASP  57 149.979   2.409 -13.661
 1151    HA   ASP  57           HA       ASP  57 151.920   4.549 -13.492
 1152   1HB   ASP  57           HB2      ASP  57 149.491   4.137 -15.257
 1153   2HB   ASP  57           HB1      ASP  57 150.601   5.493 -15.445
 1154    H    LEU  58           HN       LEU  58 148.454   4.363 -12.886
 1155    HA   LEU  58           HA       LEU  58 148.202   7.206 -12.343
 1156   1HB   LEU  58           HB2      LEU  58 146.409   4.927 -11.454
 1157   2HB   LEU  58           HB1      LEU  58 145.996   6.636 -11.390
 1158    HG   LEU  58           HG       LEU  58 146.653   5.099 -13.925
 1159   1HD1  LEU  58          HD11      LEU  58 144.466   4.513 -12.800
 1160   2HD1  LEU  58          HD13      LEU  58 143.986   6.198 -12.992
 1161   3HD1  LEU  58          HD12      LEU  58 144.290   5.200 -14.413
 1162   1HD2  LEU  58          HD23      LEU  58 146.002   7.984 -13.322
 1163   2HD2  LEU  58          HD22      LEU  58 147.214   7.325 -14.420
 1164   3HD2  LEU  58          HD21      LEU  58 145.513   7.290 -14.868
 1165    H    PHE  59           HN       PHE  59 148.742   4.343 -10.340
 1166    HA   PHE  59           HA       PHE  59 148.602   5.721  -7.830
 1167   1HB   PHE  59           HB2      PHE  59 148.460   3.287  -7.936
 1168   2HB   PHE  59           HB1      PHE  59 150.099   3.198  -8.583
 1169    HD1  PHE  59           HD1      PHE  59 148.059   3.927  -5.593
 1170    HD2  PHE  59           HD2      PHE  59 152.038   3.612  -7.179
 1171    HE1  PHE  59           HE1      PHE  59 148.980   3.950  -3.289
 1172    HE2  PHE  59           HE2      PHE  59 152.959   3.637  -4.877
 1173    HZ   PHE  59           HZ       PHE  59 151.430   3.807  -2.932
 1174    H    ARG  60           HN       ARG  60 151.428   4.854  -9.876
 1175    HA   ARG  60           HA       ARG  60 153.359   6.031  -8.148
 1176   1HB   ARG  60           HB2      ARG  60 153.400   5.599 -11.140
 1177   2HB   ARG  60           HB1      ARG  60 154.787   6.192 -10.228
 1178   1HG   ARG  60           HG2      ARG  60 154.725   4.158  -8.819
 1179   2HG   ARG  60           HG1      ARG  60 153.356   3.560  -9.753
 1180   1HD   ARG  60           HD2      ARG  60 156.102   4.198 -10.869
 1181   2HD   ARG  60           HD1      ARG  60 155.469   2.578 -10.568
 1182    HE   ARG  60           HE       ARG  60 153.575   3.690 -12.230
 1183   1HH1  ARG  60          HH21      ARG  60 157.010   3.367 -12.276
 1184   2HH1  ARG  60          HH22      ARG  60 157.106   3.264 -14.003
 1185   1HH2  ARG  60          HH11      ARG  60 153.686   3.560 -14.475
 1186   2HH2  ARG  60          HH12      ARG  60 155.225   3.372 -15.247
 1187    H    GLU  61           HN       GLU  61 151.560   7.510 -10.892
 1188    HA   GLU  61           HA       GLU  61 152.950  10.019 -10.698
 1189   1HB   GLU  61           HB2      GLU  61 150.202   9.327 -11.768
 1190   2HB   GLU  61           HB1      GLU  61 150.910  10.938 -11.885
 1191   1HG   GLU  61           HG2      GLU  61 152.842   9.994 -13.108
 1192   2HG   GLU  61           HG1      GLU  61 152.112   8.391 -13.010
 1193    H    TRP  62           HN       TRP  62 150.139   8.666  -9.040
 1194    HA   TRP  62           HA       TRP  62 149.241  11.077  -7.827
 1195   1HB   TRP  62           HB2      TRP  62 147.829   9.131  -7.705
 1196   2HB   TRP  62           HB1      TRP  62 149.090   8.196  -6.899
 1197    HD1  TRP  62           HD1      TRP  62 146.666  11.116  -6.270
 1198    HE1  TRP  62           HE1      TRP  62 146.425  11.443  -3.720
 1199    HE3  TRP  62           HE3      TRP  62 150.163   7.775  -4.610
 1200    HZ2  TRP  62           HZ2      TRP  62 147.557  10.416  -1.301
 1201    HZ3  TRP  62           HZ3      TRP  62 150.550   7.468  -2.183
 1202    HH2  TRP  62           HH2      TRP  62 149.256   8.784  -0.530
 1203    H    LEU  63           HN       LEU  63 151.546   8.628  -6.626
 1204    HA   LEU  63           HA       LEU  63 152.068  10.024  -4.171
 1205   1HB   LEU  63           HB2      LEU  63 152.506   7.619  -4.448
 1206   2HB   LEU  63           HB1      LEU  63 153.738   7.975  -5.655
 1207    HG   LEU  63           HG       LEU  63 155.032   9.223  -3.942
 1208   1HD1  LEU  63          HD11      LEU  63 152.662   8.470  -2.244
 1209   2HD1  LEU  63          HD13      LEU  63 154.247   8.672  -1.498
 1210   3HD1  LEU  63          HD12      LEU  63 153.501  10.017  -2.355
 1211   1HD2  LEU  63          HD21      LEU  63 155.452   6.818  -4.350
 1212   2HD2  LEU  63          HD23      LEU  63 155.757   7.249  -2.667
 1213   3HD2  LEU  63          HD22      LEU  63 154.269   6.410  -3.107
 1214    H    LYS  64           HN       LYS  64 153.925   9.800  -7.200
 1215    HA   LYS  64           HA       LYS  64 156.036  11.541  -6.392
 1216   1HB   LYS  64           HB2      LYS  64 156.203  10.114  -8.395
 1217   2HB   LYS  64           HB1      LYS  64 154.957  11.078  -9.188
 1218   1HG   LYS  64           HG2      LYS  64 156.395  13.075  -9.056
 1219   2HG   LYS  64           HG1      LYS  64 157.633  12.138  -8.222
 1220   1HD   LYS  64           HD2      LYS  64 157.837  10.661 -10.184
 1221   2HD   LYS  64           HD1      LYS  64 156.598  11.598 -11.018
 1222   1HE   LYS  64           HE2      LYS  64 158.729  12.411 -11.788
 1223   2HE   LYS  64           HE1      LYS  64 158.069  13.637 -10.706
 1224   1HZ   LYS  64           HZ3      LYS  64 159.566  11.704  -9.263
 1225   2HZ   LYS  64           HZ2      LYS  64 160.512  12.388 -10.498
 1226   3HZ   LYS  64           HZ1      LYS  64 159.776  13.386  -9.337
 1227    H    ASP  65           HN       ASP  65 153.055  12.269  -8.203
 1228    HA   ASP  65           HA       ASP  65 153.573  15.102  -8.343
 1229   1HB   ASP  65           HB2      ASP  65 150.962  13.568  -8.541
 1230   2HB   ASP  65           HB1      ASP  65 151.169  15.267  -8.959
 1231    H    THR  66           HN       THR  66 152.145  13.012  -5.927
 1232    HA   THR  66           HA       THR  66 150.864  15.185  -4.472
 1233    HB   THR  66           HB       THR  66 151.410  12.292  -3.762
 1234    HG1  THR  66           HG1      THR  66 149.614  12.036  -4.785
 1235   1HG2  THR  66          HG21      THR  66 149.974  14.462  -2.218
 1236   2HG2  THR  66          HG23      THR  66 149.732  12.743  -1.913
 1237   3HG2  THR  66          HG22      THR  66 151.320  13.465  -1.669
 1238    H    CYS  67           HN       CYS  67 154.004  13.484  -4.201
 1239    HA   CYS  67           HA       CYS  67 154.708  15.448  -2.031
 1240   1HB   CYS  67           HB2      CYS  67 155.993  13.639  -0.945
 1241   2HB   CYS  67           HB1      CYS  67 154.270  13.274  -1.023
 1242    HG   CYS  67           HG       CYS  67 155.054  11.173  -2.104
 1243    H    GLY  68           HN       GLY  68 155.802  13.663  -4.854
 1244   1HA   GLY  68           HA2      GLY  68 157.572  14.625  -6.250
 1245   2HA   GLY  68           HA1      GLY  68 158.332  15.270  -4.795
 1246    H    ALA  69           HN       ALA  69 157.082  12.102  -4.419
 1247    HA   ALA  69           HA       ALA  69 159.508  10.899  -3.696
 1248   1HB   ALA  69           HB3      ALA  69 157.291   9.880  -3.283
 1249   2HB   ALA  69           HB2      ALA  69 157.111   9.578  -5.012
 1250   3HB   ALA  69           HB1      ALA  69 158.367   8.743  -4.097
 1251    H    ASN  70           HN       ASN  70 160.981   9.480  -4.887
 1252    HA   ASN  70           HA       ASN  70 161.295  10.316  -7.693
 1253   1HB   ASN  70           HB2      ASN  70 162.962   8.553  -5.874
 1254   2HB   ASN  70           HB1      ASN  70 163.409   8.979  -7.527
 1255   1HD2  ASN  70          HD22      ASN  70 163.714  12.546  -6.577
 1256   2HD2  ASN  70          HD21      ASN  70 162.884  11.647  -7.753
 1257    H    ALA  71           HN       ALA  71 161.890   8.544  -9.296
 1258    HA   ALA  71           HA       ALA  71 159.708   6.765  -9.659
 1259   1HB   ALA  71           HB1      ALA  71 161.265   7.585 -11.458
 1260   2HB   ALA  71           HB3      ALA  71 162.478   6.461 -10.844
 1261   3HB   ALA  71           HB2      ALA  71 160.964   5.848 -11.509
 1262    H    LYS  72           HN       LYS  72 162.822   6.275  -8.060
 1263    HA   LYS  72           HA       LYS  72 162.569   3.388  -7.945
 1264   1HB   LYS  72           HB2      LYS  72 164.186   5.248  -6.171
 1265   2HB   LYS  72           HB1      LYS  72 164.413   3.507  -6.323
 1266   1HG   LYS  72           HG2      LYS  72 164.646   5.425  -8.656
 1267   2HG   LYS  72           HG1      LYS  72 166.023   4.912  -7.685
 1268   1HD   LYS  72           HD2      LYS  72 165.296   2.500  -8.238
 1269   2HD   LYS  72           HD1      LYS  72 164.265   3.222  -9.474
 1270   1HE   LYS  72           HE2      LYS  72 166.364   2.646 -10.520
 1271   2HE   LYS  72           HE1      LYS  72 166.291   4.402 -10.381
 1272   1HZ   LYS  72           HZ1      LYS  72 167.520   2.811  -8.234
 1273   2HZ   LYS  72           HZ3      LYS  72 168.408   3.157  -9.636
 1274   3HZ   LYS  72           HZ2      LYS  72 167.811   4.425  -8.677
 1275    H    GLN  73           HN       GLN  73 161.755   6.051  -5.769
 1276    HA   GLN  73           HA       GLN  73 160.975   4.433  -3.542
 1277   1HB   GLN  73           HB2      GLN  73 160.232   7.244  -4.381
 1278   2HB   GLN  73           HB1      GLN  73 159.718   6.521  -2.856
 1279   1HG   GLN  73           HG2      GLN  73 162.074   6.140  -2.235
 1280   2HG   GLN  73           HG1      GLN  73 162.594   6.864  -3.757
 1281   1HE2  GLN  73          HE22      GLN  73 160.748   9.972  -2.355
 1282   2HE2  GLN  73          HE21      GLN  73 160.170   8.800  -3.438
 1283    H    SER  74           HN       SER  74 159.181   5.681  -6.350
 1284    HA   SER  74           HA       SER  74 156.599   4.948  -5.384
 1285   1HB   SER  74           HB2      SER  74 155.856   5.656  -7.457
 1286   2HB   SER  74           HB1      SER  74 157.455   6.390  -7.482
 1287    HG   SER  74           HG       SER  74 157.876   5.159  -9.117
 1288    H    ARG  75           HN       ARG  75 159.051   3.162  -7.272
 1289    HA   ARG  75           HA       ARG  75 157.413   0.921  -7.901
 1290   1HB   ARG  75           HB2      ARG  75 160.401   1.144  -7.478
 1291   2HB   ARG  75           HB1      ARG  75 159.615  -0.338  -8.020
 1292   1HG   ARG  75           HG2      ARG  75 158.605   1.004  -9.915
 1293   2HG   ARG  75           HG1      ARG  75 159.647   2.343  -9.431
 1294   1HD   ARG  75           HD2      ARG  75 160.524  -0.415 -10.331
 1295   2HD   ARG  75           HD1      ARG  75 160.788   1.112 -11.178
 1296    HE   ARG  75           HE       ARG  75 162.008   1.533  -8.746
 1297   1HH1  ARG  75          HH21      ARG  75 162.112  -0.928 -11.159
 1298   2HH1  ARG  75          HH22      ARG  75 163.771  -1.330 -10.865
 1299   1HH2  ARG  75          HH11      ARG  75 164.172   1.022  -8.350
 1300   2HH2  ARG  75          HH12      ARG  75 164.938  -0.224  -9.277
 1301    H    ASP  76           HN       ASP  76 159.345   1.622  -4.977
 1302    HA   ASP  76           HA       ASP  76 158.982  -0.968  -3.820
 1303   1HB   ASP  76           HB2      ASP  76 159.562   1.731  -2.582
 1304   2HB   ASP  76           HB1      ASP  76 159.537   0.228  -1.660
 1305    H    CYS  77           HN       CYS  77 157.049   2.034  -3.545
 1306    HA   CYS  77           HA       CYS  77 155.299   0.961  -1.525
 1307   1HB   CYS  77           HB2      CYS  77 154.988   3.222  -3.515
 1308   2HB   CYS  77           HB1      CYS  77 153.780   2.842  -2.288
 1309    HG   CYS  77           HG       CYS  77 155.438   4.615  -1.278
 1310    H    PHE  78           HN       PHE  78 155.134   1.049  -5.111
 1311    HA   PHE  78           HA       PHE  78 152.472   0.062  -5.288
 1312   1HB   PHE  78           HB2      PHE  78 153.676   0.946  -7.241
 1313   2HB   PHE  78           HB1      PHE  78 154.779  -0.432  -7.191
 1314    HD1  PHE  78           HD1      PHE  78 151.336   0.665  -7.915
 1315    HD2  PHE  78           HD2      PHE  78 154.036  -2.674  -7.810
 1316    HE1  PHE  78           HE1      PHE  78 149.717  -0.685  -9.221
 1317    HE2  PHE  78           HE2      PHE  78 152.418  -4.024  -9.117
 1318    HZ   PHE  78           HZ       PHE  78 150.257  -3.030  -9.821
 1319    H    GLY  79           HN       GLY  79 155.497  -1.838  -5.641
 1320   1HA   GLY  79           HA2      GLY  79 154.225  -4.370  -5.567
 1321   2HA   GLY  79           HA1      GLY  79 155.916  -4.084  -5.158
 1322    H    CYS  80           HN       CYS  80 155.272  -2.230  -2.968
 1323    HA   CYS  80           HA       CYS  80 155.000  -4.192  -0.856
 1324   1HB   CYS  80           HB2      CYS  80 156.247  -2.054  -0.579
 1325   2HB   CYS  80           HB1      CYS  80 154.719  -1.179  -0.679
 1326    HG   CYS  80           HG       CYS  80 154.833  -1.544   1.811
 1327    H    LEU  81           HN       LEU  81 152.800  -1.642  -2.107
 1328    HA   LEU  81           HA       LEU  81 150.645  -2.457  -0.366
 1329   1HB   LEU  81           HB2      LEU  81 150.683  -0.857  -2.940
 1330   2HB   LEU  81           HB1      LEU  81 149.253  -1.065  -1.930
 1331    HG   LEU  81           HG       LEU  81 151.876   0.104  -0.951
 1332   1HD1  LEU  81          HD12      LEU  81 150.821   1.534  -2.663
 1333   2HD1  LEU  81          HD11      LEU  81 149.310   1.506  -1.755
 1334   3HD1  LEU  81          HD13      LEU  81 150.737   2.282  -1.068
 1335   1HD2  LEU  81          HD21      LEU  81 149.189  -0.426   0.302
 1336   2HD2  LEU  81          HD23      LEU  81 150.802  -0.597   0.994
 1337   3HD2  LEU  81          HD22      LEU  81 150.088   1.000   0.817
 1338    H    ARG  82           HN       ARG  82 151.556  -3.244  -3.727
 1339    HA   ARG  82           HA       ARG  82 149.200  -4.745  -4.327
 1340   1HB   ARG  82           HB2      ARG  82 150.767  -4.015  -6.079
 1341   2HB   ARG  82           HB1      ARG  82 151.997  -5.105  -5.435
 1342   1HG   ARG  82           HG2      ARG  82 150.656  -7.043  -5.944
 1343   2HG   ARG  82           HG1      ARG  82 149.268  -6.039  -6.362
 1344   1HD   ARG  82           HD2      ARG  82 150.519  -5.088  -8.258
 1345   2HD   ARG  82           HD1      ARG  82 151.918  -6.075  -7.838
 1346    HE   ARG  82           HE       ARG  82 149.830  -7.900  -8.137
 1347   1HH1  ARG  82          HH21      ARG  82 151.328  -5.418 -10.000
 1348   2HH1  ARG  82          HH22      ARG  82 150.969  -6.159 -11.524
 1349   1HH2  ARG  82          HH11      ARG  82 149.345  -8.883 -10.115
 1350   2HH2  ARG  82          HH12      ARG  82 149.843  -8.122 -11.590
 1351    H    GLU  83           HN       GLU  83 152.309  -5.745  -2.881
 1352    HA   GLU  83           HA       GLU  83 151.622  -8.537  -2.816
 1353   1HB   GLU  83           HB2      GLU  83 153.663  -6.882  -1.313
 1354   2HB   GLU  83           HB1      GLU  83 153.491  -8.622  -1.077
 1355   1HG   GLU  83           HG2      GLU  83 153.877  -8.996  -3.481
 1356   2HG   GLU  83           HG1      GLU  83 154.045  -7.262  -3.732
 1357    H    TRP  84           HN       TRP  84 151.209  -5.883  -0.455
 1358    HA   TRP  84           HA       TRP  84 150.335  -7.509   1.721
 1359   1HB   TRP  84           HB2      TRP  84 150.902  -5.064   1.853
 1360   2HB   TRP  84           HB1      TRP  84 149.384  -4.713   1.027
 1361    HD1  TRP  84           HD1      TRP  84 150.807  -5.840   4.348
 1362    HE1  TRP  84           HE1      TRP  84 148.933  -5.889   6.111
 1363    HE3  TRP  84           HE3      TRP  84 146.752  -5.054   1.341
 1364    HZ2  TRP  84           HZ2      TRP  84 146.083  -5.632   6.232
 1365    HZ3  TRP  84           HZ3      TRP  84 144.471  -4.964   2.307
 1366    HH2  TRP  84           HH2      TRP  84 144.132  -5.252   4.748
 1367    H    CYS  85           HN       CYS  85 148.571  -5.948  -0.943
 1368    HA   CYS  85           HA       CYS  85 145.951  -6.758  -0.169
 1369   1HB   CYS  85           HB2      CYS  85 147.180  -6.130  -2.860
 1370   2HB   CYS  85           HB1      CYS  85 145.477  -6.555  -2.687
 1371    HG   CYS  85           HG       CYS  85 146.786  -3.938  -1.676
 1372    H    ASP  86           HN       ASP  86 148.428  -8.369  -2.117
 1373    HA   ASP  86           HA       ASP  86 146.885 -10.584  -2.990
 1374   1HB   ASP  86           HB2      ASP  86 149.837 -10.338  -2.353
 1375   2HB   ASP  86           HB1      ASP  86 149.122 -11.770  -3.094
 1376    H    ALA  87           HN       ALA  87 148.480  -9.936   0.090
 1377    HA   ALA  87           HA       ALA  87 147.962 -12.670   1.065
 1378   1HB   ALA  87           HB2      ALA  87 149.992 -11.186   1.669
 1379   2HB   ALA  87           HB1      ALA  87 148.884 -10.347   2.756
 1380   3HB   ALA  87           HB3      ALA  87 149.204 -12.067   2.977
 1381    H    PHE  88           HN       PHE  88 146.644  -9.410   1.529
 1382    HA   PHE  88           HA       PHE  88 144.591 -10.546   3.393
 1383   1HB   PHE  88           HB2      PHE  88 145.506  -7.714   2.865
 1384   2HB   PHE  88           HB1      PHE  88 144.136  -8.123   3.900
 1385    HD1  PHE  88           HD2      PHE  88 144.492  -9.539   5.937
 1386    HD2  PHE  88           HD1      PHE  88 147.766  -8.015   3.608
 1387    HE1  PHE  88           HE2      PHE  88 146.044 -10.006   7.814
 1388    HE2  PHE  88           HE1      PHE  88 149.321  -8.487   5.486
 1389    HZ   PHE  88           HZ       PHE  88 148.456  -9.475   7.588
 1390    H    LEU  89           HN       LEU  89 144.214  -7.639   1.415
 1391    HA   LEU  89           HA       LEU  89 141.630  -8.642   0.473
 1392   1HB   LEU  89           HB2      LEU  89 141.999  -6.244   1.131
 1393   2HB   LEU  89           HB1      LEU  89 143.103  -6.079  -0.232
 1394    HG   LEU  89           HG       LEU  89 141.065  -6.937  -1.660
 1395   1HD1  LEU  89          HD12      LEU  89 139.692  -7.471   0.407
 1396   2HD1  LEU  89          HD11      LEU  89 139.585  -5.736   0.691
 1397   3HD1  LEU  89          HD13      LEU  89 138.888  -6.436  -0.767
 1398   1HD2  LEU  89          HD23      LEU  89 141.092  -4.173  -0.405
 1399   2HD2  LEU  89          HD22      LEU  89 142.009  -4.673  -1.827
 1400   3HD2  LEU  89          HD21      LEU  89 140.248  -4.608  -1.893
   
  No H/Q in entry =        1400
  Start of MODEL    2
    1   1H    MET   1           HT1      MET   1 115.201  -6.981  10.605
    2   2H    MET   1           HT3      MET   1 114.005  -8.182  10.659
    3   3H    MET   1           HT2      MET   1 113.740  -6.687  11.421
    4    HA   MET   1           HA       MET   1 115.354  -7.125  13.076
    5   1HB   MET   1           HB2      MET   1 113.106  -8.211  13.326
    6   2HB   MET   1           HB1      MET   1 113.777  -9.670  12.594
    7   1HG   MET   1           HG2      MET   1 115.462  -9.802  14.392
    8   2HG   MET   1           HG1      MET   1 114.794  -8.344  15.126
    9   1HE   MET   1           HE2      MET   1 114.886  -9.868  17.197
   10   2HE   MET   1           HE1      MET   1 113.777 -11.191  17.554
   11   3HE   MET   1           HE3      MET   1 115.123 -11.438  16.433
   12    H    THR   2           HN       THR   2 115.117 -10.260  11.375
   13    HA   THR   2           HA       THR   2 117.933 -10.807  11.969
   14    HB   THR   2           HB       THR   2 116.005 -12.378  10.232
   15    HG1  THR   2           HG1      THR   2 115.500 -13.470  12.078
   16   1HG2  THR   2          HG21      THR   2 118.593 -13.103  11.632
   17   2HG2  THR   2          HG23      THR   2 117.537 -14.257  10.818
   18   3HG2  THR   2          HG22      THR   2 118.341 -12.991   9.890
   19    H    THR   3           HN       THR   3 119.630 -10.563  10.567
   20    HA   THR   3           HA       THR   3 119.205  -9.026   8.136
   21    HB   THR   3           HB       THR   3 121.681  -9.279   7.873
   22    HG1  THR   3           HG1      THR   3 121.476 -11.412   9.079
   23   1HG2  THR   3          HG23      THR   3 120.665  -7.480   9.264
   24   2HG2  THR   3          HG22      THR   3 120.802  -8.531  10.674
   25   3HG2  THR   3          HG21      THR   3 122.255  -7.971   9.846
   26    H    SER   4           HN       SER   4 119.973  -9.745   5.998
   27    HA   SER   4           HA       SER   4 118.932 -12.349   5.307
   28   1HB   SER   4           HB2      SER   4 119.579 -11.796   3.047
   29   2HB   SER   4           HB1      SER   4 118.967 -10.322   3.791
   30    HG   SER   4           HG       SER   4 121.589 -10.603   4.301
   31    H    GLN   5           HN       GLN   5 120.204 -14.046   4.256
   32    HA   GLN   5           HA       GLN   5 122.415 -14.899   5.819
   33   1HB   GLN   5           HB2      GLN   5 121.465 -15.773   3.076
   34   2HB   GLN   5           HB1      GLN   5 122.719 -16.611   3.991
   35   1HG   GLN   5           HG2      GLN   5 120.682 -17.755   4.489
   36   2HG   GLN   5           HG1      GLN   5 121.028 -16.762   5.905
   37   1HE2  GLN   5          HE22      GLN   5 117.811 -15.351   5.642
   38   2HE2  GLN   5          HE21      GLN   5 118.977 -16.095   6.627
   39    H    LYS   6           HN       LYS   6 122.321 -12.843   2.972
   40    HA   LYS   6           HA       LYS   6 124.978 -13.245   2.064
   41   1HB   LYS   6           HB2      LYS   6 123.160 -10.833   1.950
   42   2HB   LYS   6           HB1      LYS   6 124.731 -10.898   1.148
   43   1HG   LYS   6           HG2      LYS   6 124.012 -12.898  -0.106
   44   2HG   LYS   6           HG1      LYS   6 122.441 -12.833   0.693
   45   1HD   LYS   6           HD2      LYS   6 121.989 -10.645  -0.296
   46   2HD   LYS   6           HD1      LYS   6 123.593 -10.619  -1.031
   47   1HE   LYS   6           HE2      LYS   6 121.617 -12.838  -1.592
   48   2HE   LYS   6           HE1      LYS   6 121.651 -11.355  -2.544
   49   1HZ   LYS   6           HZ1      LYS   6 124.245 -12.025  -2.484
   50   2HZ   LYS   6           HZ3      LYS   6 123.522 -13.559  -2.496
   51   3HZ   LYS   6           HZ2      LYS   6 123.179 -12.450  -3.737
   52    H    HIS   7           HN       HIS   7 123.671 -11.150   4.619
   53    HA   HIS   7           HA       HIS   7 126.004  -9.617   5.098
   54   1HB   HIS   7           HB2      HIS   7 123.927  -9.000   6.153
   55   2HB   HIS   7           HB1      HIS   7 123.813 -10.559   6.966
   56    HD2  HIS   7           HD2      HIS   7 125.358 -10.790   9.321
   57    HE1  HIS   7           HE1      HIS   7 126.887  -6.857   9.280
   58    HE2  HIS   7           HE2      HIS   7 126.677  -8.978  10.650
   59    H    ARG   8           HN       ARG   8 125.013 -12.685   6.676
   60    HA   ARG   8           HA       ARG   8 127.433 -12.907   8.206
   61   1HB   ARG   8           HB2      ARG   8 125.304 -14.912   7.423
   62   2HB   ARG   8           HB1      ARG   8 126.655 -15.304   8.493
   63   1HG   ARG   8           HG2      ARG   8 125.969 -13.496  10.026
   64   2HG   ARG   8           HG1      ARG   8 124.618 -13.106   8.961
   65   1HD   ARG   8           HD2      ARG   8 123.706 -15.381   9.292
   66   2HD   ARG   8           HD1      ARG   8 125.053 -15.762  10.363
   67    HE   ARG   8           HE       ARG   8 123.907 -13.464  11.452
   68   1HH1  ARG   8          HH21      ARG   8 122.888 -16.630  10.549
   69   2HH1  ARG   8          HH22      ARG   8 121.635 -16.711  11.742
   70   1HH2  ARG   8          HH11      ARG   8 122.275 -13.549  13.013
   71   2HH2  ARG   8          HH12      ARG   8 121.288 -14.966  13.137
   72    H    ASP   9           HN       ASP   9 126.445 -13.988   5.019
   73    HA   ASP   9           HA       ASP   9 128.692 -15.784   4.641
   74   1HB   ASP   9           HB2      ASP   9 126.780 -14.479   2.702
   75   2HB   ASP   9           HB1      ASP   9 128.034 -15.607   2.203
   76    H    PHE  10           HN       PHE  10 128.067 -12.368   3.912
   77    HA   PHE  10           HA       PHE  10 130.430 -11.985   2.309
   78   1HB   PHE  10           HB2      PHE  10 128.413 -10.466   2.380
   79   2HB   PHE  10           HB1      PHE  10 128.971  -9.905   3.957
   80    HD1  PHE  10           HD1      PHE  10 129.656  -9.948   0.343
   81    HD2  PHE  10           HD2      PHE  10 131.000  -8.553   4.178
   82    HE1  PHE  10           HE1      PHE  10 131.203  -8.367  -0.775
   83    HE2  PHE  10           HE2      PHE  10 132.552  -6.973   3.058
   84    HZ   PHE  10           HZ       PHE  10 132.652  -6.883   0.581
   85    H    VAL  11           HN       VAL  11 129.766 -11.537   5.784
   86    HA   VAL  11           HA       VAL  11 132.492 -10.560   6.270
   87    HB   VAL  11           HB       VAL  11 131.804 -10.524   8.627
   88   1HG1  VAL  11          HG13      VAL  11 129.661  -9.537   6.719
   89   2HG1  VAL  11          HG12      VAL  11 129.865  -8.989   8.382
   90   3HG1  VAL  11          HG11      VAL  11 131.117  -8.658   7.184
   91   1HG2  VAL  11          HG22      VAL  11 129.487 -12.118   7.529
   92   2HG2  VAL  11          HG21      VAL  11 130.516 -12.489   8.911
   93   3HG2  VAL  11          HG23      VAL  11 129.321 -11.196   9.024
   94    H    ALA  12           HN       ALA  12 131.747 -13.412   5.245
   95    HA   ALA  12           HA       ALA  12 133.412 -14.923   7.242
   96   1HB   ALA  12           HB2      ALA  12 131.171 -15.931   5.469
   97   2HB   ALA  12           HB1      ALA  12 132.191 -16.947   6.487
   98   3HB   ALA  12           HB3      ALA  12 131.116 -15.758   7.223
   99    H    GLU  13           HN       GLU  13 133.376 -13.632   4.136
  100    HA   GLU  13           HA       GLU  13 135.671 -15.328   3.390
  101   1HB   GLU  13           HB2      GLU  13 134.770 -15.922   1.198
  102   2HB   GLU  13           HB1      GLU  13 133.679 -16.501   2.456
  103   1HG   GLU  13           HG2      GLU  13 132.386 -14.322   2.159
  104   2HG   GLU  13           HG1      GLU  13 133.351 -14.056   0.707
  105    HA   PRO  14           HA       PRO  14 137.386 -11.515   1.815
  106   1HB   PRO  14           HB2      PRO  14 137.833 -13.025  -0.748
  107   2HB   PRO  14           HB1      PRO  14 138.965 -12.017   0.177
  108   1HG   PRO  14           HG2      PRO  14 139.063 -14.692   0.266
  109   2HG   PRO  14           HG1      PRO  14 139.443 -13.690   1.678
  110   1HD   PRO  14           HD2      PRO  14 137.055 -15.398   1.189
  111   2HD   PRO  14           HD1      PRO  14 137.758 -14.842   2.725
  112    H    MET  15           HN       MET  15 136.997  -9.879   0.050
  113    HA   MET  15           HA       MET  15 134.191 -10.046  -0.896
  114   1HB   MET  15           HB2      MET  15 134.641  -7.626  -1.565
  115   2HB   MET  15           HB1      MET  15 134.719  -7.975   0.161
  116   1HG   MET  15           HG2      MET  15 137.140  -8.070   0.097
  117   2HG   MET  15           HG1      MET  15 137.139  -7.918  -1.661
  118   1HE   MET  15           HE1      MET  15 136.023  -6.532   1.618
  119   2HE   MET  15           HE3      MET  15 135.987  -4.769   1.464
  120   3HE   MET  15           HE2      MET  15 134.679  -5.741   0.799
  121    H    GLY  16           HN       GLY  16 137.394 -10.403  -2.116
  122   1HA   GLY  16           HA2      GLY  16 138.236 -10.632  -4.303
  123   2HA   GLY  16           HA1      GLY  16 136.722 -11.490  -4.576
  124    H    GLU  17           HN       GLU  17 136.257 -10.732  -6.623
  125    HA   GLU  17           HA       GLU  17 136.110  -7.773  -7.050
  126   1HB   GLU  17           HB2      GLU  17 136.165 -10.087  -9.012
  127   2HB   GLU  17           HB1      GLU  17 136.051  -8.385  -9.464
  128   1HG   GLU  17           HG2      GLU  17 138.203  -7.938  -8.342
  129   2HG   GLU  17           HG1      GLU  17 138.322  -9.642  -7.894
  130    H    LYS  18           HN       LYS  18 134.047  -9.524  -5.670
  131    HA   LYS  18           HA       LYS  18 131.828  -9.901  -7.416
  132   1HB   LYS  18           HB2      LYS  18 132.064  -9.473  -4.433
  133   2HB   LYS  18           HB1      LYS  18 130.479  -9.577  -5.188
  134   1HG   LYS  18           HG2      LYS  18 130.842 -11.811  -4.623
  135   2HG   LYS  18           HG1      LYS  18 131.453 -11.793  -6.269
  136   1HD   LYS  18           HD2      LYS  18 133.224 -12.841  -5.184
  137   2HD   LYS  18           HD1      LYS  18 133.749 -11.165  -5.073
  138   1HE   LYS  18           HE2      LYS  18 134.004 -12.047  -2.876
  139   2HE   LYS  18           HE1      LYS  18 132.522 -11.094  -2.816
  140   1HZ   LYS  18           HZ2      LYS  18 132.146 -13.834  -3.634
  141   2HZ   LYS  18           HZ1      LYS  18 132.726 -13.661  -2.046
  142   3HZ   LYS  18           HZ3      LYS  18 131.277 -12.908  -2.506
  143    HA   PRO  19           HA       PRO  19 130.596  -5.785  -8.365
  144   1HB   PRO  19           HB2      PRO  19 127.829  -6.017  -8.396
  145   2HB   PRO  19           HB1      PRO  19 128.891  -6.597  -9.694
  146   1HG   PRO  19           HG2      PRO  19 127.667  -8.126  -7.436
  147   2HG   PRO  19           HG1      PRO  19 127.819  -8.572  -9.148
  148   1HD   PRO  19           HD2      PRO  19 129.498  -9.577  -7.294
  149   2HD   PRO  19           HD1      PRO  19 130.069  -9.173  -8.928
  150    H    VAL  20           HN       VAL  20 129.757  -3.856  -7.490
  151    HA   VAL  20           HA       VAL  20 129.915  -3.520  -4.709
  152    HB   VAL  20           HB       VAL  20 130.092  -1.665  -6.314
  153   1HG1  VAL  20          HG11      VAL  20 128.136  -2.616  -7.727
  154   2HG1  VAL  20          HG13      VAL  20 127.087  -1.743  -6.608
  155   3HG1  VAL  20          HG12      VAL  20 128.267  -0.864  -7.580
  156   1HG2  VAL  20          HG21      VAL  20 129.407  -1.277  -3.913
  157   2HG2  VAL  20          HG23      VAL  20 128.878  -0.016  -5.027
  158   3HG2  VAL  20          HG22      VAL  20 127.731  -1.230  -4.462
  159    H    GLY  21           HN       GLY  21 126.997  -3.874  -6.727
  160   1HA   GLY  21           HA2      GLY  21 125.052  -3.572  -4.713
  161   2HA   GLY  21           HA1      GLY  21 124.828  -4.553  -6.160
  162    H    SER  22           HN       SER  22 127.493  -5.851  -4.728
  163    HA   SER  22           HA       SER  22 125.951  -8.100  -3.661
  164   1HB   SER  22           HB2      SER  22 128.091  -9.171  -3.406
  165   2HB   SER  22           HB1      SER  22 128.129  -8.307  -4.939
  166    HG   SER  22           HG       SER  22 128.998  -7.117  -2.532
  167    H    LEU  23           HN       LEU  23 127.575  -5.287  -2.464
  168    HA   LEU  23           HA       LEU  23 128.044  -6.108   0.228
  169   1HB   LEU  23           HB2      LEU  23 127.434  -3.377  -0.931
  170   2HB   LEU  23           HB1      LEU  23 127.934  -3.637   0.737
  171    HG   LEU  23           HG       LEU  23 129.536  -4.534  -1.678
  172   1HD1  LEU  23          HD12      LEU  23 129.718  -2.046   0.035
  173   2HD1  LEU  23          HD11      LEU  23 131.042  -2.607  -0.987
  174   3HD1  LEU  23          HD13      LEU  23 129.505  -2.139  -1.713
  175   1HD2  LEU  23          HD23      LEU  23 129.940  -4.649   1.308
  176   2HD2  LEU  23          HD22      LEU  23 130.317  -5.854   0.079
  177   3HD2  LEU  23          HD21      LEU  23 131.349  -4.443   0.268
  178    H    ALA  24           HN       ALA  24 126.744  -6.199   1.997
  179    HA   ALA  24           HA       ALA  24 123.904  -6.410   1.630
  180   1HB   ALA  24           HB2      ALA  24 125.385  -7.464   3.472
  181   2HB   ALA  24           HB1      ALA  24 125.227  -5.915   4.299
  182   3HB   ALA  24           HB3      ALA  24 123.791  -6.877   3.947
  183    H    GLY  25           HN       GLY  25 122.327  -4.914   1.832
  184   1HA   GLY  25           HA2      GLY  25 121.343  -2.871   2.759
  185   2HA   GLY  25           HA1      GLY  25 122.970  -2.229   2.993
  186    H    ILE  26           HN       ILE  26 123.528  -3.421   0.156
  187    HA   ILE  26           HA       ILE  26 122.561  -1.004  -1.324
  188    HB   ILE  26           HB       ILE  26 124.657  -3.055  -2.121
  189   1HG1  ILE  26          HG12      ILE  26 125.445  -1.879  -0.151
  190   2HG1  ILE  26          HG11      ILE  26 126.282  -1.221  -1.554
  191   1HG2  ILE  26          HG22      ILE  26 123.601  -1.825  -3.997
  192   2HG2  ILE  26          HG21      ILE  26 124.022  -0.299  -3.220
  193   3HG2  ILE  26          HG23      ILE  26 125.295  -1.376  -3.797
  194   1HD1  ILE  26          HD13      ILE  26 124.343   0.543  -1.573
  195   2HD1  ILE  26          HD12      ILE  26 124.097   0.028   0.095
  196   3HD1  ILE  26          HD11      ILE  26 125.644   0.714  -0.395
  197    H    GLY  27           HN       GLY  27 120.742  -1.347  -2.569
  198   1HA   GLY  27           HA2      GLY  27 120.026  -4.126  -3.300
  199   2HA   GLY  27           HA1      GLY  27 118.978  -2.713  -3.429
  200    H    GLU  28           HN       GLU  28 119.014  -4.266  -5.606
  201    HA   GLU  28           HA       GLU  28 121.063  -3.863  -7.514
  202   1HB   GLU  28           HB2      GLU  28 118.087  -4.307  -7.849
  203   2HB   GLU  28           HB1      GLU  28 119.222  -4.309  -9.199
  204   1HG   GLU  28           HG2      GLU  28 120.499  -6.128  -8.127
  205   2HG   GLU  28           HG1      GLU  28 119.362  -6.130  -6.778
  206    H    VAL  29           HN       VAL  29 118.198  -1.853  -6.801
  207    HA   VAL  29           HA       VAL  29 118.684  -0.020  -8.979
  208    HB   VAL  29           HB       VAL  29 117.129   0.281  -6.393
  209   1HG1  VAL  29          HG11      VAL  29 117.473   2.146  -8.747
  210   2HG1  VAL  29          HG13      VAL  29 116.067   2.230  -7.686
  211   3HG1  VAL  29          HG12      VAL  29 117.681   2.506  -7.034
  212   1HG2  VAL  29          HG22      VAL  29 116.357  -1.384  -8.144
  213   2HG2  VAL  29          HG21      VAL  29 115.194  -0.110  -7.780
  214   3HG2  VAL  29          HG23      VAL  29 116.163  -0.024  -9.250
  215    H    LEU  30           HN       LEU  30 119.511   0.037  -5.522
  216    HA   LEU  30           HA       LEU  30 120.853   2.579  -5.604
  217   1HB   LEU  30           HB2      LEU  30 121.207   0.224  -3.719
  218   2HB   LEU  30           HB1      LEU  30 121.875   1.831  -3.450
  219    HG   LEU  30           HG       LEU  30 118.918   1.238  -3.787
  220   1HD1  LEU  30          HD13      LEU  30 120.559   1.749  -1.286
  221   2HD1  LEU  30          HD12      LEU  30 118.799   1.648  -1.338
  222   3HD1  LEU  30          HD11      LEU  30 119.776   0.231  -1.725
  223   1HD2  LEU  30          HD23      LEU  30 120.537   3.731  -3.272
  224   2HD2  LEU  30          HD22      LEU  30 119.152   3.504  -4.339
  225   3HD2  LEU  30          HD21      LEU  30 118.912   3.606  -2.598
  226    H    GLY  31           HN       GLY  31 121.926  -0.767  -6.003
  227   1HA   GLY  31           HA2      GLY  31 124.724  -0.271  -6.103
  228   2HA   GLY  31           HA1      GLY  31 123.918  -1.631  -6.883
  229    H    LYS  32           HN       LYS  32 122.256  -0.144  -8.668
  230    HA   LYS  32           HA       LYS  32 124.057   0.219 -10.847
  231   1HB   LYS  32           HB2      LYS  32 121.667  -0.328 -11.144
  232   2HB   LYS  32           HB1      LYS  32 121.231   1.276 -10.554
  233   1HG   LYS  32           HG2      LYS  32 122.399   2.328 -12.419
  234   2HG   LYS  32           HG1      LYS  32 122.982   0.760 -12.977
  235   1HD   LYS  32           HD2      LYS  32 120.617   0.040 -13.305
  236   2HD   LYS  32           HD1      LYS  32 120.088   1.658 -12.844
  237   1HE   LYS  32           HE2      LYS  32 122.061   1.206 -15.090
  238   2HE   LYS  32           HE1      LYS  32 120.319   1.198 -15.363
  239   1HZ   LYS  32           HZ2      LYS  32 120.395   3.420 -14.091
  240   2HZ   LYS  32           HZ1      LYS  32 122.047   3.415 -14.486
  241   3HZ   LYS  32           HZ3      LYS  32 120.881   3.390 -15.718
  242    H    LYS  33           HN       LYS  33 122.580   2.637  -8.663
  243    HA   LYS  33           HA       LYS  33 123.492   4.910 -10.160
  244   1HB   LYS  33           HB2      LYS  33 122.865   4.576  -7.213
  245   2HB   LYS  33           HB1      LYS  33 123.193   6.132  -7.977
  246   1HG   LYS  33           HG2      LYS  33 121.309   5.774  -9.529
  247   2HG   LYS  33           HG1      LYS  33 120.976   4.219  -8.765
  248   1HD   LYS  33           HD2      LYS  33 120.574   5.355  -6.614
  249   2HD   LYS  33           HD1      LYS  33 120.903   6.913  -7.374
  250   1HE   LYS  33           HE2      LYS  33 118.986   6.715  -8.805
  251   2HE   LYS  33           HE1      LYS  33 118.743   5.029  -8.347
  252   1HZ   LYS  33           HZ1      LYS  33 118.800   6.587  -6.021
  253   2HZ   LYS  33           HZ3      LYS  33 117.723   7.317  -7.110
  254   3HZ   LYS  33           HZ2      LYS  33 117.504   5.693  -6.660
  255    H    LEU  34           HN       LEU  34 124.994   3.093  -7.479
  256    HA   LEU  34           HA       LEU  34 127.269   4.787  -7.157
  257   1HB   LEU  34           HB2      LEU  34 126.922   1.811  -6.700
  258   2HB   LEU  34           HB1      LEU  34 128.359   2.706  -6.219
  259    HG   LEU  34           HG       LEU  34 125.581   3.518  -5.330
  260   1HD1  LEU  34          HD11      LEU  34 127.552   1.678  -3.941
  261   2HD1  LEU  34          HD13      LEU  34 126.094   2.337  -3.201
  262   3HD1  LEU  34          HD12      LEU  34 125.965   1.227  -4.565
  263   1HD2  LEU  34          HD23      LEU  34 128.413   4.222  -4.505
  264   2HD2  LEU  34          HD22      LEU  34 127.088   5.305  -4.926
  265   3HD2  LEU  34          HD21      LEU  34 127.065   4.446  -3.392
  266    H    GLU  35           HN       GLU  35 126.652   2.054  -9.300
  267    HA   GLU  35           HA       GLU  35 129.296   1.836 -10.371
  268   1HB   GLU  35           HB2      GLU  35 126.611   1.234 -11.644
  269   2HB   GLU  35           HB1      GLU  35 128.165   0.794 -12.359
  270   1HG   GLU  35           HG2      GLU  35 128.725  -0.545 -10.387
  271   2HG   GLU  35           HG1      GLU  35 127.208  -0.086  -9.622
  272    H    GLU  36           HN       GLU  36 126.567   3.889 -11.348
  273    HA   GLU  36           HA       GLU  36 127.884   4.990 -13.671
  274   1HB   GLU  36           HB2      GLU  36 125.596   6.001 -11.959
  275   2HB   GLU  36           HB1      GLU  36 126.130   6.797 -13.440
  276   1HG   GLU  36           HG2      GLU  36 125.709   4.724 -14.710
  277   2HG   GLU  36           HG1      GLU  36 125.170   3.928 -13.231
  278    H    ARG  37           HN       ARG  37 128.123   5.545 -10.292
  279    HA   ARG  37           HA       ARG  37 129.292   8.242 -10.594
  280   1HB   ARG  37           HB2      ARG  37 128.759   6.432  -8.234
  281   2HB   ARG  37           HB1      ARG  37 129.640   7.946  -8.064
  282   1HG   ARG  37           HG2      ARG  37 126.960   7.914  -9.453
  283   2HG   ARG  37           HG1      ARG  37 127.031   7.906  -7.693
  284   1HD   ARG  37           HD2      ARG  37 128.261   9.994  -9.525
  285   2HD   ARG  37           HD1      ARG  37 126.863  10.209  -8.474
  286    HE   ARG  37           HE       ARG  37 128.860   9.406  -6.738
  287   1HH1  ARG  37          HH21      ARG  37 128.460  11.850  -9.136
  288   2HH1  ARG  37          HH22      ARG  37 129.530  12.969  -8.361
  289   1HH2  ARG  37          HH11      ARG  37 130.261  10.848  -5.718
  290   2HH2  ARG  37          HH12      ARG  37 130.551  12.402  -6.426
  291    H    GLY  38           HN       GLY  38 130.446   5.189 -11.105
  292   1HA   GLY  38           HA2      GLY  38 132.759   4.841 -11.747
  293   2HA   GLY  38           HA1      GLY  38 133.249   6.119 -10.641
  294    H    PHE  39           HN       PHE  39 131.101   3.388  -9.938
  295    HA   PHE  39           HA       PHE  39 133.206   2.204  -8.172
  296   1HB   PHE  39           HB2      PHE  39 130.299   2.723  -7.467
  297   2HB   PHE  39           HB1      PHE  39 131.394   1.734  -6.499
  298    HD1  PHE  39           HD2      PHE  39 133.264   2.746  -5.283
  299    HD2  PHE  39           HD1      PHE  39 130.568   5.134  -7.603
  300    HE1  PHE  39           HE2      PHE  39 134.158   4.796  -4.207
  301    HE2  PHE  39           HE1      PHE  39 131.458   7.190  -6.538
  302    HZ   PHE  39           HZ       PHE  39 133.257   7.020  -4.834
  303    H    ASP  40           HN       ASP  40 133.272   0.920 -10.284
  304    HA   ASP  40           HA       ASP  40 130.986  -0.767 -10.890
  305   1HB   ASP  40           HB2      ASP  40 132.499  -1.791 -12.545
  306   2HB   ASP  40           HB1      ASP  40 132.567  -0.031 -12.636
  307    H    LYS  41           HN       LYS  41 133.608  -0.979  -8.645
  308    HA   LYS  41           HA       LYS  41 132.926  -3.863  -8.157
  309   1HB   LYS  41           HB2      LYS  41 135.684  -2.612  -8.017
  310   2HB   LYS  41           HB1      LYS  41 135.289  -4.278  -7.606
  311   1HG   LYS  41           HG2      LYS  41 134.772  -3.066 -10.337
  312   2HG   LYS  41           HG1      LYS  41 136.238  -3.957  -9.935
  313   1HD   LYS  41           HD2      LYS  41 134.629  -5.854  -9.178
  314   2HD   LYS  41           HD1      LYS  41 133.401  -4.980 -10.096
  315   1HE   LYS  41           HE2      LYS  41 134.828  -5.084 -12.107
  316   2HE   LYS  41           HE1      LYS  41 136.043  -5.981 -11.194
  317   1HZ   LYS  41           HZ1      LYS  41 133.766  -7.361 -10.714
  318   2HZ   LYS  41           HZ3      LYS  41 133.564  -6.890 -12.331
  319   3HZ   LYS  41           HZ2      LYS  41 134.937  -7.777 -11.871
  320    H    ALA  42           HN       ALA  42 133.067  -4.537  -5.984
  321    HA   ALA  42           HA       ALA  42 132.192  -2.640  -4.046
  322   1HB   ALA  42           HB2      ALA  42 133.381  -5.400  -3.661
  323   2HB   ALA  42           HB1      ALA  42 132.509  -4.492  -2.426
  324   3HB   ALA  42           HB3      ALA  42 131.673  -5.023  -3.885
  325    H    TYR  43           HN       TYR  43 135.433  -4.070  -4.539
  326    HA   TYR  43           HA       TYR  43 136.597  -3.039  -2.175
  327   1HB   TYR  43           HB2      TYR  43 138.774  -3.341  -3.225
  328   2HB   TYR  43           HB1      TYR  43 137.725  -4.709  -3.586
  329    HD1  TYR  43           HD1      TYR  43 139.012  -1.489  -4.953
  330    HD2  TYR  43           HD2      TYR  43 137.219  -5.292  -5.825
  331    HE1  TYR  43           HE1      TYR  43 139.372  -1.105  -7.374
  332    HE2  TYR  43           HE2      TYR  43 137.579  -4.907  -8.248
  333    HH   TYR  43           HH       TYR  43 139.637  -2.605  -9.452
  334    H    VAL  44           HN       VAL  44 135.611  -1.271  -4.978
  335    HA   VAL  44           HA       VAL  44 137.454   0.968  -4.508
  336    HB   VAL  44           HB       VAL  44 134.878   0.852  -6.123
  337   1HG1  VAL  44          HG13      VAL  44 135.554   3.158  -5.462
  338   2HG1  VAL  44          HG12      VAL  44 137.147   2.869  -6.158
  339   3HG1  VAL  44          HG11      VAL  44 135.723   2.894  -7.196
  340   1HG2  VAL  44          HG22      VAL  44 137.792   0.562  -6.916
  341   2HG2  VAL  44          HG21      VAL  44 136.553  -0.688  -7.000
  342   3HG2  VAL  44          HG23      VAL  44 136.458   0.718  -8.058
  343    H    VAL  45           HN       VAL  45 134.297  -0.051  -3.565
  344    HA   VAL  45           HA       VAL  45 133.518   2.473  -2.290
  345    HB   VAL  45           HB       VAL  45 132.369  -0.330  -2.062
  346   1HG1  VAL  45          HG13      VAL  45 131.469   2.329  -0.931
  347   2HG1  VAL  45          HG12      VAL  45 130.377   0.958  -1.118
  348   3HG1  VAL  45          HG11      VAL  45 131.778   0.830  -0.054
  349   1HG2  VAL  45          HG22      VAL  45 131.596   2.141  -3.635
  350   2HG2  VAL  45          HG21      VAL  45 132.038   0.559  -4.274
  351   3HG2  VAL  45          HG23      VAL  45 130.516   0.767  -3.411
  352    H    LEU  46           HN       LEU  46 134.995  -0.582  -1.349
  353    HA   LEU  46           HA       LEU  46 134.943  -0.241   1.487
  354   1HB   LEU  46           HB2      LEU  46 135.622  -2.355   0.348
  355   2HB   LEU  46           HB1      LEU  46 137.065  -1.551  -0.253
  356    HG   LEU  46           HG       LEU  46 137.692  -1.084   2.166
  357   1HD1  LEU  46          HD12      LEU  46 135.247  -2.785   2.585
  358   2HD1  LEU  46          HD11      LEU  46 136.564  -2.824   3.756
  359   3HD1  LEU  46          HD13      LEU  46 135.735  -1.308   3.415
  360   1HD2  LEU  46          HD23      LEU  46 137.829  -3.614   0.691
  361   2HD2  LEU  46          HD22      LEU  46 139.065  -2.794   1.634
  362   3HD2  LEU  46          HD21      LEU  46 137.923  -3.865   2.436
  363    H    GLY  47           HN       GLY  47 137.126   0.868  -1.042
  364   1HA   GLY  47           HA2      GLY  47 139.148   2.024   0.597
  365   2HA   GLY  47           HA1      GLY  47 138.789   2.525  -1.054
  366    H    GLN  48           HN       GLN  48 136.095   3.403  -0.664
  367    HA   GLN  48           HA       GLN  48 136.523   6.067   0.260
  368   1HB   GLN  48           HB2      GLN  48 134.707   5.419  -1.299
  369   2HB   GLN  48           HB1      GLN  48 133.925   4.514  -0.006
  370   1HG   GLN  48           HG2      GLN  48 132.882   6.724  -0.267
  371   2HG   GLN  48           HG1      GLN  48 133.682   6.606   1.299
  372   1HE2  GLN  48          HE22      GLN  48 135.591   9.475   0.626
  373   2HE2  GLN  48          HE21      GLN  48 134.763   8.520   1.760
  374    H    PHE  49           HN       PHE  49 135.064   3.228   1.822
  375    HA   PHE  49           HA       PHE  49 134.302   4.461   4.281
  376   1HB   PHE  49           HB2      PHE  49 133.589   2.196   3.587
  377   2HB   PHE  49           HB1      PHE  49 135.247   1.624   3.744
  378    HD1  PHE  49           HD1      PHE  49 132.604   3.403   5.732
  379    HD2  PHE  49           HD2      PHE  49 135.910   0.659   5.770
  380    HE1  PHE  49           HE1      PHE  49 132.200   2.947   8.137
  381    HE2  PHE  49           HE2      PHE  49 135.508   0.204   8.170
  382    HZ   PHE  49           HZ       PHE  49 133.653   1.348   9.358
  383    H    LEU  50           HN       LEU  50 137.313   2.998   3.189
  384    HA   LEU  50           HA       LEU  50 138.694   3.292   5.721
  385   1HB   LEU  50           HB2      LEU  50 139.728   3.020   2.884
  386   2HB   LEU  50           HB1      LEU  50 140.776   3.028   4.301
  387    HG   LEU  50           HG       LEU  50 138.485   1.079   3.888
  388   1HD1  LEU  50          HD12      LEU  50 141.465   0.736   3.437
  389   2HD1  LEU  50          HD11      LEU  50 140.290  -0.578   3.421
  390   3HD1  LEU  50          HD13      LEU  50 140.207   0.694   2.203
  391   1HD2  LEU  50          HD23      LEU  50 140.560   1.495   6.034
  392   2HD2  LEU  50          HD22      LEU  50 138.859   1.057   6.192
  393   3HD2  LEU  50          HD21      LEU  50 140.028  -0.148   5.681
  394    H    VAL  51           HN       VAL  51 138.355   5.339   2.863
  395    HA   VAL  51           HA       VAL  51 140.216   7.360   3.650
  396    HB   VAL  51           HB       VAL  51 137.760   7.443   1.879
  397   1HG1  VAL  51          HG13      VAL  51 139.825   9.575   2.472
  398   2HG1  VAL  51          HG12      VAL  51 138.838   9.588   1.011
  399   3HG1  VAL  51          HG11      VAL  51 138.070   9.708   2.594
  400   1HG2  VAL  51          HG22      VAL  51 139.865   6.074   1.284
  401   2HG2  VAL  51          HG21      VAL  51 139.294   7.227   0.079
  402   3HG2  VAL  51          HG23      VAL  51 140.676   7.630   1.100
  403    H    LEU  52           HN       LEU  52 136.873   6.757   4.580
  404    HA   LEU  52           HA       LEU  52 136.636   9.403   5.884
  405   1HB   LEU  52           HB2      LEU  52 134.747   7.033   5.857
  406   2HB   LEU  52           HB1      LEU  52 134.384   8.611   6.546
  407    HG   LEU  52           HG       LEU  52 135.041   8.071   3.633
  408   1HD1  LEU  52          HD11      LEU  52 132.770   7.302   4.597
  409   2HD1  LEU  52          HD13      LEU  52 132.416   9.019   4.792
  410   3HD1  LEU  52          HD12      LEU  52 132.726   8.360   3.187
  411   1HD2  LEU  52          HD23      LEU  52 134.562  10.584   5.232
  412   2HD2  LEU  52          HD22      LEU  52 135.742  10.287   3.955
  413   3HD2  LEU  52          HD21      LEU  52 134.049  10.526   3.546
  414    H    LYS  53           HN       LYS  53 138.475   6.984   6.788
  415    HA   LYS  53           HA       LYS  53 139.114   6.065   8.861
  416   1HB   LYS  53           HB2      LYS  53 138.048   8.787   9.669
  417   2HB   LYS  53           HB1      LYS  53 139.020   7.751  10.715
  418   1HG   LYS  53           HG2      LYS  53 140.845   7.784   9.061
  419   2HG   LYS  53           HG1      LYS  53 139.880   8.821   8.010
  420   1HD   LYS  53           HD2      LYS  53 139.826  10.548   9.770
  421   2HD   LYS  53           HD1      LYS  53 140.797   9.509  10.816
  422   1HE   LYS  53           HE2      LYS  53 142.600   9.514   9.096
  423   2HE   LYS  53           HE1      LYS  53 141.638  10.630   8.126
  424   1HZ   LYS  53           HZ3      LYS  53 142.324  11.232  10.934
  425   2HZ   LYS  53           HZ2      LYS  53 143.391  11.609   9.668
  426   3HZ   LYS  53           HZ1      LYS  53 141.840  12.301   9.710
  427    H    LYS  54           HN       LYS  54 136.450   5.331   8.003
  428    HA   LYS  54           HA       LYS  54 134.550   4.248   8.833
  429   1HB   LYS  54           HB2      LYS  54 135.950   4.380  11.518
  430   2HB   LYS  54           HB1      LYS  54 134.724   3.225  11.003
  431   1HG   LYS  54           HG2      LYS  54 136.297   2.469   9.189
  432   2HG   LYS  54           HG1      LYS  54 137.536   3.494   9.914
  433   1HD   LYS  54           HD2      LYS  54 137.150   2.251  12.089
  434   2HD   LYS  54           HD1      LYS  54 136.144   1.122  11.178
  435   1HE   LYS  54           HE2      LYS  54 139.086   1.701  10.762
  436   2HE   LYS  54           HE1      LYS  54 138.358   0.177  11.273
  437   1HZ   LYS  54           HZ2      LYS  54 137.067   0.462   9.035
  438   2HZ   LYS  54           HZ1      LYS  54 138.407   1.422   8.620
  439   3HZ   LYS  54           HZ3      LYS  54 138.631  -0.202   9.054
  440    H    ASP  55           HN       ASP  55 134.914   7.335   9.112
  441    HA   ASP  55           HA       ASP  55 133.383   8.081  11.448
  442   1HB   ASP  55           HB2      ASP  55 134.747   9.731  10.268
  443   2HB   ASP  55           HB1      ASP  55 133.798   9.506   8.805
  444    H    GLU  56           HN       GLU  56 131.337   7.355  11.754
  445    HA   GLU  56           HA       GLU  56 129.663   6.257   9.742
  446   1HB   GLU  56           HB2      GLU  56 129.507   5.709  12.134
  447   2HB   GLU  56           HB1      GLU  56 128.924   7.337  12.470
  448   1HG   GLU  56           HG2      GLU  56 126.936   6.953  11.110
  449   2HG   GLU  56           HG1      GLU  56 127.537   5.365  10.629
  450    H    ASP  57           HN       ASP  57 129.568   9.533  11.200
  451    HA   ASP  57           HA       ASP  57 127.116  10.279   9.874
  452   1HB   ASP  57           HB2      ASP  57 129.368  11.921  11.060
  453   2HB   ASP  57           HB1      ASP  57 127.890  12.635  10.414
  454    H    LEU  58           HN       LEU  58 130.515  10.681   9.041
  455    HA   LEU  58           HA       LEU  58 129.947  12.235   6.648
  456   1HB   LEU  58           HB2      LEU  58 132.395  10.615   7.388
  457   2HB   LEU  58           HB1      LEU  58 132.297  11.679   5.993
  458    HG   LEU  58           HG       LEU  58 131.858  12.571   8.858
  459   1HD1  LEU  58          HD12      LEU  58 134.204  11.803   8.320
  460   2HD1  LEU  58          HD11      LEU  58 134.267  13.065   7.087
  461   3HD1  LEU  58          HD13      LEU  58 134.082  13.500   8.787
  462   1HD2  LEU  58          HD22      LEU  58 131.806  13.945   6.177
  463   2HD2  LEU  58          HD21      LEU  58 130.765  14.188   7.578
  464   3HD2  LEU  58          HD23      LEU  58 132.399  14.844   7.572
  465    H    PHE  59           HN       PHE  59 130.412   8.799   7.324
  466    HA   PHE  59           HA       PHE  59 130.363   7.919   4.596
  467   1HB   PHE  59           HB2      PHE  59 131.125   6.450   6.400
  468   2HB   PHE  59           HB1      PHE  59 129.518   6.478   7.127
  469    HD1  PHE  59           HD1      PHE  59 131.219   5.703   3.871
  470    HD2  PHE  59           HD2      PHE  59 127.983   4.798   6.551
  471    HE1  PHE  59           HE1      PHE  59 130.538   3.815   2.413
  472    HE2  PHE  59           HE2      PHE  59 127.303   2.912   5.094
  473    HZ   PHE  59           HZ       PHE  59 128.579   2.420   3.024
  474    H    ARG  60           HN       ARG  60 127.746   8.184   7.032
  475    HA   ARG  60           HA       ARG  60 125.657   7.253   5.348
  476   1HB   ARG  60           HB2      ARG  60 125.604   9.197   7.664
  477   2HB   ARG  60           HB1      ARG  60 124.146   8.614   6.865
  478   1HG   ARG  60           HG2      ARG  60 124.803   6.287   7.391
  479   2HG   ARG  60           HG1      ARG  60 126.231   6.885   8.228
  480   1HD   ARG  60           HD2      ARG  60 123.342   7.444   8.954
  481   2HD   ARG  60           HD1      ARG  60 124.489   6.470   9.874
  482    HE   ARG  60           HE       ARG  60 125.706   8.963   9.671
  483   1HH1  ARG  60          HH21      ARG  60 122.703   7.681  10.776
  484   2HH1  ARG  60          HH22      ARG  60 122.440   8.940  11.937
  485   1HH2  ARG  60          HH11      ARG  60 125.374  10.618  11.173
  486   2HH2  ARG  60          HH12      ARG  60 123.953  10.602  12.161
  487    H    GLU  61           HN       GLU  61 126.769  10.626   5.895
  488    HA   GLU  61           HA       GLU  61 124.819  11.803   4.165
  489   1HB   GLU  61           HB2      GLU  61 126.207  13.069   5.811
  490   2HB   GLU  61           HB1      GLU  61 127.623  12.773   4.806
  491   1HG   GLU  61           HG2      GLU  61 126.772  14.985   4.292
  492   2HG   GLU  61           HG1      GLU  61 126.445  13.936   2.912
  493    H    TRP  62           HN       TRP  62 128.054  10.452   3.591
  494    HA   TRP  62           HA       TRP  62 128.301  11.288   0.879
  495   1HB   TRP  62           HB2      TRP  62 130.252  10.473   2.006
  496   2HB   TRP  62           HB1      TRP  62 129.469   8.941   2.388
  497    HD1  TRP  62           HD1      TRP  62 130.972  10.883  -0.566
  498    HE1  TRP  62           HE1      TRP  62 131.447   9.219  -2.481
  499    HE3  TRP  62           HE3      TRP  62 128.854   6.671   1.383
  500    HZ2  TRP  62           HZ2      TRP  62 130.969   6.454  -3.106
  501    HZ3  TRP  62           HZ3      TRP  62 128.880   4.541   0.119
  502    HH2  TRP  62           HH2      TRP  62 129.934   4.428  -2.121
  503    H    LEU  63           HN       LEU  63 127.050   8.191   2.192
  504    HA   LEU  63           HA       LEU  63 126.490   7.121  -0.415
  505   1HB   LEU  63           HB2      LEU  63 126.779   5.675   1.553
  506   2HB   LEU  63           HB1      LEU  63 125.335   6.365   2.283
  507    HG   LEU  63           HG       LEU  63 123.970   5.490   0.428
  508   1HD1  LEU  63          HD11      LEU  63 126.670   4.657  -0.619
  509   2HD1  LEU  63          HD13      LEU  63 125.237   3.722  -1.045
  510   3HD1  LEU  63          HD12      LEU  63 125.336   5.425  -1.480
  511   1HD2  LEU  63          HD21      LEU  63 125.783   3.549   1.872
  512   2HD2  LEU  63          HD23      LEU  63 124.144   4.031   2.309
  513   3HD2  LEU  63          HD22      LEU  63 124.417   3.011   0.896
  514    H    LYS  64           HN       LYS  64 124.373   8.638   2.012
  515    HA   LYS  64           HA       LYS  64 121.965   8.396   0.480
  516   1HB   LYS  64           HB2      LYS  64 122.022   8.992   2.907
  517   2HB   LYS  64           HB1      LYS  64 122.647  10.582   2.465
  518   1HG   LYS  64           HG2      LYS  64 120.629  11.006   1.107
  519   2HG   LYS  64           HG1      LYS  64 119.999   9.417   1.544
  520   1HD   LYS  64           HD2      LYS  64 120.020  10.072   3.924
  521   2HD   LYS  64           HD1      LYS  64 120.626  11.667   3.476
  522   1HE   LYS  64           HE2      LYS  64 118.003  10.479   2.523
  523   2HE   LYS  64           HE1      LYS  64 118.162  11.668   3.815
  524   1HZ   LYS  64           HZ3      LYS  64 119.587  12.629   1.632
  525   2HZ   LYS  64           HZ2      LYS  64 118.091  12.092   1.033
  526   3HZ   LYS  64           HZ1      LYS  64 118.146  13.244   2.281
  527    H    ASP  65           HN       ASP  65 124.283  11.067   0.747
  528    HA   ASP  65           HA       ASP  65 122.933  12.762  -1.145
  529   1HB   ASP  65           HB2      ASP  65 124.658  13.489   0.570
  530   2HB   ASP  65           HB1      ASP  65 125.888  12.785  -0.479
  531    H    THR  66           HN       THR  66 125.250  10.151  -1.458
  532    HA   THR  66           HA       THR  66 125.958  10.805  -4.200
  533    HB   THR  66           HB       THR  66 126.411   8.332  -2.514
  534    HG1  THR  66           HG1      THR  66 127.845  10.653  -3.167
  535   1HG2  THR  66          HG23      THR  66 127.324   9.033  -5.312
  536   2HG2  THR  66          HG22      THR  66 128.136   7.825  -4.316
  537   3HG2  THR  66          HG21      THR  66 126.454   7.589  -4.792
  538    H    CYS  67           HN       CYS  67 123.573   8.585  -2.698
  539    HA   CYS  67           HA       CYS  67 122.556   8.042  -5.479
  540   1HB   CYS  67           HB2      CYS  67 122.169   5.742  -4.897
  541   2HB   CYS  67           HB1      CYS  67 123.846   6.120  -4.501
  542    HG   CYS  67           HG       CYS  67 123.042   5.067  -2.334
  543    H    GLY  68           HN       GLY  68 121.748   8.417  -2.056
  544   1HA   GLY  68           HA2      GLY  68 119.631   9.581  -1.503
  545   2HA   GLY  68           HA1      GLY  68 118.868   8.738  -2.852
  546    H    ALA  69           HN       ALA  69 121.073   6.830  -1.021
  547    HA   ALA  69           HA       ALA  69 119.219   4.835  -0.344
  548   1HB   ALA  69           HB1      ALA  69 121.736   5.620   1.161
  549   2HB   ALA  69           HB3      ALA  69 120.891   4.080   1.323
  550   3HB   ALA  69           HB2      ALA  69 121.658   4.508  -0.206
  551    H    ASN  70           HN       ASN  70 118.125   4.328   1.679
  552    HA   ASN  70           HA       ASN  70 117.279   6.764   3.134
  553   1HB   ASN  70           HB2      ASN  70 116.268   3.908   3.266
  554   2HB   ASN  70           HB1      ASN  70 115.534   5.294   4.072
  555   1HD2  ASN  70          HD22      ASN  70 114.568   6.778   0.839
  556   2HD2  ASN  70          HD21      ASN  70 115.369   7.268   2.253
  557    H    ALA  71           HN       ALA  71 116.895   6.391   5.566
  558    HA   ALA  71           HA       ALA  71 119.392   6.041   6.862
  559   1HB   ALA  71           HB2      ALA  71 116.593   5.943   8.014
  560   2HB   ALA  71           HB1      ALA  71 118.069   6.091   8.967
  561   3HB   ALA  71           HB3      ALA  71 117.609   7.376   7.850
  562    H    LYS  72           HN       LYS  72 116.743   3.693   6.377
  563    HA   LYS  72           HA       LYS  72 117.893   1.768   8.214
  564   1HB   LYS  72           HB2      LYS  72 115.881   1.472   5.970
  565   2HB   LYS  72           HB1      LYS  72 116.346   0.148   7.040
  566   1HG   LYS  72           HG2      LYS  72 115.640   1.476   8.995
  567   2HG   LYS  72           HG1      LYS  72 115.170   2.798   7.928
  568   1HD   LYS  72           HD2      LYS  72 113.525   1.324   6.821
  569   2HD   LYS  72           HD1      LYS  72 113.992   0.004   7.893
  570   1HE   LYS  72           HE2      LYS  72 113.409   1.578   9.834
  571   2HE   LYS  72           HE1      LYS  72 112.629   2.598   8.626
  572   1HZ   LYS  72           HZ3      LYS  72 111.758   0.037   8.118
  573   2HZ   LYS  72           HZ2      LYS  72 111.698   0.196   9.809
  574   3HZ   LYS  72           HZ1      LYS  72 110.865   1.298   8.818
  575    H    GLN  73           HN       GLN  73 118.100   2.260   4.716
  576    HA   GLN  73           HA       GLN  73 119.594  -0.116   4.149
  577   1HB   GLN  73           HB2      GLN  73 119.370   2.535   2.697
  578   2HB   GLN  73           HB1      GLN  73 120.227   1.138   2.042
  579   1HG   GLN  73           HG2      GLN  73 117.316   1.102   2.894
  580   2HG   GLN  73           HG1      GLN  73 117.859   1.326   1.232
  581   1HE2  GLN  73          HE22      GLN  73 119.306  -2.096   1.226
  582   2HE2  GLN  73          HE21      GLN  73 119.882  -0.525   0.936
  583    H    SER  74           HN       SER  74 120.576   3.176   5.016
  584    HA   SER  74           HA       SER  74 123.367   2.767   4.540
  585   1HB   SER  74           HB2      SER  74 122.131   4.986   4.879
  586   2HB   SER  74           HB1      SER  74 122.216   4.646   6.604
  587    HG   SER  74           HG       SER  74 124.605   4.180   5.596
  588    H    ARG  75           HN       ARG  75 121.308   2.223   7.399
  589    HA   ARG  75           HA       ARG  75 123.385   1.744   9.274
  590   1HB   ARG  75           HB2      ARG  75 120.593   0.568   9.068
  591   2HB   ARG  75           HB1      ARG  75 121.640   0.357  10.469
  592   1HG   ARG  75           HG2      ARG  75 121.013   3.118   9.439
  593   2HG   ARG  75           HG1      ARG  75 119.878   2.285  10.495
  594   1HD   ARG  75           HD2      ARG  75 121.614   2.060  12.215
  595   2HD   ARG  75           HD1      ARG  75 122.790   2.834  11.160
  596    HE   ARG  75           HE       ARG  75 120.707   4.661  11.309
  597   1HH1  ARG  75          HH21      ARG  75 122.742   2.959  13.509
  598   2HH1  ARG  75          HH22      ARG  75 122.691   4.196  14.720
  599   1HH2  ARG  75          HH11      ARG  75 120.625   6.282  12.874
  600   2HH2  ARG  75          HH12      ARG  75 121.490   6.080  14.360
  601    H    ASP  76           HN       ASP  76 121.803  -0.455   6.951
  602    HA   ASP  76           HA       ASP  76 123.079  -2.823   7.902
  603   1HB   ASP  76           HB2      ASP  76 121.936  -2.082   5.201
  604   2HB   ASP  76           HB1      ASP  76 122.525  -3.700   5.591
  605    H    CYS  77           HN       CYS  77 124.081  -0.466   5.405
  606    HA   CYS  77           HA       CYS  77 126.349  -2.010   4.541
  607   1HB   CYS  77           HB2      CYS  77 125.706   0.944   4.379
  608   2HB   CYS  77           HB1      CYS  77 127.139   0.226   3.645
  609    HG   CYS  77           HG       CYS  77 124.717   0.318   2.163
  610    H    PHE  78           HN       PHE  78 125.946   0.530   7.030
  611    HA   PHE  78           HA       PHE  78 128.700   0.885   7.604
  612   1HB   PHE  78           HB2      PHE  78 126.939   2.333   8.528
  613   2HB   PHE  78           HB1      PHE  78 126.346   0.993   9.510
  614    HD1  PHE  78           HD2      PHE  78 127.609   0.167  11.426
  615    HD2  PHE  78           HD1      PHE  78 129.062   3.435   9.050
  616    HE1  PHE  78           HE2      PHE  78 129.267   0.709  13.190
  617    HE2  PHE  78           HE1      PHE  78 130.721   3.978  10.811
  618    HZ   PHE  78           HZ       PHE  78 130.824   2.617  12.881
  619    H    GLY  79           HN       GLY  79 126.408  -1.140   9.470
  620   1HA   GLY  79           HA2      GLY  79 128.419  -2.447  10.991
  621   2HA   GLY  79           HA1      GLY  79 126.787  -3.065  10.742
  622    H    CYS  80           HN       CYS  80 127.079  -3.176   7.814
  623    HA   CYS  80           HA       CYS  80 128.200  -5.841   7.648
  624   1HB   CYS  80           HB2      CYS  80 126.367  -5.052   6.170
  625   2HB   CYS  80           HB1      CYS  80 127.489  -3.928   5.406
  626    HG   CYS  80           HG       CYS  80 127.195  -6.658   4.467
  627    H    LEU  81           HN       LEU  81 129.319  -2.663   6.381
  628    HA   LEU  81           HA       LEU  81 131.802  -3.766   5.393
  629   1HB   LEU  81           HB2      LEU  81 131.042  -0.917   6.109
  630   2HB   LEU  81           HB1      LEU  81 132.494  -1.381   5.227
  631    HG   LEU  81           HG       LEU  81 129.680  -2.043   4.308
  632   1HD1  LEU  81          HD11      LEU  81 130.118   0.414   4.386
  633   2HD1  LEU  81          HD13      LEU  81 131.518   0.167   3.342
  634   3HD1  LEU  81          HD12      LEU  81 129.898  -0.190   2.743
  635   1HD2  LEU  81          HD22      LEU  81 132.448  -2.404   3.152
  636   2HD2  LEU  81          HD21      LEU  81 131.106  -3.547   3.199
  637   3HD2  LEU  81          HD23      LEU  81 131.072  -2.196   2.071
  638    H    ARG  82           HN       ARG  82 130.823  -2.158   8.416
  639    HA   ARG  82           HA       ARG  82 133.435  -1.951   9.549
  640   1HB   ARG  82           HB2      ARG  82 131.479  -0.789  10.506
  641   2HB   ARG  82           HB1      ARG  82 130.783  -2.340  10.971
  642   1HG   ARG  82           HG2      ARG  82 132.713  -2.785  12.440
  643   2HG   ARG  82           HG1      ARG  82 133.442  -1.254  11.955
  644   1HD   ARG  82           HD2      ARG  82 131.508  -0.039  12.888
  645   2HD   ARG  82           HD1      ARG  82 130.776  -1.569  13.367
  646    HE   ARG  82           HE       ARG  82 133.276  -1.618  14.569
  647   1HH1  ARG  82          HH21      ARG  82 130.594   0.547  14.460
  648   2HH1  ARG  82          HH22      ARG  82 130.856   1.163  16.057
  649   1HH2  ARG  82          HH11      ARG  82 133.630  -0.829  16.656
  650   2HH2  ARG  82          HH12      ARG  82 132.574   0.384  17.300
  651    H    GLU  83           HN       GLU  83 131.055  -4.594   9.607
  652    HA   GLU  83           HA       GLU  83 132.578  -6.261  11.386
  653   1HB   GLU  83           HB2      GLU  83 130.347  -6.826   9.425
  654   2HB   GLU  83           HB1      GLU  83 131.075  -8.088  10.421
  655   1HG   GLU  83           HG2      GLU  83 129.982  -5.527  11.603
  656   2HG   GLU  83           HG1      GLU  83 128.985  -6.967  11.385
  657    H    TRP  84           HN       TRP  84 132.458  -6.038   7.809
  658    HA   TRP  84           HA       TRP  84 134.067  -8.341   7.299
  659   1HB   TRP  84           HB2      TRP  84 132.780  -7.010   5.575
  660   2HB   TRP  84           HB1      TRP  84 134.028  -5.770   5.689
  661    HD1  TRP  84           HD1      TRP  84 133.362  -9.255   4.359
  662    HE1  TRP  84           HE1      TRP  84 135.339  -9.988   2.869
  663    HE3  TRP  84           HE3      TRP  84 136.649  -5.464   5.318
  664    HZ2  TRP  84           HZ2      TRP  84 137.958  -9.090   2.180
  665    HZ3  TRP  84           HZ3      TRP  84 138.878  -5.429   4.232
  666    HH2  TRP  84           HH2      TRP  84 139.536  -7.236   2.665
  667    H    CYS  85           HN       CYS  85 134.899  -4.938   7.901
  668    HA   CYS  85           HA       CYS  85 137.714  -5.170   7.528
  669   1HB   CYS  85           HB2      CYS  85 136.070  -3.331   9.289
  670   2HB   CYS  85           HB1      CYS  85 137.812  -3.158   9.070
  671    HG   CYS  85           HG       CYS  85 135.675  -2.663   6.865
  672    H    ASP  86           HN       ASP  86 135.677  -5.701  10.375
  673    HA   ASP  86           HA       ASP  86 137.723  -6.074  12.300
  674   1HB   ASP  86           HB2      ASP  86 134.957  -7.285  12.067
  675   2HB   ASP  86           HB1      ASP  86 135.989  -7.496  13.481
  676    H    ALA  87           HN       ALA  87 136.432  -8.273   9.859
  677    HA   ALA  87           HA       ALA  87 137.886 -10.575  10.992
  678   1HB   ALA  87           HB3      ALA  87 135.627 -10.704   9.795
  679   2HB   ALA  87           HB2      ALA  87 136.522 -10.438   8.296
  680   3HB   ALA  87           HB1      ALA  87 136.849 -11.865   9.278
  681    H    PHE  88           HN       PHE  88 138.225  -8.317   8.290
  682    HA   PHE  88           HA       PHE  88 140.748  -9.712   7.471
  683   1HB   PHE  88           HB2      PHE  88 138.967  -7.734   6.033
  684   2HB   PHE  88           HB1      PHE  88 140.515  -8.299   5.404
  685    HD1  PHE  88           HD2      PHE  88 140.849 -10.713   4.874
  686    HD2  PHE  88           HD1      PHE  88 137.012  -9.143   5.999
  687    HE1  PHE  88           HE2      PHE  88 139.754 -12.751   3.982
  688    HE2  PHE  88           HE1      PHE  88 135.916 -11.185   5.107
  689    HZ   PHE  88           HZ       PHE  88 137.288 -12.984   4.095
  690    H    LEU  89           HN       LEU  89 139.990  -6.345   6.820
  691    HA   LEU  89           HA       LEU  89 142.604  -5.555   7.922
  692   1HB   LEU  89           HB2      LEU  89 142.029  -4.608   5.787
  693   2HB   LEU  89           HB1      LEU  89 140.452  -4.090   6.373
  694    HG   LEU  89           HG       LEU  89 141.453  -2.427   7.813
  695   1HD1  LEU  89          HD11      LEU  89 144.032  -3.801   7.043
  696   2HD1  LEU  89          HD13      LEU  89 144.016  -2.155   7.680
  697   3HD1  LEU  89          HD12      LEU  89 143.402  -3.486   8.660
  698   1HD2  LEU  89          HD21      LEU  89 141.289  -2.059   5.246
  699   2HD2  LEU  89          HD23      LEU  89 142.286  -0.937   6.173
  700   3HD2  LEU  89          HD22      LEU  89 143.042  -2.237   5.247
  701   1H    MET   1           HT1      MET   1 168.198  -3.109  -3.997
  702   2H    MET   1           HT3      MET   1 169.706  -3.571  -3.374
  703   3H    MET   1           HT2      MET   1 169.580  -3.036  -4.982
  704    HA   MET   1           HA       MET   1 168.392  -4.956  -5.643
  705   1HB   MET   1           HB2      MET   1 170.880  -5.157  -5.377
  706   2HB   MET   1           HB1      MET   1 170.610  -5.816  -3.763
  707   1HG   MET   1           HG2      MET   1 169.280  -7.655  -4.731
  708   2HG   MET   1           HG1      MET   1 169.548  -6.997  -6.346
  709   1HE   MET   1           HE2      MET   1 170.184  -9.461  -6.761
  710   2HE   MET   1           HE1      MET   1 171.683 -10.236  -6.257
  711   3HE   MET   1           HE3      MET   1 170.357 -10.035  -5.105
  712    H    THR   2           HN       THR   2 169.387  -5.768  -2.306
  713    HA   THR   2           HA       THR   2 166.974  -7.393  -1.972
  714    HB   THR   2           HB       THR   2 169.071  -6.638   0.086
  715    HG1  THR   2           HG1      THR   2 170.108  -8.476  -0.548
  716   1HG2  THR   2          HG21      THR   2 167.029  -8.873  -0.063
  717   2HG2  THR   2          HG23      THR   2 168.284  -8.737   1.171
  718   3HG2  THR   2          HG22      THR   2 167.015  -7.516   1.064
  719    H    THR   3           HN       THR   3 165.130  -6.781  -0.912
  720    HA   THR   3           HA       THR   3 164.759  -3.966  -0.290
  721    HB   THR   3           HB       THR   3 162.471  -4.707   0.408
  722    HG1  THR   3           HG1      THR   3 163.474  -6.878   0.984
  723   1HG2  THR   3          HG23      THR   3 163.041  -4.174  -1.960
  724   2HG2  THR   3          HG22      THR   3 163.405  -5.880  -2.225
  725   3HG2  THR   3          HG21      THR   3 161.762  -5.380  -1.824
  726    H    SER   4           HN       SER   4 164.003  -3.195   1.834
  727    HA   SER   4           HA       SER   4 165.709  -4.111   3.976
  728   1HB   SER   4           HB2      SER   4 164.658  -2.385   5.297
  729   2HB   SER   4           HB1      SER   4 164.865  -1.746   3.669
  730    HG   SER   4           HG       SER   4 162.541  -3.080   3.856
  731    H    GLN   5           HN       GLN   5 164.912  -4.890   6.064
  732    HA   GLN   5           HA       GLN   5 163.279  -7.200   5.833
  733   1HB   GLN   5           HB2      GLN   5 164.112  -5.594   8.264
  734   2HB   GLN   5           HB1      GLN   5 163.299  -7.158   8.354
  735   1HG   GLN   5           HG2      GLN   5 165.639  -7.632   8.512
  736   2HG   GLN   5           HG1      GLN   5 165.176  -8.063   6.866
  737   1HE2  GLN   5          HE22      GLN   5 167.735  -5.973   5.651
  738   2HE2  GLN   5          HE21      GLN   5 166.988  -7.496   5.615
  739    H    LYS   6           HN       LYS   6 162.386  -3.857   6.438
  740    HA   LYS   6           HA       LYS   6 159.895  -4.304   7.723
  741   1HB   LYS   6           HB2      LYS   6 160.847  -2.088   5.902
  742   2HB   LYS   6           HB1      LYS   6 159.290  -2.055   6.731
  743   1HG   LYS   6           HG2      LYS   6 160.438  -2.286   8.905
  744   2HG   LYS   6           HG1      LYS   6 161.995  -2.316   8.077
  745   1HD   LYS   6           HD2      LYS   6 161.624  -0.059   7.219
  746   2HD   LYS   6           HD1      LYS   6 160.014  -0.024   7.942
  747   1HE   LYS   6           HE2      LYS   6 162.497  -0.494   9.601
  748   2HE   LYS   6           HE1      LYS   6 161.891   1.129   9.268
  749   1HZ   LYS   6           HZ1      LYS   6 159.661  -0.144  10.032
  750   2HZ   LYS   6           HZ3      LYS   6 160.816  -0.922  10.998
  751   3HZ   LYS   6           HZ2      LYS   6 160.645   0.766  11.075
  752    H    HIS   7           HN       HIS   7 160.785  -4.292   4.285
  753    HA   HIS   7           HA       HIS   7 158.167  -4.327   3.204
  754   1HB   HIS   7           HB2      HIS   7 160.060  -4.018   1.746
  755   2HB   HIS   7           HB1      HIS   7 160.751  -5.567   2.219
  756    HD2  HIS   7           HD2      HIS   7 159.651  -7.814   0.907
  757    HE1  HIS   7           HE1      HIS   7 156.981  -5.668  -1.560
  758    HE2  HIS   7           HE2      HIS   7 158.005  -7.942  -1.109
  759    H    ARG   8           HN       ARG   8 160.245  -7.129   4.050
  760    HA   ARG   8           HA       ARG   8 158.216  -9.068   3.440
  761   1HB   ARG   8           HB2      ARG   8 160.752  -9.195   5.089
  762   2HB   ARG   8           HB1      ARG   8 159.728 -10.600   4.778
  763   1HG   ARG   8           HG2      ARG   8 159.997 -10.264   2.348
  764   2HG   ARG   8           HG1      ARG   8 161.023  -8.863   2.657
  765   1HD   ARG   8           HD2      ARG   8 162.628 -10.307   3.862
  766   2HD   ARG   8           HD1      ARG   8 161.604 -11.706   3.541
  767    HE   ARG   8           HE       ARG   8 162.101 -10.604   1.030
  768   1HH1  ARG   8          HH21      ARG   8 163.936 -11.746   3.714
  769   2HH1  ARG   8          HH22      ARG   8 165.289 -12.237   2.751
  770   1HH2  ARG   8          HH11      ARG   8 163.858 -11.236  -0.244
  771   2HH2  ARG   8          HH12      ARG   8 165.245 -11.947   0.510
  772    H    ASP   9           HN       ASP   9 159.096  -7.277   6.326
  773    HA   ASP   9           HA       ASP   9 157.492  -8.880   8.133
  774   1HB   ASP   9           HB2      ASP   9 158.655  -6.103   8.359
  775   2HB   ASP   9           HB1      ASP   9 157.764  -6.880   9.662
  776    H    PHE  10           HN       PHE  10 156.936  -5.940   6.226
  777    HA   PHE  10           HA       PHE  10 154.395  -5.303   7.420
  778   1HB   PHE  10           HB2      PHE  10 155.833  -3.741   6.053
  779   2HB   PHE  10           HB1      PHE  10 155.325  -4.631   4.618
  780    HD1  PHE  10           HD1      PHE  10 154.254  -2.375   7.318
  781    HD2  PHE  10           HD2      PHE  10 153.018  -4.515   3.803
  782    HE1  PHE  10           HE1      PHE  10 152.168  -1.036   7.237
  783    HE2  PHE  10           HE2      PHE  10 150.929  -3.178   3.725
  784    HZ   PHE  10           HZ       PHE  10 150.506  -1.440   5.443
  785    H    VAL  11           HN       VAL  11 155.299  -7.207   4.545
  786    HA   VAL  11           HA       VAL  11 152.484  -7.730   3.896
  787    HB   VAL  11           HB       VAL  11 153.405  -9.123   2.095
  788   1HG1  VAL  11          HG13      VAL  11 154.892  -6.507   2.487
  789   2HG1  VAL  11          HG12      VAL  11 154.722  -7.355   0.950
  790   3HG1  VAL  11          HG11      VAL  11 153.299  -6.690   1.753
  791   1HG2  VAL  11          HG22      VAL  11 155.953  -8.705   3.659
  792   2HG2  VAL  11          HG21      VAL  11 155.265 -10.216   3.069
  793   3HG2  VAL  11          HG23      VAL  11 156.002  -9.082   1.937
  794    H    ALA  12           HN       ALA  12 153.943  -8.666   6.487
  795    HA   ALA  12           HA       ALA  12 153.089 -11.544   6.322
  796   1HB   ALA  12           HB2      ALA  12 155.301 -10.299   7.978
  797   2HB   ALA  12           HB1      ALA  12 154.781 -11.980   8.087
  798   3HB   ALA  12           HB3      ALA  12 155.512 -11.379   6.600
  799    H    GLU  13           HN       GLU  13 152.351  -8.543   7.648
  800    HA   GLU  13           HA       GLU  13 150.621  -9.839   9.656
  801   1HB   GLU  13           HB2      GLU  13 151.390  -8.443  11.506
  802   2HB   GLU  13           HB1      GLU  13 152.751  -9.359  10.859
  803   1HG   GLU  13           HG2      GLU  13 153.257  -7.329   9.399
  804   2HG   GLU  13           HG1      GLU  13 152.089  -6.447  10.384
  805    HA   PRO  14           HA       PRO  14 147.628  -6.771   8.392
  806   1HB   PRO  14           HB2      PRO  14 147.368  -6.134  11.319
  807   2HB   PRO  14           HB1      PRO  14 146.098  -6.452  10.119
  808   1HG   PRO  14           HG2      PRO  14 146.846  -8.304  11.906
  809   2HG   PRO  14           HG1      PRO  14 146.348  -8.734  10.259
  810   1HD   PRO  14           HD2      PRO  14 149.071  -8.790  11.462
  811   2HD   PRO  14           HD1      PRO  14 148.423  -9.700  10.078
  812    H    MET  15           HN       MET  15 147.276  -4.361   8.473
  813    HA   MET  15           HA       MET  15 149.859  -2.964   8.884
  814   1HB   MET  15           HB2      MET  15 148.602  -1.051   7.759
  815   2HB   MET  15           HB1      MET  15 148.847  -2.495   6.778
  816   1HG   MET  15           HG2      MET  15 146.584  -3.250   7.216
  817   2HG   MET  15           HG1      MET  15 146.328  -1.937   8.366
  818   1HE   MET  15           HE1      MET  15 147.343  -2.950   4.923
  819   2HE   MET  15           HE3      MET  15 146.811  -1.676   3.816
  820   3HE   MET  15           HE2      MET  15 148.267  -1.457   4.780
  821    H    GLY  16           HN       GLY  16 146.809  -3.332  10.433
  822   1HA   GLY  16           HA2      GLY  16 145.818  -2.228  12.264
  823   2HA   GLY  16           HA1      GLY  16 147.479  -2.142  12.845
  824    H    GLU  17           HN       GLU  17 147.430  -0.090  13.722
  825    HA   GLU  17           HA       GLU  17 146.603   2.193  11.974
  826   1HB   GLU  17           HB2      GLU  17 147.035   2.012  14.971
  827   2HB   GLU  17           HB1      GLU  17 146.558   3.474  14.107
  828   1HG   GLU  17           HG2      GLU  17 144.526   2.338  13.294
  829   2HG   GLU  17           HG1      GLU  17 144.995   0.875  14.160
  830    H    LYS  18           HN       LYS  18 149.261   0.718  11.910
  831    HA   LYS  18           HA       LYS  18 151.255   2.350  13.119
  832   1HB   LYS  18           HB2      LYS  18 151.258   0.500  10.727
  833   2HB   LYS  18           HB1      LYS  18 152.694   1.437  11.119
  834   1HG   LYS  18           HG2      LYS  18 153.118  -0.529  12.301
  835   2HG   LYS  18           HG1      LYS  18 152.339   0.432  13.547
  836   1HD   LYS  18           HD2      LYS  18 151.128  -1.546  13.734
  837   2HD   LYS  18           HD1      LYS  18 150.123  -0.683  12.576
  838   1HE   LYS  18           HE2      LYS  18 150.420  -2.852  11.646
  839   2HE   LYS  18           HE1      LYS  18 151.529  -1.817  10.749
  840   1HZ   LYS  18           HZ2      LYS  18 152.636  -2.941  13.163
  841   2HZ   LYS  18           HZ1      LYS  18 152.227  -4.097  11.987
  842   3HZ   LYS  18           HZ3      LYS  18 153.304  -2.844  11.605
  843    HA   PRO  19           HA       PRO  19 151.026   6.082  10.800
  844   1HB   PRO  19           HB2      PRO  19 153.704   6.793  10.605
  845   2HB   PRO  19           HB1      PRO  19 152.727   6.986  12.074
  846   1HG   PRO  19           HG2      PRO  19 154.628   4.796  11.350
  847   2HG   PRO  19           HG1      PRO  19 154.416   5.636  12.898
  848   1HD   PRO  19           HD2      PRO  19 153.367   3.186  12.492
  849   2HD   PRO  19           HD1      PRO  19 152.506   4.404  13.460
  850    H    VAL  20           HN       VAL  20 151.326   7.002   8.737
  851    HA   VAL  20           HA       VAL  20 151.406   5.253   6.541
  852    HB   VAL  20           HB       VAL  20 150.469   7.525   6.435
  853   1HG1  VAL  20          HG11      VAL  20 152.438   8.472   7.833
  854   2HG1  VAL  20          HG13      VAL  20 153.293   8.591   6.296
  855   3HG1  VAL  20          HG12      VAL  20 151.791   9.482   6.542
  856   1HG2  VAL  20          HG21      VAL  20 151.287   6.334   4.362
  857   2HG2  VAL  20          HG23      VAL  20 151.257   8.091   4.221
  858   3HG2  VAL  20          HG22      VAL  20 152.785   7.255   4.496
  859    H    GLY  21           HN       GLY  21 154.021   7.300   7.830
  860   1HA   GLY  21           HA2      GLY  21 156.008   6.702   5.924
  861   2HA   GLY  21           HA1      GLY  21 156.348   7.125   7.601
  862    H    SER  22           HN       SER  22 154.411   4.471   7.825
  863    HA   SER  22           HA       SER  22 156.693   2.729   8.405
  864   1HB   SER  22           HB2      SER  22 155.039   1.198   9.248
  865   2HB   SER  22           HB1      SER  22 154.550   2.811   9.755
  866    HG   SER  22           HG       SER  22 153.648   1.669   7.336
  867    H    LEU  23           HN       LEU  23 154.432   3.257   5.839
  868    HA   LEU  23           HA       LEU  23 154.567   0.717   4.544
  869   1HB   LEU  23           HB2      LEU  23 154.155   3.497   3.413
  870   2HB   LEU  23           HB1      LEU  23 153.964   2.024   2.469
  871    HG   LEU  23           HG       LEU  23 152.442   2.611   5.026
  872   1HD1  LEU  23          HD12      LEU  23 151.702   3.009   2.117
  873   2HD1  LEU  23          HD11      LEU  23 150.507   2.943   3.411
  874   3HD1  LEU  23          HD13      LEU  23 151.724   4.220   3.399
  875   1HD2  LEU  23          HD23      LEU  23 152.458   0.356   3.024
  876   2HD2  LEU  23          HD22      LEU  23 152.328   0.294   4.780
  877   3HD2  LEU  23          HD21      LEU  23 150.939   0.776   3.816
  878    H    ALA  24           HN       ALA  24 156.036  -0.170   3.170
  879    HA   ALA  24           HA       ALA  24 158.734   0.813   3.190
  880   1HB   ALA  24           HB2      ALA  24 157.888  -1.603   2.800
  881   2HB   ALA  24           HB1      ALA  24 157.656  -1.108   1.123
  882   3HB   ALA  24           HB3      ALA  24 159.266  -1.058   1.843
  883    H    GLY  25           HN       GLY  25 159.778   2.134   1.809
  884   1HA   GLY  25           HA2      GLY  25 160.188   3.136  -0.392
  885   2HA   GLY  25           HA1      GLY  25 158.484   2.900  -0.783
  886    H    ILE  26           HN       ILE  26 157.986   3.906   2.141
  887    HA   ILE  26           HA       ILE  26 157.968   6.807   1.401
  888    HB   ILE  26           HB       ILE  26 156.532   5.373   3.663
  889   1HG1  ILE  26          HG12      ILE  26 155.660   4.546   1.555
  890   2HG1  ILE  26          HG11      ILE  26 154.498   5.692   2.219
  891   1HG2  ILE  26          HG22      ILE  26 156.920   7.795   4.015
  892   2HG2  ILE  26          HG21      ILE  26 156.140   8.132   2.470
  893   3HG2  ILE  26          HG23      ILE  26 155.209   7.434   3.794
  894   1HD1  ILE  26          HD13      ILE  26 155.779   7.453   0.758
  895   2HD1  ILE  26          HD12      ILE  26 156.369   6.039  -0.114
  896   3HD1  ILE  26          HD11      ILE  26 154.639   6.360  -0.025
  897    H    GLY  27           HN       GLY  27 159.636   7.995   2.279
  898   1HA   GLY  27           HA2      GLY  27 161.089   6.894   4.614
  899   2HA   GLY  27           HA1      GLY  27 161.624   8.228   3.593
  900    H    GLU  28           HN       GLU  28 161.808   8.702   6.221
  901    HA   GLU  28           HA       GLU  28 159.521   9.658   7.581
  902   1HB   GLU  28           HB2      GLU  28 162.424  10.505   7.723
  903   2HB   GLU  28           HB1      GLU  28 161.191  11.087   8.843
  904   1HG   GLU  28           HG2      GLU  28 160.681   8.767   9.500
  905   2HG   GLU  28           HG1      GLU  28 161.914   8.177   8.383
  906    H    VAL  29           HN       VAL  29 161.683  11.356   5.301
  907    HA   VAL  29           HA       VAL  29 160.394  13.916   5.662
  908    HB   VAL  29           HB       VAL  29 162.077  12.801   3.400
  909   1HG1  VAL  29          HG11      VAL  29 160.891  15.546   3.842
  910   2HG1  VAL  29          HG13      VAL  29 162.318  15.296   2.836
  911   3HG1  VAL  29          HG12      VAL  29 160.788  14.535   2.401
  912   1HG2  VAL  29          HG22      VAL  29 163.109  13.156   5.692
  913   2HG2  VAL  29          HG21      VAL  29 163.858  14.088   4.397
  914   3HG2  VAL  29          HG23      VAL  29 162.741  14.871   5.514
  915    H    LEU  30           HN       LEU  30 160.017  11.317   3.266
  916    HA   LEU  30           HA       LEU  30 157.950  12.631   1.760
  917   1HB   LEU  30           HB2      LEU  30 158.571   9.677   2.083
  918   2HB   LEU  30           HB1      LEU  30 157.477  10.346   0.874
  919    HG   LEU  30           HG       LEU  30 160.410  11.086   1.125
  920   1HD1  LEU  30          HD13      LEU  30 159.003   9.196  -0.786
  921   2HD1  LEU  30          HD12      LEU  30 160.688   9.700  -0.921
  922   3HD1  LEU  30          HD11      LEU  30 160.163   8.741   0.463
  923   1HD2  LEU  30          HD23      LEU  30 158.171  11.875  -0.737
  924   2HD2  LEU  30          HD22      LEU  30 159.420  12.883  -0.007
  925   3HD2  LEU  30          HD21      LEU  30 159.823  11.822  -1.351
  926    H    GLY  31           HN       GLY  31 157.927  10.386   4.490
  927   1HA   GLY  31           HA2      GLY  31 155.122   9.929   4.600
  928   2HA   GLY  31           HA1      GLY  31 156.211   9.818   5.982
  929    H    LYS  32           HN       LYS  32 157.100  12.534   6.011
  930    HA   LYS  32           HA       LYS  32 155.028  13.727   7.561
  931   1HB   LYS  32           HB2      LYS  32 157.415  14.300   7.824
  932   2HB   LYS  32           HB1      LYS  32 157.399  15.079   6.241
  933   1HG   LYS  32           HG2      LYS  32 155.746  16.703   7.006
  934   2HG   LYS  32           HG1      LYS  32 155.617  15.882   8.562
  935   1HD   LYS  32           HD2      LYS  32 158.032  16.354   8.970
  936   2HD   LYS  32           HD1      LYS  32 158.083  17.258   7.456
  937   1HE   LYS  32           HE2      LYS  32 156.097  17.913   9.639
  938   2HE   LYS  32           HE1      LYS  32 157.709  18.627   9.600
  939   1HZ   LYS  32           HZ2      LYS  32 157.097  19.184   7.177
  940   2HZ   LYS  32           HZ1      LYS  32 155.493  18.950   7.689
  941   3HZ   LYS  32           HZ3      LYS  32 156.453  20.138   8.426
  942    H    LYS  33           HN       LYS  33 155.937  14.264   4.143
  943    HA   LYS  33           HA       LYS  33 154.187  16.505   3.766
  944   1HB   LYS  33           HB2      LYS  33 155.238  14.444   1.812
  945   2HB   LYS  33           HB1      LYS  33 154.355  15.891   1.330
  946   1HG   LYS  33           HG2      LYS  33 156.055  17.302   2.429
  947   2HG   LYS  33           HG1      LYS  33 156.944  15.855   2.908
  948   1HD   LYS  33           HD2      LYS  33 157.229  15.237   0.538
  949   2HD   LYS  33           HD1      LYS  33 156.344  16.685   0.054
  950   1HE   LYS  33           HE2      LYS  33 158.041  18.126   0.950
  951   2HE   LYS  33           HE1      LYS  33 158.849  16.778   1.751
  952   1HZ   LYS  33           HZ1      LYS  33 158.591  16.177  -0.972
  953   2HZ   LYS  33           HZ3      LYS  33 159.250  17.734  -0.843
  954   3HZ   LYS  33           HZ2      LYS  33 160.014  16.424  -0.077
  955    H    LEU  34           HN       LEU  34 153.658  13.004   3.309
  956    HA   LEU  34           HA       LEU  34 151.026  13.203   2.221
  957   1HB   LEU  34           HB2      LEU  34 152.332  11.039   3.893
  958   2HB   LEU  34           HB1      LEU  34 150.758  10.858   3.129
  959    HG   LEU  34           HG       LEU  34 153.232  11.622   1.561
  960   1HD1  LEU  34          HD11      LEU  34 152.111   8.856   2.101
  961   2HD1  LEU  34          HD13      LEU  34 153.372   9.221   0.923
  962   3HD1  LEU  34          HD12      LEU  34 153.673   9.472   2.642
  963   1HD2  LEU  34          HD23      LEU  34 150.443  10.651   0.871
  964   2HD2  LEU  34          HD22      LEU  34 151.303  12.058   0.249
  965   3HD2  LEU  34          HD21      LEU  34 151.778  10.443  -0.260
  966    H    GLU  35           HN       GLU  35 152.196  13.077   5.547
  967    HA   GLU  35           HA       GLU  35 149.643  12.867   6.816
  968   1HB   GLU  35           HB2      GLU  35 152.211  14.167   7.775
  969   2HB   GLU  35           HB1      GLU  35 150.797  13.899   8.799
  970   1HG   GLU  35           HG2      GLU  35 150.921  11.489   8.388
  971   2HG   GLU  35           HG1      GLU  35 152.300  11.724   7.320
  972    H    GLU  36           HN       GLU  36 151.463  15.720   5.734
  973    HA   GLU  36           HA       GLU  36 149.600  17.646   6.811
  974   1HB   GLU  36           HB2      GLU  36 151.650  17.821   4.585
  975   2HB   GLU  36           HB1      GLU  36 150.721  19.204   5.167
  976   1HG   GLU  36           HG2      GLU  36 151.610  18.850   7.441
  977   2HG   GLU  36           HG1      GLU  36 152.542  17.470   6.862
  978    H    ARG  37           HN       ARG  37 149.610  15.607   4.052
  979    HA   ARG  37           HA       ARG  37 147.634  17.226   2.570
  980   1HB   ARG  37           HB2      ARG  37 148.984  14.572   2.059
  981   2HB   ARG  37           HB1      ARG  37 147.703  15.180   1.016
  982   1HG   ARG  37           HG2      ARG  37 150.071  16.935   1.665
  983   2HG   ARG  37           HG1      ARG  37 150.220  15.693   0.425
  984   1HD   ARG  37           HD2      ARG  37 148.191  17.954   0.464
  985   2HD   ARG  37           HD1      ARG  37 149.568  17.795  -0.624
  986    HE   ARG  37           HE       ARG  37 148.142  15.461  -1.038
  987   1HH1  ARG  37          HH21      ARG  37 147.471  18.843  -1.058
  988   2HH1  ARG  37          HH22      ARG  37 146.208  18.720  -2.237
  989   1HH2  ARG  37          HH11      ARG  37 146.497  15.279  -2.572
  990   2HH2  ARG  37          HH12      ARG  37 145.656  16.701  -3.095
  991    H    GLY  38           HN       GLY  38 147.425  15.225   5.194
  992   1HA   GLY  38           HA2      GLY  38 145.276  14.733   6.196
  993   2HA   GLY  38           HA1      GLY  38 144.554  14.660   4.592
  994    H    PHE  39           HN       PHE  39 147.509  13.040   5.686
  995    HA   PHE  39           HA       PHE  39 146.111  10.399   5.523
  996   1HB   PHE  39           HB2      PHE  39 148.774  11.141   4.270
  997   2HB   PHE  39           HB1      PHE  39 148.167   9.491   4.406
  998    HD1  PHE  39           HD2      PHE  39 146.235   8.744   3.095
  999    HD2  PHE  39           HD1      PHE  39 147.755  12.736   2.746
 1000    HE1  PHE  39           HE2      PHE  39 144.885   9.076   1.041
 1001    HE2  PHE  39           HE1      PHE  39 146.406  13.077   0.692
 1002    HZ   PHE  39           HZ       PHE  39 144.968  11.241  -0.163
 1003    H    ASP  40           HN       ASP  40 146.191  10.992   7.920
 1004    HA   ASP  40           HA       ASP  40 148.797  11.002   9.206
 1005   1HB   ASP  40           HB2      ASP  40 147.488  11.012  11.294
 1006   2HB   ASP  40           HB1      ASP  40 146.866  12.208  10.155
 1007    H    LYS  41           HN       LYS  41 146.665   8.516   8.100
 1008    HA   LYS  41           HA       LYS  41 148.258   6.494   9.643
 1009   1HB   LYS  41           HB2      LYS  41 145.285   6.379   9.059
 1010   2HB   LYS  41           HB1      LYS  41 146.224   5.121   9.858
 1011   1HG   LYS  41           HG2      LYS  41 146.011   7.958  10.903
 1012   2HG   LYS  41           HG1      LYS  41 144.950   6.653  11.427
 1013   1HD   LYS  41           HD2      LYS  41 147.148   5.370  11.973
 1014   2HD   LYS  41           HD1      LYS  41 147.924   6.949  11.863
 1015   1HE   LYS  41           HE2      LYS  41 146.366   7.834  13.562
 1016   2HE   LYS  41           HE1      LYS  41 145.614   6.245  13.692
 1017   1HZ   LYS  41           HZ1      LYS  41 148.248   5.707  13.989
 1018   2HZ   LYS  41           HZ3      LYS  41 148.094   7.194  14.790
 1019   3HZ   LYS  41           HZ2      LYS  41 147.133   5.874  15.260
 1020    H    ALA  42           HN       ALA  42 148.591   4.508   8.578
 1021    HA   ALA  42           HA       ALA  42 149.065   4.679   5.773
 1022   1HB   ALA  42           HB2      ALA  42 148.848   2.245   7.560
 1023   2HB   ALA  42           HB1      ALA  42 149.535   2.249   5.936
 1024   3HB   ALA  42           HB3      ALA  42 150.316   3.165   7.225
 1025    H    TYR  43           HN       TYR  43 146.391   3.098   7.544
 1026    HA   TYR  43           HA       TYR  43 145.264   1.786   5.304
 1027   1HB   TYR  43           HB2      TYR  43 143.178   1.647   6.557
 1028   2HB   TYR  43           HB1      TYR  43 144.548   1.319   7.612
 1029    HD1  TYR  43           HD1      TYR  43 142.171   3.977   6.549
 1030    HD2  TYR  43           HD2      TYR  43 144.934   2.632   9.543
 1031    HE1  TYR  43           HE1      TYR  43 141.419   5.789   8.054
 1032    HE2  TYR  43           HE2      TYR  43 144.184   4.453  11.055
 1033    HH   TYR  43           HH       TYR  43 141.385   6.166  10.610
 1034    H    VAL  44           HN       VAL  44 145.296   5.183   5.961
 1035    HA   VAL  44           HA       VAL  44 142.925   5.768   4.329
 1036    HB   VAL  44           HB       VAL  44 145.196   7.588   5.216
 1037   1HG1  VAL  44          HG13      VAL  44 143.923   8.442   3.252
 1038   2HG1  VAL  44          HG12      VAL  44 142.426   8.249   4.163
 1039   3HG1  VAL  44          HG11      VAL  44 143.638   9.413   4.694
 1040   1HG2  VAL  44          HG22      VAL  44 142.443   7.058   6.376
 1041   2HG2  VAL  44          HG21      VAL  44 143.991   6.673   7.127
 1042   3HG2  VAL  44          HG23      VAL  44 143.516   8.355   6.905
 1043    H    VAL  45           HN       VAL  45 146.331   5.408   3.937
 1044    HA   VAL  45           HA       VAL  45 146.439   6.424   1.184
 1045    HB   VAL  45           HB       VAL  45 148.419   4.775   2.792
 1046   1HG1  VAL  45          HG13      VAL  45 148.579   6.013   0.036
 1047   2HG1  VAL  45          HG12      VAL  45 150.012   5.574   0.964
 1048   3HG1  VAL  45          HG11      VAL  45 148.858   4.331   0.481
 1049   1HG2  VAL  45          HG22      VAL  45 148.196   7.719   2.110
 1050   2HG2  VAL  45          HG21      VAL  45 148.189   6.987   3.715
 1051   3HG2  VAL  45          HG23      VAL  45 149.667   6.986   2.752
 1052    H    LEU  46           HN       LEU  46 146.108   3.319   2.813
 1053    HA   LEU  46           HA       LEU  46 146.395   1.603   0.548
 1054   1HB   LEU  46           HB2      LEU  46 146.273   0.793   2.906
 1055   2HB   LEU  46           HB1      LEU  46 144.588   1.296   2.977
 1056    HG   LEU  46           HG       LEU  46 144.145  -0.258   1.013
 1057   1HD1  LEU  46          HD12      LEU  46 147.028  -0.918   1.555
 1058   2HD1  LEU  46          HD11      LEU  46 145.942  -2.153   0.924
 1059   3HD1  LEU  46          HD13      LEU  46 146.210  -0.669   0.012
 1060   1HD2  LEU  46          HD23      LEU  46 144.624  -0.945   3.825
 1061   2HD2  LEU  46          HD22      LEU  46 143.317  -1.435   2.755
 1062   3HD2  LEU  46          HD21      LEU  46 144.824  -2.342   2.763
 1063    H    GLY  47           HN       GLY  47 143.680   3.409   1.883
 1064   1HA   GLY  47           HA2      GLY  47 141.616   2.421   0.187
 1065   2HA   GLY  47           HA1      GLY  47 141.599   4.000   0.972
 1066    H    GLN  48           HN       GLN  48 143.909   5.129  -0.268
 1067    HA   GLN  48           HA       GLN  48 142.796   6.109  -2.703
 1068   1HB   GLN  48           HB2      GLN  48 144.521   7.310  -1.387
 1069   2HB   GLN  48           HB1      GLN  48 145.697   6.062  -1.795
 1070   1HG   GLN  48           HG2      GLN  48 145.963   8.011  -3.270
 1071   2HG   GLN  48           HG1      GLN  48 145.432   6.610  -4.197
 1072   1HE2  GLN  48          HE22      GLN  48 142.661   8.378  -5.430
 1073   2HE2  GLN  48          HE21      GLN  48 143.875   7.221  -5.696
 1074    H    PHE  49           HN       PHE  49 145.242   3.611  -2.061
 1075    HA   PHE  49           HA       PHE  49 145.873   2.955  -4.765
 1076   1HB   PHE  49           HB2      PHE  49 147.167   2.163  -2.811
 1077   2HB   PHE  49           HB1      PHE  49 145.800   1.175  -2.304
 1078    HD1  PHE  49           HD1      PHE  49 147.980   1.775  -5.303
 1079    HD2  PHE  49           HD2      PHE  49 145.716  -1.059  -2.999
 1080    HE1  PHE  49           HE1      PHE  49 148.792  -0.060  -6.760
 1081    HE2  PHE  49           HE2      PHE  49 146.527  -2.891  -4.455
 1082    HZ   PHE  49           HZ       PHE  49 148.064  -2.393  -6.339
 1083    H    LEU  50           HN       LEU  50 143.354   1.831  -2.575
 1084    HA   LEU  50           HA       LEU  50 142.270  -0.144  -4.395
 1085   1HB   LEU  50           HB2      LEU  50 141.034   1.321  -2.046
 1086   2HB   LEU  50           HB1      LEU  50 140.215   0.030  -2.921
 1087    HG   LEU  50           HG       LEU  50 142.929  -0.267  -1.597
 1088   1HD1  LEU  50          HD12      LEU  50 140.173  -1.088  -0.632
 1089   2HD1  LEU  50          HD11      LEU  50 141.688  -1.583   0.122
 1090   3HD1  LEU  50          HD13      LEU  50 141.225   0.118   0.107
 1091   1HD2  LEU  50          HD23      LEU  50 141.105  -2.106  -3.135
 1092   2HD2  LEU  50          HD22      LEU  50 142.864  -1.987  -3.172
 1093   3HD2  LEU  50          HD21      LEU  50 142.069  -2.779  -1.821
 1094    H    VAL  51           HN       VAL  51 141.600   3.275  -3.806
 1095    HA   VAL  51           HA       VAL  51 139.319   3.495  -5.510
 1096    HB   VAL  51           HB       VAL  51 141.397   5.519  -4.635
 1097   1HG1  VAL  51          HG13      VAL  51 138.859   5.879  -6.246
 1098   2HG1  VAL  51          HG12      VAL  51 139.607   7.197  -5.345
 1099   3HG1  VAL  51          HG11      VAL  51 140.486   6.419  -6.660
 1100   1HG2  VAL  51          HG22      VAL  51 139.766   4.390  -2.984
 1101   2HG2  VAL  51          HG21      VAL  51 139.802   6.153  -2.996
 1102   3HG2  VAL  51          HG23      VAL  51 138.496   5.292  -3.811
 1103    H    LEU  52           HN       LEU  52 142.767   3.469  -6.207
 1104    HA   LEU  52           HA       LEU  52 142.331   4.382  -8.991
 1105   1HB   LEU  52           HB2      LEU  52 144.846   3.420  -7.598
 1106   2HB   LEU  52           HB1      LEU  52 144.779   4.090  -9.225
 1107    HG   LEU  52           HG       LEU  52 143.978   5.548  -6.685
 1108   1HD1  LEU  52          HD11      LEU  52 146.473   5.067  -7.152
 1109   2HD1  LEU  52          HD13      LEU  52 146.297   6.167  -8.521
 1110   3HD1  LEU  52          HD12      LEU  52 146.017   6.749  -6.881
 1111   1HD2  LEU  52          HD23      LEU  52 143.843   6.239  -9.620
 1112   2HD2  LEU  52          HD22      LEU  52 142.667   6.565  -8.346
 1113   3HD2  LEU  52          HD21      LEU  52 144.140   7.522  -8.446
 1114    H    LYS  53           HN       LYS  53 141.451   1.612  -7.731
 1115    HA   LYS  53           HA       LYS  53 141.392  -0.619  -8.487
 1116   1HB   LYS  53           HB2      LYS  53 141.645   0.936 -11.078
 1117   2HB   LYS  53           HB1      LYS  53 141.177  -0.763 -10.980
 1118   1HG   LYS  53           HG2      LYS  53 139.248  -0.153  -9.566
 1119   2HG   LYS  53           HG1      LYS  53 139.710   1.547  -9.665
 1120   1HD   LYS  53           HD2      LYS  53 139.436   1.480 -12.116
 1121   2HD   LYS  53           HD1      LYS  53 138.968  -0.218 -12.017
 1122   1HE   LYS  53           HE2      LYS  53 137.059   0.424 -10.551
 1123   2HE   LYS  53           HE1      LYS  53 137.503   2.119 -10.759
 1124   1HZ   LYS  53           HZ3      LYS  53 137.012   0.366 -13.083
 1125   2HZ   LYS  53           HZ2      LYS  53 135.733   1.160 -12.295
 1126   3HZ   LYS  53           HZ1      LYS  53 136.983   2.061 -13.009
 1127    H    LYS  54           HN       LYS  54 144.024   0.300  -7.729
 1128    HA   LYS  54           HA       LYS  54 146.253  -0.404  -7.832
 1129   1HB   LYS  54           HB2      LYS  54 145.214  -2.593  -9.652
 1130   2HB   LYS  54           HB1      LYS  54 146.668  -2.625  -8.658
 1131   1HG   LYS  54           HG2      LYS  54 145.198  -2.346  -6.631
 1132   2HG   LYS  54           HG1      LYS  54 143.801  -2.555  -7.687
 1133   1HD   LYS  54           HD2      LYS  54 144.820  -4.753  -8.433
 1134   2HD   LYS  54           HD1      LYS  54 146.006  -4.555  -7.141
 1135   1HE   LYS  54           HE2      LYS  54 143.001  -4.788  -6.849
 1136   2HE   LYS  54           HE1      LYS  54 144.222  -5.919  -6.263
 1137   1HZ   LYS  54           HZ2      LYS  54 145.077  -3.795  -5.034
 1138   2HZ   LYS  54           HZ1      LYS  54 143.467  -3.287  -5.218
 1139   3HZ   LYS  54           HZ3      LYS  54 143.811  -4.721  -4.382
 1140    H    ASP  55           HN       ASP  55 144.980   1.318 -10.111
 1141    HA   ASP  55           HA       ASP  55 146.477   0.665 -12.496
 1142   1HB   ASP  55           HB2      ASP  55 144.538   2.149 -12.599
 1143   2HB   ASP  55           HB1      ASP  55 145.330   3.299 -11.528
 1144    H    GLU  56           HN       GLU  56 148.674   0.600 -12.494
 1145    HA   GLU  56           HA       GLU  56 150.347   1.775 -10.526
 1146   1HB   GLU  56           HB2      GLU  56 150.954  -0.187 -11.876
 1147   2HB   GLU  56           HB1      GLU  56 151.037   0.826 -13.315
 1148   1HG   GLU  56           HG2      GLU  56 152.867   2.122 -12.352
 1149   2HG   GLU  56           HG1      GLU  56 152.736   1.230 -10.834
 1150    H    ASP  57           HN       ASP  57 149.601   2.949 -13.835
 1151    HA   ASP  57           HA       ASP  57 151.516   5.103 -13.730
 1152   1HB   ASP  57           HB2      ASP  57 149.026   4.675 -15.401
 1153   2HB   ASP  57           HB1      ASP  57 150.120   6.040 -15.630
 1154    H    LEU  58           HN       LEU  58 148.088   4.905 -12.950
 1155    HA   LEU  58           HA       LEU  58 147.849   7.751 -12.386
 1156   1HB   LEU  58           HB2      LEU  58 146.133   5.432 -11.470
 1157   2HB   LEU  58           HB1      LEU  58 145.727   7.124 -11.221
 1158    HG   LEU  58           HG       LEU  58 146.212   5.866 -13.939
 1159   1HD1  LEU  58          HD12      LEU  58 144.172   5.016 -12.711
 1160   2HD1  LEU  58          HD11      LEU  58 143.572   6.674 -12.688
 1161   3HD1  LEU  58          HD13      LEU  58 143.815   5.846 -14.227
 1162   1HD2  LEU  58          HD22      LEU  58 145.508   8.632 -12.977
 1163   2HD2  LEU  58          HD21      LEU  58 146.584   8.140 -14.284
 1164   3HD2  LEU  58          HD23      LEU  58 144.840   8.078 -14.512
 1165    H    PHE  59           HN       PHE  59 148.565   4.887 -10.448
 1166    HA   PHE  59           HA       PHE  59 148.551   6.205  -7.902
 1167   1HB   PHE  59           HB2      PHE  59 148.506   3.764  -8.078
 1168   2HB   PHE  59           HB1      PHE  59 150.100   3.770  -8.833
 1169    HD1  PHE  59           HD1      PHE  59 148.344   4.991  -5.746
 1170    HD2  PHE  59           HD2      PHE  59 151.999   3.533  -7.474
 1171    HE1  PHE  59           HE1      PHE  59 149.397   4.963  -3.500
 1172    HE2  PHE  59           HE2      PHE  59 153.051   3.509  -5.229
 1173    HZ   PHE  59           HZ       PHE  59 151.750   4.223  -3.241
 1174    H    ARG  60           HN       ARG  60 151.230   5.497 -10.178
 1175    HA   ARG  60           HA       ARG  60 153.285   6.683  -8.617
 1176   1HB   ARG  60           HB2      ARG  60 153.010   6.379 -11.613
 1177   2HB   ARG  60           HB1      ARG  60 154.470   6.991 -10.839
 1178   1HG   ARG  60           HG2      ARG  60 154.636   4.899  -9.527
 1179   2HG   ARG  60           HG1      ARG  60 153.206   4.280 -10.343
 1180   1HD   ARG  60           HD2      ARG  60 155.843   5.026 -11.635
 1181   2HD   ARG  60           HD1      ARG  60 155.177   3.403 -11.466
 1182    HE   ARG  60           HE       ARG  60 153.229   4.808 -12.869
 1183   1HH1  ARG  60          HH21      ARG  60 156.593   4.116 -13.184
 1184   2HH1  ARG  60          HH22      ARG  60 156.587   4.219 -14.914
 1185   1HH2  ARG  60          HH11      ARG  60 153.208   4.958 -15.125
 1186   2HH2  ARG  60          HH12      ARG  60 154.672   4.697 -16.011
 1187    H    GLU  61           HN       GLU  61 151.263   8.183 -11.181
 1188    HA   GLU  61           HA       GLU  61 152.522  10.742 -11.013
 1189   1HB   GLU  61           HB2      GLU  61 151.020  10.018 -12.872
 1190   2HB   GLU  61           HB1      GLU  61 149.653  10.083 -11.761
 1191   1HG   GLU  61           HG2      GLU  61 149.707  12.149 -13.025
 1192   2HG   GLU  61           HG1      GLU  61 150.175  12.512 -11.365
 1193    H    TRP  62           HN       TRP  62 149.826   9.263  -9.236
 1194    HA   TRP  62           HA       TRP  62 149.002  11.609  -7.844
 1195   1HB   TRP  62           HB2      TRP  62 147.550   9.703  -7.823
 1196   2HB   TRP  62           HB1      TRP  62 148.810   8.671  -7.148
 1197    HD1  TRP  62           HD1      TRP  62 146.435  11.528  -6.171
 1198    HE1  TRP  62           HE1      TRP  62 146.269  11.611  -3.599
 1199    HE3  TRP  62           HE3      TRP  62 149.975   8.063  -4.953
 1200    HZ2  TRP  62           HZ2      TRP  62 147.505  10.374  -1.315
 1201    HZ3  TRP  62           HZ3      TRP  62 150.460   7.530  -2.584
 1202    HH2  TRP  62           HH2      TRP  62 149.231   8.680  -0.765
 1203    H    LEU  63           HN       LEU  63 151.305   9.052  -6.823
 1204    HA   LEU  63           HA       LEU  63 151.847  10.318  -4.300
 1205   1HB   LEU  63           HB2      LEU  63 152.262   7.923  -4.674
 1206   2HB   LEU  63           HB1      LEU  63 153.497   8.314  -5.863
 1207    HG   LEU  63           HG       LEU  63 154.831   9.434  -4.123
 1208   1HD1  LEU  63          HD11      LEU  63 152.418   8.789  -2.438
 1209   2HD1  LEU  63          HD13      LEU  63 154.008   8.903  -1.686
 1210   3HD1  LEU  63          HD12      LEU  63 153.336  10.291  -2.532
 1211   1HD2  LEU  63          HD21      LEU  63 153.898   6.609  -3.577
 1212   2HD2  LEU  63          HD23      LEU  63 155.349   7.126  -4.438
 1213   3HD2  LEU  63          HD22      LEU  63 155.235   7.347  -2.691
 1214    H    LYS  64           HN       LYS  64 153.672  10.279  -7.359
 1215    HA   LYS  64           HA       LYS  64 155.827  11.916  -6.427
 1216   1HB   LYS  64           HB2      LYS  64 155.880  10.615  -8.559
 1217   2HB   LYS  64           HB1      LYS  64 154.743  11.771  -9.253
 1218   1HG   LYS  64           HG2      LYS  64 156.352  13.603  -8.849
 1219   2HG   LYS  64           HG1      LYS  64 157.491  12.449  -8.156
 1220   1HD   LYS  64           HD2      LYS  64 157.552  11.229 -10.304
 1221   2HD   LYS  64           HD1      LYS  64 156.432  12.402 -10.996
 1222   1HE   LYS  64           HE2      LYS  64 159.160  13.077  -9.856
 1223   2HE   LYS  64           HE1      LYS  64 158.797  12.919 -11.573
 1224   1HZ   LYS  64           HZ3      LYS  64 156.892  14.623 -10.483
 1225   2HZ   LYS  64           HZ2      LYS  64 158.398  15.138  -9.888
 1226   3HZ   LYS  64           HZ1      LYS  64 158.139  15.016 -11.563
 1227    H    ASP  65           HN       ASP  65 152.841  12.781  -8.143
 1228    HA   ASP  65           HA       ASP  65 153.361  15.610  -8.138
 1229   1HB   ASP  65           HB2      ASP  65 151.719  14.379  -9.630
 1230   2HB   ASP  65           HB1      ASP  65 150.650  14.266  -8.232
 1231    H    THR  66           HN       THR  66 151.955  13.405  -5.804
 1232    HA   THR  66           HA       THR  66 150.750  15.510  -4.205
 1233    HB   THR  66           HB       THR  66 151.292  12.584  -3.645
 1234    HG1  THR  66           HG1      THR  66 149.144  14.125  -4.582
 1235   1HG2  THR  66          HG23      THR  66 149.879  14.700  -2.008
 1236   2HG2  THR  66          HG22      THR  66 149.605  12.974  -1.778
 1237   3HG2  THR  66          HG21      THR  66 151.209  13.656  -1.504
 1238    H    CYS  67           HN       CYS  67 153.868  13.743  -4.073
 1239    HA   CYS  67           HA       CYS  67 154.661  15.614  -1.852
 1240   1HB   CYS  67           HB2      CYS  67 155.812  13.819  -0.739
 1241   2HB   CYS  67           HB1      CYS  67 154.161  13.284  -1.055
 1242    HG   CYS  67           HG       CYS  67 155.506  11.343  -1.986
 1243    H    GLY  68           HN       GLY  68 155.724  13.742  -4.663
 1244   1HA   GLY  68           HA2      GLY  68 157.424  14.774  -6.140
 1245   2HA   GLY  68           HA1      GLY  68 158.241  15.384  -4.702
 1246    H    ALA  69           HN       ALA  69 156.973  12.193  -4.408
 1247    HA   ALA  69           HA       ALA  69 159.423  10.981  -3.766
 1248   1HB   ALA  69           HB1      ALA  69 156.988   9.690  -5.038
 1249   2HB   ALA  69           HB3      ALA  69 158.283   8.829  -4.205
 1250   3HB   ALA  69           HB2      ALA  69 157.238   9.933  -3.310
 1251    H    ASN  70           HN       ASN  70 160.852   9.587  -5.008
 1252    HA   ASN  70           HA       ASN  70 161.072  10.439  -7.835
 1253   1HB   ASN  70           HB2      ASN  70 162.927   8.779  -6.102
 1254   2HB   ASN  70           HB1      ASN  70 163.287   9.357  -7.729
 1255   1HD2  ASN  70          HD22      ASN  70 163.347  12.857  -6.571
 1256   2HD2  ASN  70          HD21      ASN  70 162.610  11.958  -7.808
 1257    H    ALA  71           HN       ALA  71 161.841   8.633  -9.365
 1258    HA   ALA  71           HA       ALA  71 159.753   6.748  -9.712
 1259   1HB   ALA  71           HB2      ALA  71 162.560   6.744 -10.846
 1260   2HB   ALA  71           HB1      ALA  71 161.239   5.734 -11.429
 1261   3HB   ALA  71           HB3      ALA  71 161.137   7.488 -11.575
 1262    H    LYS  72           HN       LYS  72 162.920   6.351  -8.107
 1263    HA   LYS  72           HA       LYS  72 162.657   3.468  -7.944
 1264   1HB   LYS  72           HB2      LYS  72 164.375   5.435  -6.409
 1265   2HB   LYS  72           HB1      LYS  72 164.476   3.684  -6.200
 1266   1HG   LYS  72           HG2      LYS  72 164.968   3.423  -8.604
 1267   2HG   LYS  72           HG1      LYS  72 164.870   5.171  -8.814
 1268   1HD   LYS  72           HD2      LYS  72 166.744   5.468  -7.236
 1269   2HD   LYS  72           HD1      LYS  72 166.844   3.718  -7.028
 1270   1HE   LYS  72           HE2      LYS  72 167.139   3.590  -9.576
 1271   2HE   LYS  72           HE1      LYS  72 167.412   5.332  -9.519
 1272   1HZ   LYS  72           HZ3      LYS  72 168.967   4.261  -7.514
 1273   2HZ   LYS  72           HZ2      LYS  72 169.179   3.221  -8.841
 1274   3HZ   LYS  72           HZ1      LYS  72 169.503   4.881  -8.999
 1275    H    GLN  73           HN       GLN  73 161.885   6.140  -5.757
 1276    HA   GLN  73           HA       GLN  73 161.146   4.515  -3.515
 1277   1HB   GLN  73           HB2      GLN  73 160.359   7.326  -4.331
 1278   2HB   GLN  73           HB1      GLN  73 159.907   6.600  -2.789
 1279   1HG   GLN  73           HG2      GLN  73 162.765   6.873  -3.766
 1280   2HG   GLN  73           HG1      GLN  73 161.985   8.004  -2.660
 1281   1HE2  GLN  73          HE22      GLN  73 161.679   5.321  -0.106
 1282   2HE2  GLN  73          HE21      GLN  73 160.615   6.376  -0.903
 1283    H    SER  74           HN       SER  74 159.307   5.779  -6.267
 1284    HA   SER  74           HA       SER  74 156.741   4.991  -5.268
 1285   1HB   SER  74           HB2      SER  74 157.260   6.592  -7.205
 1286   2HB   SER  74           HB1      SER  74 157.491   5.149  -8.190
 1287    HG   SER  74           HG       SER  74 155.264   4.815  -6.823
 1288    H    ARG  75           HN       ARG  75 159.198   3.288  -7.209
 1289    HA   ARG  75           HA       ARG  75 157.613   1.046  -7.939
 1290   1HB   ARG  75           HB2      ARG  75 160.586   1.266  -7.362
 1291   2HB   ARG  75           HB1      ARG  75 159.832  -0.157  -8.074
 1292   1HG   ARG  75           HG2      ARG  75 159.441   2.557  -9.323
 1293   2HG   ARG  75           HG1      ARG  75 160.897   1.628  -9.658
 1294   1HD   ARG  75           HD2      ARG  75 159.539  -0.237 -10.496
 1295   2HD   ARG  75           HD1      ARG  75 158.061   0.640 -10.114
 1296    HE   ARG  75           HE       ARG  75 159.476   2.372 -11.761
 1297   1HH1  ARG  75          HH21      ARG  75 158.349  -0.883 -11.885
 1298   2HH1  ARG  75          HH22      ARG  75 158.160  -0.890 -13.606
 1299   1HH2  ARG  75          HH11      ARG  75 159.238   2.383 -14.002
 1300   2HH2  ARG  75          HH12      ARG  75 158.664   0.959 -14.807
 1301    H    ASP  76           HN       ASP  76 159.503   1.690  -4.981
 1302    HA   ASP  76           HA       ASP  76 159.150  -0.913  -3.862
 1303   1HB   ASP  76           HB2      ASP  76 159.676   1.785  -2.597
 1304   2HB   ASP  76           HB1      ASP  76 159.670   0.276  -1.683
 1305    H    CYS  77           HN       CYS  77 157.176   2.053  -3.563
 1306    HA   CYS  77           HA       CYS  77 155.411   0.946  -1.579
 1307   1HB   CYS  77           HB2      CYS  77 155.080   3.196  -3.581
 1308   2HB   CYS  77           HB1      CYS  77 153.866   2.794  -2.367
 1309    HG   CYS  77           HG       CYS  77 155.946   4.611  -1.701
 1310    H    PHE  78           HN       PHE  78 155.303   1.021  -5.159
 1311    HA   PHE  78           HA       PHE  78 152.666   0.019  -5.439
 1312   1HB   PHE  78           HB2      PHE  78 153.990   0.868  -7.332
 1313   2HB   PHE  78           HB1      PHE  78 155.083  -0.509  -7.190
 1314    HD1  PHE  78           HD2      PHE  78 154.378  -2.760  -7.820
 1315    HD2  PHE  78           HD1      PHE  78 151.708   0.587  -8.175
 1316    HE1  PHE  78           HE2      PHE  78 152.856  -4.123  -9.226
 1317    HE2  PHE  78           HE1      PHE  78 150.186  -0.777  -9.580
 1318    HZ   PHE  78           HZ       PHE  78 150.761  -3.132 -10.107
 1319    H    GLY  79           HN       GLY  79 155.684  -1.899  -5.684
 1320   1HA   GLY  79           HA2      GLY  79 154.376  -4.420  -5.605
 1321   2HA   GLY  79           HA1      GLY  79 156.075  -4.157  -5.221
 1322    H    CYS  80           HN       CYS  80 155.479  -2.300  -3.015
 1323    HA   CYS  80           HA       CYS  80 155.231  -4.276  -0.914
 1324   1HB   CYS  80           HB2      CYS  80 156.536  -2.182  -0.647
 1325   2HB   CYS  80           HB1      CYS  80 155.037  -1.256  -0.726
 1326    HG   CYS  80           HG       CYS  80 156.046  -2.314   1.782
 1327    H    LEU  81           HN       LEU  81 153.037  -1.658  -2.042
 1328    HA   LEU  81           HA       LEU  81 150.917  -2.456  -0.246
 1329   1HB   LEU  81           HB2      LEU  81 150.836  -0.846  -2.816
 1330   2HB   LEU  81           HB1      LEU  81 149.504  -0.984  -1.671
 1331    HG   LEU  81           HG       LEU  81 152.253   0.069  -0.941
 1332   1HD1  LEU  81          HD11      LEU  81 151.086   1.498  -2.626
 1333   2HD1  LEU  81          HD13      LEU  81 149.718   1.631  -1.520
 1334   3HD1  LEU  81          HD12      LEU  81 151.286   2.302  -1.069
 1335   1HD2  LEU  81          HD22      LEU  81 149.616  -0.209   0.505
 1336   2HD2  LEU  81          HD21      LEU  81 151.242  -0.588   1.075
 1337   3HD2  LEU  81          HD23      LEU  81 150.720   1.089   0.949
 1338    H    ARG  82           HN       ARG  82 151.707  -3.189  -3.638
 1339    HA   ARG  82           HA       ARG  82 149.314  -4.626  -4.239
 1340   1HB   ARG  82           HB2      ARG  82 150.914  -3.930  -5.984
 1341   2HB   ARG  82           HB1      ARG  82 152.108  -5.057  -5.341
 1342   1HG   ARG  82           HG2      ARG  82 150.603  -6.949  -5.824
 1343   2HG   ARG  82           HG1      ARG  82 149.383  -5.831  -6.432
 1344   1HD   ARG  82           HD2      ARG  82 150.941  -5.088  -8.196
 1345   2HD   ARG  82           HD1      ARG  82 152.166  -6.200  -7.585
 1346    HE   ARG  82           HE       ARG  82 149.968  -7.825  -8.071
 1347   1HH1  ARG  82          HH21      ARG  82 151.808  -5.508  -9.846
 1348   2HH1  ARG  82          HH22      ARG  82 151.563  -6.288 -11.372
 1349   1HH2  ARG  82          HH11      ARG  82 149.640  -8.854 -10.053
 1350   2HH2  ARG  82          HH12      ARG  82 150.335  -8.182 -11.490
 1351    H    GLU  83           HN       GLU  83 152.386  -5.677  -2.782
 1352    HA   GLU  83           HA       GLU  83 151.683  -8.463  -2.701
 1353   1HB   GLU  83           HB2      GLU  83 153.725  -6.802  -1.214
 1354   2HB   GLU  83           HB1      GLU  83 153.552  -8.540  -0.961
 1355   1HG   GLU  83           HG2      GLU  83 153.927  -7.340  -3.711
 1356   2HG   GLU  83           HG1      GLU  83 155.288  -7.830  -2.701
 1357    H    TRP  84           HN       TRP  84 151.295  -5.812  -0.317
 1358    HA   TRP  84           HA       TRP  84 150.431  -7.461   1.847
 1359   1HB   TRP  84           HB2      TRP  84 151.025  -5.006   1.990
 1360   2HB   TRP  84           HB1      TRP  84 149.476  -4.650   1.225
 1361    HD1  TRP  84           HD1      TRP  84 151.027  -5.818   4.480
 1362    HE1  TRP  84           HE1      TRP  84 149.210  -5.873   6.314
 1363    HE3  TRP  84           HE3      TRP  84 146.864  -4.992   1.636
 1364    HZ2  TRP  84           HZ2      TRP  84 146.380  -5.608   6.542
 1365    HZ3  TRP  84           HZ3      TRP  84 144.622  -4.898   2.689
 1366    HH2  TRP  84           HH2      TRP  84 144.374  -5.204   5.138
 1367    H    CYS  85           HN       CYS  85 148.666  -5.898  -0.808
 1368    HA   CYS  85           HA       CYS  85 146.037  -6.648  -0.005
 1369   1HB   CYS  85           HB2      CYS  85 147.228  -6.155  -2.745
 1370   2HB   CYS  85           HB1      CYS  85 145.506  -6.421  -2.474
 1371    HG   CYS  85           HG       CYS  85 147.102  -3.925  -1.529
 1372    H    ASP  86           HN       ASP  86 148.467  -8.342  -1.945
 1373    HA   ASP  86           HA       ASP  86 146.884 -10.539  -2.785
 1374   1HB   ASP  86           HB2      ASP  86 149.839 -10.328  -2.161
 1375   2HB   ASP  86           HB1      ASP  86 149.103 -11.758  -2.885
 1376    H    ALA  87           HN       ALA  87 148.487  -9.903   0.294
 1377    HA   ALA  87           HA       ALA  87 147.973 -12.638   1.265
 1378   1HB   ALA  87           HB3      ALA  87 149.995 -11.208   1.903
 1379   2HB   ALA  87           HB2      ALA  87 148.888 -10.269   2.906
 1380   3HB   ALA  87           HB1      ALA  87 149.140 -11.984   3.236
 1381    H    PHE  88           HN       PHE  88 146.627  -9.397   1.689
 1382    HA   PHE  88           HA       PHE  88 144.579 -10.516   3.570
 1383   1HB   PHE  88           HB2      PHE  88 145.471  -7.682   2.995
 1384   2HB   PHE  88           HB1      PHE  88 144.113  -8.089   4.041
 1385    HD1  PHE  88           HD2      PHE  88 144.481  -9.406   6.126
 1386    HD2  PHE  88           HD1      PHE  88 147.751  -7.990   3.723
 1387    HE1  PHE  88           HE2      PHE  88 146.039  -9.793   8.017
 1388    HE2  PHE  88           HE1      PHE  88 149.310  -8.380   5.615
 1389    HZ   PHE  88           HZ       PHE  88 148.450  -9.276   7.761
 1390    H    LEU  89           HN       LEU  89 144.167  -7.624   1.625
 1391    HA   LEU  89           HA       LEU  89 141.592  -8.661   0.645
 1392   1HB   LEU  89           HB2      LEU  89 141.586  -6.391   1.439
 1393   2HB   LEU  89           HB1      LEU  89 142.984  -5.977   0.451
 1394    HG   LEU  89           HG       LEU  89 141.696  -6.183  -1.584
 1395   1HD1  LEU  89          HD11      LEU  89 139.599  -7.340   0.261
 1396   2HD1  LEU  89          HD13      LEU  89 139.178  -6.693  -1.326
 1397   3HD1  LEU  89          HD12      LEU  89 140.288  -8.056  -1.196
 1398   1HD2  LEU  89          HD21      LEU  89 141.429  -4.121  -0.028
 1399   2HD2  LEU  89          HD23      LEU  89 140.249  -4.327  -1.323
 1400   3HD2  LEU  89          HD22      LEU  89 139.832  -4.773   0.333
   
  No H/Q in entry =        1400
  Start of MODEL    3
    1   1H    MET   1           HT1      MET   1 116.617  -5.958  11.499
    2   2H    MET   1           HT3      MET   1 115.095  -5.455  10.944
    3   3H    MET   1           HT2      MET   1 115.477  -5.338  12.595
    4    HA   MET   1           HA       MET   1 114.668  -7.350  12.954
    5   1HB   MET   1           HB2      MET   1 113.376  -6.671  10.783
    6   2HB   MET   1           HB1      MET   1 114.412  -7.852   9.986
    7   1HG   MET   1           HG2      MET   1 113.644  -9.587  11.585
    8   2HG   MET   1           HG1      MET   1 112.593  -8.399  12.353
    9   1HE   MET   1           HE1      MET   1 110.805 -10.056  12.117
   10   2HE   MET   1           HE3      MET   1 109.952 -10.507  10.634
   11   3HE   MET   1           HE2      MET   1 111.501 -11.250  11.024
   12    H    THR   2           HN       THR   2 115.122  -9.459  10.610
   13    HA   THR   2           HA       THR   2 117.698 -10.403  11.715
   14    HB   THR   2           HB       THR   2 117.204 -12.426  10.293
   15    HG1  THR   2           HG1      THR   2 115.679 -12.277   8.885
   16   1HG2  THR   2          HG23      THR   2 116.487 -12.233  12.671
   17   2HG2  THR   2          HG22      THR   2 114.950 -11.565  12.124
   18   3HG2  THR   2          HG21      THR   2 115.389 -13.221  11.709
   19    H    THR   3           HN       THR   3 119.593 -10.590  10.488
   20    HA   THR   3           HA       THR   3 119.763  -8.875   8.124
   21    HB   THR   3           HB       THR   3 122.158  -9.506   8.140
   22    HG1  THR   3           HG1      THR   3 122.868 -11.083   9.410
   23   1HG2  THR   3          HG23      THR   3 120.975  -8.818  10.847
   24   2HG2  THR   3          HG22      THR   3 122.680  -8.640  10.427
   25   3HG2  THR   3          HG21      THR   3 121.461  -7.680   9.589
   26    H    SER   4           HN       SER   4 120.493  -9.641   6.020
   27    HA   SER   4           HA       SER   4 119.245 -12.179   5.280
   28   1HB   SER   4           HB2      SER   4 119.812 -11.560   3.004
   29   2HB   SER   4           HB1      SER   4 119.206 -10.127   3.827
   30    HG   SER   4           HG       SER   4 121.951 -10.823   3.583
   31    H    GLN   5           HN       GLN   5 120.473 -13.819   4.026
   32    HA   GLN   5           HA       GLN   5 122.708 -14.816   5.468
   33   1HB   GLN   5           HB2      GLN   5 121.660 -15.443   2.698
   34   2HB   GLN   5           HB1      GLN   5 122.989 -16.334   3.444
   35   1HG   GLN   5           HG2      GLN   5 120.972 -17.560   3.912
   36   2HG   GLN   5           HG1      GLN   5 121.455 -16.775   5.415
   37   1HE2  GLN   5          HE22      GLN   5 118.172 -15.490   5.623
   38   2HE2  GLN   5          HE21      GLN   5 119.380 -16.439   6.346
   39    H    LYS   6           HN       LYS   6 122.570 -12.541   2.802
   40    HA   LYS   6           HA       LYS   6 125.209 -12.861   1.807
   41   1HB   LYS   6           HB2      LYS   6 123.371 -10.462   1.949
   42   2HB   LYS   6           HB1      LYS   6 124.916 -10.450   1.094
   43   1HG   LYS   6           HG2      LYS   6 124.199 -12.192  -0.401
   44   2HG   LYS   6           HG1      LYS   6 122.753 -12.497   0.559
   45   1HD   LYS   6           HD2      LYS   6 122.086 -11.189  -1.357
   46   2HD   LYS   6           HD1      LYS   6 122.014 -10.140   0.058
   47   1HE   LYS   6           HE2      LYS   6 124.023  -9.023  -0.530
   48   2HE   LYS   6           HE1      LYS   6 124.476 -10.272  -1.690
   49   1HZ   LYS   6           HZ3      LYS   6 121.957  -8.809  -2.060
   50   2HZ   LYS   6           HZ2      LYS   6 123.418  -8.063  -2.502
   51   3HZ   LYS   6           HZ1      LYS   6 122.961  -9.534  -3.219
   52    H    HIS   7           HN       HIS   7 123.933 -11.002   4.544
   53    HA   HIS   7           HA       HIS   7 126.274  -9.497   5.088
   54   1HB   HIS   7           HB2      HIS   7 124.193  -8.954   6.195
   55   2HB   HIS   7           HB1      HIS   7 124.121 -10.548   6.942
   56    HD2  HIS   7           HD2      HIS   7 125.761 -10.871   9.225
   57    HE1  HIS   7           HE1      HIS   7 127.237  -6.917   9.317
   58    HE2  HIS   7           HE2      HIS   7 127.118  -9.108  10.586
   59    H    ARG   8           HN       ARG   8 125.286 -12.650   6.485
   60    HA   ARG   8           HA       ARG   8 127.725 -12.985   7.967
   61   1HB   ARG   8           HB2      ARG   8 125.575 -14.923   7.076
   62   2HB   ARG   8           HB1      ARG   8 126.933 -15.389   8.103
   63   1HG   ARG   8           HG2      ARG   8 126.269 -13.697   9.765
   64   2HG   ARG   8           HG1      ARG   8 124.914 -13.219   8.741
   65   1HD   ARG   8           HD2      ARG   8 124.100 -14.754  10.445
   66   2HD   ARG   8           HD1      ARG   8 124.047 -15.561   8.878
   67    HE   ARG   8           HE       ARG   8 126.519 -16.277   9.892
   68   1HH1  ARG   8          HH21      ARG   8 123.259 -16.329  11.015
   69   2HH1  ARG   8          HH22      ARG   8 123.473 -17.753  11.976
   70   1HH2  ARG   8          HH11      ARG   8 126.811 -18.139  11.136
   71   2HH2  ARG   8          HH12      ARG   8 125.482 -18.777  12.044
   72    H    ASP   9           HN       ASP   9 126.682 -13.878   4.736
   73    HA   ASP   9           HA       ASP   9 128.885 -15.673   4.199
   74   1HB   ASP   9           HB2      ASP   9 127.002 -14.169   2.379
   75   2HB   ASP   9           HB1      ASP   9 128.222 -15.290   1.787
   76    H    PHE  10           HN       PHE  10 128.326 -12.204   3.658
   77    HA   PHE  10           HA       PHE  10 130.706 -11.798   2.095
   78   1HB   PHE  10           HB2      PHE  10 128.711 -10.264   2.222
   79   2HB   PHE  10           HB1      PHE  10 129.260  -9.776   3.824
   80    HD1  PHE  10           HD2      PHE  10 131.306  -8.469   4.118
   81    HD2  PHE  10           HD1      PHE  10 129.953  -9.640   0.213
   82    HE1  PHE  10           HE2      PHE  10 132.863  -6.836   3.090
   83    HE2  PHE  10           HE1      PHE  10 131.512  -8.007  -0.817
   84    HZ   PHE  10           HZ       PHE  10 132.966  -6.605   0.621
   85    H    VAL  11           HN       VAL  11 130.056 -11.517   5.598
   86    HA   VAL  11           HA       VAL  11 132.821 -10.628   6.109
   87    HB   VAL  11           HB       VAL  11 132.135 -10.627   8.472
   88   1HG1  VAL  11          HG12      VAL  11 130.089  -9.430   6.579
   89   2HG1  VAL  11          HG11      VAL  11 130.296  -8.963   8.267
   90   3HG1  VAL  11          HG13      VAL  11 131.590  -8.669   7.106
   91   1HG2  VAL  11          HG22      VAL  11 129.715 -12.012   7.320
   92   2HG2  VAL  11          HG21      VAL  11 130.724 -12.517   8.672
   93   3HG2  VAL  11          HG23      VAL  11 129.626 -11.149   8.855
   94    H    ALA  12           HN       ALA  12 131.922 -13.490   5.107
   95    HA   ALA  12           HA       ALA  12 133.483 -15.039   7.160
   96   1HB   ALA  12           HB3      ALA  12 131.345 -16.009   5.247
   97   2HB   ALA  12           HB2      ALA  12 132.233 -17.013   6.393
   98   3HB   ALA  12           HB1      ALA  12 131.138 -15.762   6.981
   99    H    GLU  13           HN       GLU  13 133.611 -13.808   4.010
  100    HA   GLU  13           HA       GLU  13 135.974 -15.443   3.452
  101   1HB   GLU  13           HB2      GLU  13 135.156 -16.258   1.267
  102   2HB   GLU  13           HB1      GLU  13 134.160 -16.873   2.582
  103   1HG   GLU  13           HG2      GLU  13 132.627 -14.880   2.170
  104   2HG   GLU  13           HG1      GLU  13 133.527 -14.616   0.678
  105    HA   PRO  14           HA       PRO  14 137.530 -11.725   1.569
  106   1HB   PRO  14           HB2      PRO  14 137.922 -13.413  -0.894
  107   2HB   PRO  14           HB1      PRO  14 139.040 -12.260  -0.132
  108   1HG   PRO  14           HG2      PRO  14 139.324 -14.884   0.220
  109   2HG   PRO  14           HG1      PRO  14 139.641 -13.738   1.535
  110   1HD   PRO  14           HD2      PRO  14 137.368 -15.633   1.217
  111   2HD   PRO  14           HD1      PRO  14 138.051 -14.928   2.698
  112    H    MET  15           HN       MET  15 136.977 -10.143  -0.118
  113    HA   MET  15           HA       MET  15 134.184 -10.468  -1.055
  114   1HB   MET  15           HB2      MET  15 134.483  -8.031  -1.700
  115   2HB   MET  15           HB1      MET  15 134.655  -8.373   0.023
  116   1HG   MET  15           HG2      MET  15 137.025  -8.227  -0.073
  117   2HG   MET  15           HG1      MET  15 137.041  -8.326  -1.834
  118   1HE   MET  15           HE2      MET  15 135.632  -6.569   1.149
  119   2HE   MET  15           HE1      MET  15 137.203  -5.773   1.160
  120   3HE   MET  15           HE3      MET  15 135.738  -4.841   0.820
  121    H    GLY  16           HN       GLY  16 137.395 -10.633  -2.292
  122   1HA   GLY  16           HA2      GLY  16 138.232 -10.809  -4.490
  123   2HA   GLY  16           HA1      GLY  16 136.727 -11.675  -4.800
  124    H    GLU  17           HN       GLU  17 136.133 -10.808  -6.775
  125    HA   GLU  17           HA       GLU  17 136.019  -7.827  -7.037
  126   1HB   GLU  17           HB2      GLU  17 136.035 -10.050  -9.091
  127   2HB   GLU  17           HB1      GLU  17 135.757  -8.355  -9.491
  128   1HG   GLU  17           HG2      GLU  17 137.943  -7.769  -8.484
  129   2HG   GLU  17           HG1      GLU  17 138.224  -9.473  -8.127
  130    H    LYS  18           HN       LYS  18 133.939  -9.479  -5.613
  131    HA   LYS  18           HA       LYS  18 131.653  -9.832  -7.266
  132   1HB   LYS  18           HB2      LYS  18 131.917  -9.183  -4.318
  133   2HB   LYS  18           HB1      LYS  18 130.366  -9.527  -5.081
  134   1HG   LYS  18           HG2      LYS  18 131.199 -11.725  -5.814
  135   2HG   LYS  18           HG1      LYS  18 132.764 -11.382  -5.077
  136   1HD   LYS  18           HD2      LYS  18 131.634 -11.140  -2.867
  137   2HD   LYS  18           HD1      LYS  18 130.109 -11.600  -3.627
  138   1HE   LYS  18           HE2      LYS  18 131.247 -13.531  -2.527
  139   2HE   LYS  18           HE1      LYS  18 131.039 -13.768  -4.262
  140   1HZ   LYS  18           HZ3      LYS  18 133.509 -12.579  -3.168
  141   2HZ   LYS  18           HZ2      LYS  18 133.311 -14.265  -3.252
  142   3HZ   LYS  18           HZ1      LYS  18 133.269 -13.330  -4.670
  143    HA   PRO  19           HA       PRO  19 130.492  -5.670  -8.268
  144   1HB   PRO  19           HB2      PRO  19 127.716  -5.863  -8.246
  145   2HB   PRO  19           HB1      PRO  19 128.750  -6.437  -9.569
  146   1HG   PRO  19           HG2      PRO  19 127.518  -7.981  -7.330
  147   2HG   PRO  19           HG1      PRO  19 127.687  -8.416  -9.040
  148   1HD   PRO  19           HD2      PRO  19 129.339  -9.433  -7.155
  149   2HD   PRO  19           HD1      PRO  19 129.915  -9.070  -8.795
  150    H    VAL  20           HN       VAL  20 129.698  -3.712  -7.370
  151    HA   VAL  20           HA       VAL  20 129.878  -3.416  -4.579
  152    HB   VAL  20           HB       VAL  20 130.140  -1.459  -5.899
  153   1HG1  VAL  20          HG12      VAL  20 127.394  -2.078  -7.024
  154   2HG1  VAL  20          HG11      VAL  20 128.275  -0.585  -7.335
  155   3HG1  VAL  20          HG13      VAL  20 128.929  -2.125  -7.889
  156   1HG2  VAL  20          HG22      VAL  20 128.773  -1.236  -3.728
  157   2HG2  VAL  20          HG21      VAL  20 128.672   0.104  -4.871
  158   3HG2  VAL  20          HG23      VAL  20 127.362  -1.072  -4.767
  159    H    GLY  21           HN       GLY  21 126.981  -3.835  -6.589
  160   1HA   GLY  21           HA2      GLY  21 125.026  -3.450  -4.593
  161   2HA   GLY  21           HA1      GLY  21 124.804  -4.471  -6.013
  162    H    SER  22           HN       SER  22 127.457  -5.756  -4.565
  163    HA   SER  22           HA       SER  22 125.871  -7.932  -3.400
  164   1HB   SER  22           HB2      SER  22 128.880  -7.558  -3.452
  165   2HB   SER  22           HB1      SER  22 128.015  -9.050  -3.093
  166    HG   SER  22           HG       SER  22 128.788  -8.171  -5.440
  167    H    LEU  23           HN       LEU  23 127.480  -5.065  -2.307
  168    HA   LEU  23           HA       LEU  23 128.025  -5.874   0.395
  169   1HB   LEU  23           HB2      LEU  23 127.336  -3.122  -0.680
  170   2HB   LEU  23           HB1      LEU  23 128.038  -3.453   0.902
  171    HG   LEU  23           HG       LEU  23 129.330  -4.170  -1.750
  172   1HD1  LEU  23          HD13      LEU  23 129.740  -1.874   0.177
  173   2HD1  LEU  23          HD12      LEU  23 130.958  -2.346  -1.007
  174   3HD1  LEU  23          HD11      LEU  23 129.376  -1.790  -1.545
  175   1HD2  LEU  23          HD23      LEU  23 130.097  -4.554   1.146
  176   2HD2  LEU  23          HD22      LEU  23 130.245  -5.683  -0.200
  177   3HD2  LEU  23          HD21      LEU  23 131.359  -4.328  -0.063
  178    H    ALA  24           HN       ALA  24 126.728  -5.924   2.173
  179    HA   ALA  24           HA       ALA  24 123.899  -6.190   1.817
  180   1HB   ALA  24           HB3      ALA  24 125.570  -5.768   4.306
  181   2HB   ALA  24           HB2      ALA  24 123.844  -6.117   4.343
  182   3HB   ALA  24           HB1      ALA  24 124.971  -7.300   3.677
  183    H    GLY  25           HN       GLY  25 122.272  -4.716   1.978
  184   1HA   GLY  25           HA2      GLY  25 121.267  -2.654   2.804
  185   2HA   GLY  25           HA1      GLY  25 122.881  -1.968   2.985
  186    H    ILE  26           HN       ILE  26 123.495  -3.219   0.212
  187    HA   ILE  26           HA       ILE  26 122.436  -0.902  -1.354
  188    HB   ILE  26           HB       ILE  26 124.555  -2.931  -2.137
  189   1HG1  ILE  26          HG12      ILE  26 125.329  -1.794  -0.140
  190   2HG1  ILE  26          HG11      ILE  26 126.174  -1.106  -1.524
  191   1HG2  ILE  26          HG23      ILE  26 123.868  -0.174  -3.189
  192   2HG2  ILE  26          HG22      ILE  26 125.204  -1.177  -3.754
  193   3HG2  ILE  26          HG21      ILE  26 123.539  -1.702  -4.004
  194   1HD1  ILE  26          HD13      ILE  26 124.253   0.660  -1.528
  195   2HD1  ILE  26          HD12      ILE  26 123.948   0.098   0.114
  196   3HD1  ILE  26          HD11      ILE  26 125.513   0.793  -0.302
  197    H    GLY  27           HN       GLY  27 120.584  -1.348  -2.531
  198   1HA   GLY  27           HA2      GLY  27 119.972  -4.163  -3.216
  199   2HA   GLY  27           HA1      GLY  27 118.869  -2.793  -3.353
  200    H    GLU  28           HN       GLU  28 118.880  -4.316  -5.534
  201    HA   GLU  28           HA       GLU  28 120.920  -3.893  -7.453
  202   1HB   GLU  28           HB2      GLU  28 117.949  -4.367  -7.809
  203   2HB   GLU  28           HB1      GLU  28 119.090  -4.337  -9.152
  204   1HG   GLU  28           HG2      GLU  28 118.850  -6.639  -8.528
  205   2HG   GLU  28           HG1      GLU  28 120.418  -6.122  -7.912
  206    H    VAL  29           HN       VAL  29 118.056  -1.878  -6.720
  207    HA   VAL  29           HA       VAL  29 118.517  -0.055  -8.909
  208    HB   VAL  29           HB       VAL  29 117.036   0.285  -6.285
  209   1HG1  VAL  29          HG12      VAL  29 117.299   2.119  -8.676
  210   2HG1  VAL  29          HG11      VAL  29 115.970   2.244  -7.524
  211   3HG1  VAL  29          HG13      VAL  29 117.630   2.495  -6.986
  212   1HG2  VAL  29          HG22      VAL  29 116.241  -1.376  -8.094
  213   2HG2  VAL  29          HG21      VAL  29 115.072  -0.177  -7.542
  214   3HG2  VAL  29          HG23      VAL  29 115.906   0.047  -9.080
  215    H    LEU  30           HN       LEU  30 119.414   0.032  -5.469
  216    HA   LEU  30           HA       LEU  30 120.768   2.559  -5.590
  217   1HB   LEU  30           HB2      LEU  30 121.189   0.220  -3.703
  218   2HB   LEU  30           HB1      LEU  30 121.792   1.855  -3.445
  219    HG   LEU  30           HG       LEU  30 118.859   1.169  -3.796
  220   1HD1  LEU  30          HD12      LEU  30 119.906   0.168  -1.739
  221   2HD1  LEU  30          HD11      LEU  30 120.341   1.799  -1.228
  222   3HD1  LEU  30          HD13      LEU  30 118.644   1.349  -1.393
  223   1HD2  LEU  30          HD22      LEU  30 120.405   3.692  -3.193
  224   2HD2  LEU  30          HD21      LEU  30 119.058   3.452  -4.304
  225   3HD2  LEU  30          HD23      LEU  30 118.768   3.505  -2.569
  226    H    GLY  31           HN       GLY  31 121.832  -0.779  -6.017
  227   1HA   GLY  31           HA2      GLY  31 124.634  -0.281  -6.168
  228   2HA   GLY  31           HA1      GLY  31 123.814  -1.641  -6.938
  229    H    LYS  32           HN       LYS  32 122.096  -0.152  -8.647
  230    HA   LYS  32           HA       LYS  32 123.794   0.238 -10.898
  231   1HB   LYS  32           HB2      LYS  32 121.365  -0.294 -11.024
  232   2HB   LYS  32           HB1      LYS  32 121.003   1.335 -10.455
  233   1HG   LYS  32           HG2      LYS  32 122.142   2.289 -12.417
  234   2HG   LYS  32           HG1      LYS  32 122.536   0.664 -12.984
  235   1HD   LYS  32           HD2      LYS  32 120.111   0.137 -13.091
  236   2HD   LYS  32           HD1      LYS  32 119.746   1.791 -12.596
  237   1HE   LYS  32           HE2      LYS  32 120.730   2.693 -14.596
  238   2HE   LYS  32           HE1      LYS  32 121.406   1.125 -15.038
  239   1HZ   LYS  32           HZ1      LYS  32 118.565   1.071 -14.619
  240   2HZ   LYS  32           HZ3      LYS  32 119.028   2.100 -15.884
  241   3HZ   LYS  32           HZ2      LYS  32 119.483   0.464 -15.912
  242    H    LYS  33           HN       LYS  33 122.382   2.615  -8.628
  243    HA   LYS  33           HA       LYS  33 123.306   4.910 -10.098
  244   1HB   LYS  33           HB2      LYS  33 122.620   4.533  -7.171
  245   2HB   LYS  33           HB1      LYS  33 122.996   6.100  -7.890
  246   1HG   LYS  33           HG2      LYS  33 121.143   5.815  -9.492
  247   2HG   LYS  33           HG1      LYS  33 120.763   4.249  -8.775
  248   1HD   LYS  33           HD2      LYS  33 120.329   5.347  -6.604
  249   2HD   LYS  33           HD1      LYS  33 120.704   6.913  -7.324
  250   1HE   LYS  33           HE2      LYS  33 118.283   6.604  -7.287
  251   2HE   LYS  33           HE1      LYS  33 118.849   6.568  -8.957
  252   1HZ   LYS  33           HZ2      LYS  33 119.007   4.035  -8.526
  253   2HZ   LYS  33           HZ1      LYS  33 117.914   4.351  -7.265
  254   3HZ   LYS  33           HZ3      LYS  33 117.496   4.730  -8.864
  255    H    LEU  34           HN       LEU  34 124.721   3.079  -7.378
  256    HA   LEU  34           HA       LEU  34 127.039   4.722  -7.071
  257   1HB   LEU  34           HB2      LEU  34 126.594   1.772  -6.535
  258   2HB   LEU  34           HB1      LEU  34 128.055   2.633  -6.068
  259    HG   LEU  34           HG       LEU  34 125.279   3.487  -5.213
  260   1HD1  LEU  34          HD13      LEU  34 125.945   1.209  -4.359
  261   2HD1  LEU  34          HD12      LEU  34 127.328   1.971  -3.572
  262   3HD1  LEU  34          HD11      LEU  34 125.689   2.410  -3.094
  263   1HD2  LEU  34          HD22      LEU  34 128.089   4.422  -4.621
  264   2HD2  LEU  34          HD21      LEU  34 126.630   5.370  -4.901
  265   3HD2  LEU  34          HD23      LEU  34 126.867   4.559  -3.358
  266    H    GLU  35           HN       GLU  35 126.337   1.957  -9.153
  267    HA   GLU  35           HA       GLU  35 128.949   1.655 -10.269
  268   1HB   GLU  35           HB2      GLU  35 127.187  -0.010 -10.658
  269   2HB   GLU  35           HB1      GLU  35 126.252   1.170 -11.579
  270   1HG   GLU  35           HG2      GLU  35 127.962   1.295 -13.281
  271   2HG   GLU  35           HG1      GLU  35 129.060   0.306 -12.318
  272    H    GLU  36           HN       GLU  36 126.250   3.754 -11.197
  273    HA   GLU  36           HA       GLU  36 127.559   4.868 -13.516
  274   1HB   GLU  36           HB2      GLU  36 125.291   5.873 -11.770
  275   2HB   GLU  36           HB1      GLU  36 125.831   6.702 -13.231
  276   1HG   GLU  36           HG2      GLU  36 125.380   4.684 -14.563
  277   2HG   GLU  36           HG1      GLU  36 124.860   3.833 -13.108
  278    H    ARG  37           HN       ARG  37 127.880   5.330 -10.134
  279    HA   ARG  37           HA       ARG  37 129.127   7.999 -10.409
  280   1HB   ARG  37           HB2      ARG  37 128.711   6.195  -8.010
  281   2HB   ARG  37           HB1      ARG  37 129.432   7.799  -7.928
  282   1HG   ARG  37           HG2      ARG  37 126.715   7.380  -9.172
  283   2HG   ARG  37           HG1      ARG  37 126.893   7.559  -7.429
  284   1HD   ARG  37           HD2      ARG  37 128.057   9.734  -7.799
  285   2HD   ARG  37           HD1      ARG  37 127.769   9.572  -9.530
  286    HE   ARG  37           HE       ARG  37 125.250   9.312  -8.439
  287   1HH1  ARG  37          HH21      ARG  37 127.851  11.562  -8.184
  288   2HH1  ARG  37          HH22      ARG  37 126.819  12.928  -7.920
  289   1HH2  ARG  37          HH11      ARG  37 123.889  11.079  -8.093
  290   2HH2  ARG  37          HH12      ARG  37 124.574  12.655  -7.876
  291    H    GLY  38           HN       GLY  38 130.177   4.914 -11.008
  292   1HA   GLY  38           HA2      GLY  38 132.483   4.600 -11.724
  293   2HA   GLY  38           HA1      GLY  38 133.009   5.735 -10.492
  294    H    PHE  39           HN       PHE  39 130.726   3.644  -9.123
  295    HA   PHE  39           HA       PHE  39 132.932   1.998  -7.928
  296   1HB   PHE  39           HB2      PHE  39 130.118   2.566  -6.987
  297   2HB   PHE  39           HB1      PHE  39 131.258   1.522  -6.147
  298    HD1  PHE  39           HD2      PHE  39 133.233   2.459  -5.028
  299    HD2  PHE  39           HD1      PHE  39 130.420   4.970  -7.063
  300    HE1  PHE  39           HE2      PHE  39 134.230   4.454  -3.940
  301    HE2  PHE  39           HE1      PHE  39 131.406   6.966  -5.975
  302    HZ   PHE  39           HZ       PHE  39 133.316   6.709  -4.413
  303    H    ASP  40           HN       ASP  40 132.825   0.695 -10.012
  304    HA   ASP  40           HA       ASP  40 130.420  -0.940 -10.409
  305   1HB   ASP  40           HB2      ASP  40 131.695  -1.969 -12.235
  306   2HB   ASP  40           HB1      ASP  40 131.801  -0.211 -12.330
  307    H    LYS  41           HN       LYS  41 133.232  -1.163  -8.455
  308    HA   LYS  41           HA       LYS  41 132.645  -4.064  -7.937
  309   1HB   LYS  41           HB2      LYS  41 135.373  -2.731  -7.927
  310   2HB   LYS  41           HB1      LYS  41 135.048  -4.416  -7.531
  311   1HG   LYS  41           HG2      LYS  41 134.382  -3.165 -10.210
  312   2HG   LYS  41           HG1      LYS  41 135.875  -4.040  -9.887
  313   1HD   LYS  41           HD2      LYS  41 134.345  -5.983  -9.114
  314   2HD   LYS  41           HD1      LYS  41 133.049  -5.110  -9.932
  315   1HE   LYS  41           HE2      LYS  41 135.650  -5.935 -11.247
  316   2HE   LYS  41           HE1      LYS  41 134.125  -6.803 -11.405
  317   1HZ   LYS  41           HZ2      LYS  41 133.478  -4.218 -11.969
  318   2HZ   LYS  41           HZ1      LYS  41 134.996  -4.412 -12.707
  319   3HZ   LYS  41           HZ3      LYS  41 133.722  -5.457 -13.106
  320    H    ALA  42           HN       ALA  42 132.878  -4.701  -5.760
  321    HA   ALA  42           HA       ALA  42 132.097  -2.747  -3.826
  322   1HB   ALA  42           HB3      ALA  42 133.101  -5.583  -3.565
  323   2HB   ALA  42           HB2      ALA  42 132.594  -4.627  -2.173
  324   3HB   ALA  42           HB1      ALA  42 131.441  -5.004  -3.453
  325    H    TYR  43           HN       TYR  43 135.299  -4.223  -4.439
  326    HA   TYR  43           HA       TYR  43 136.556  -3.179  -2.123
  327   1HB   TYR  43           HB2      TYR  43 138.673  -3.593  -3.183
  328   2HB   TYR  43           HB1      TYR  43 137.570  -4.889  -3.632
  329    HD1  TYR  43           HD1      TYR  43 139.038  -1.671  -4.806
  330    HD2  TYR  43           HD2      TYR  43 137.046  -5.313  -5.899
  331    HE1  TYR  43           HE1      TYR  43 139.451  -1.174  -7.199
  332    HE2  TYR  43           HE2      TYR  43 137.451  -4.818  -8.294
  333    HH   TYR  43           HH       TYR  43 139.228  -3.400  -9.600
  334    H    VAL  44           HN       VAL  44 135.526  -1.447  -4.958
  335    HA   VAL  44           HA       VAL  44 137.390   0.785  -4.504
  336    HB   VAL  44           HB       VAL  44 134.816   0.687  -6.129
  337   1HG1  VAL  44          HG12      VAL  44 137.080   2.711  -6.086
  338   2HG1  VAL  44          HG11      VAL  44 135.704   2.739  -7.187
  339   3HG1  VAL  44          HG13      VAL  44 135.455   2.983  -5.461
  340   1HG2  VAL  44          HG21      VAL  44 137.732   0.373  -6.896
  341   2HG2  VAL  44          HG23      VAL  44 136.451  -0.826  -7.076
  342   3HG2  VAL  44          HG22      VAL  44 136.435   0.635  -8.061
  343    H    VAL  45           HN       VAL  45 134.223  -0.237  -3.588
  344    HA   VAL  45           HA       VAL  45 133.371   2.260  -2.349
  345    HB   VAL  45           HB       VAL  45 132.374  -0.589  -2.054
  346   1HG1  VAL  45          HG12      VAL  45 131.278   2.045  -1.033
  347   2HG1  VAL  45          HG11      VAL  45 130.310   0.577  -1.154
  348   3HG1  VAL  45          HG13      VAL  45 131.709   0.623  -0.084
  349   1HG2  VAL  45          HG21      VAL  45 131.340   1.789  -3.623
  350   2HG2  VAL  45          HG23      VAL  45 132.133   0.372  -4.308
  351   3HG2  VAL  45          HG22      VAL  45 130.565   0.212  -3.524
  352    H    LEU  46           HN       LEU  46 134.835  -0.784  -1.224
  353    HA   LEU  46           HA       LEU  46 134.752  -0.177   1.562
  354   1HB   LEU  46           HB2      LEU  46 135.381  -2.426   0.699
  355   2HB   LEU  46           HB1      LEU  46 136.861  -1.746   0.025
  356    HG   LEU  46           HG       LEU  46 137.588  -1.089   2.292
  357   1HD1  LEU  46          HD12      LEU  46 134.875  -2.150   3.016
  358   2HD1  LEU  46          HD11      LEU  46 136.186  -2.304   4.184
  359   3HD1  LEU  46          HD13      LEU  46 135.708  -0.712   3.604
  360   1HD2  LEU  46          HD21      LEU  46 137.838  -3.524   1.214
  361   2HD2  LEU  46          HD23      LEU  46 138.422  -3.164   2.837
  362   3HD2  LEU  46          HD22      LEU  46 136.874  -3.974   2.624
  363    H    GLY  47           HN       GLY  47 136.970   0.658  -1.026
  364   1HA   GLY  47           HA2      GLY  47 139.035   1.872   0.483
  365   2HA   GLY  47           HA1      GLY  47 138.594   2.349  -1.159
  366    H    GLN  48           HN       GLN  48 135.933   3.217  -0.690
  367    HA   GLN  48           HA       GLN  48 136.352   5.896   0.181
  368   1HB   GLN  48           HB2      GLN  48 134.463   5.065  -1.287
  369   2HB   GLN  48           HB1      GLN  48 133.713   4.402   0.164
  370   1HG   GLN  48           HG2      GLN  48 132.746   6.585  -0.247
  371   2HG   GLN  48           HG1      GLN  48 133.789   6.708   1.171
  372   1HE2  GLN  48          HE22      GLN  48 135.785   9.191  -0.302
  373   2HE2  GLN  48          HE21      GLN  48 135.232   8.430   1.111
  374    H    PHE  49           HN       PHE  49 134.898   3.103   1.851
  375    HA   PHE  49           HA       PHE  49 134.212   4.408   4.289
  376   1HB   PHE  49           HB2      PHE  49 133.453   2.140   3.664
  377   2HB   PHE  49           HB1      PHE  49 135.103   1.544   3.803
  378    HD1  PHE  49           HD1      PHE  49 132.562   3.448   5.803
  379    HD2  PHE  49           HD2      PHE  49 135.743   0.559   5.831
  380    HE1  PHE  49           HE1      PHE  49 132.171   3.038   8.216
  381    HE2  PHE  49           HE2      PHE  49 135.352   0.154   8.247
  382    HZ   PHE  49           HZ       PHE  49 133.565   1.393   9.439
  383    H    LEU  50           HN       LEU  50 137.183   2.860   3.203
  384    HA   LEU  50           HA       LEU  50 138.608   3.182   5.703
  385   1HB   LEU  50           HB2      LEU  50 139.579   2.819   2.853
  386   2HB   LEU  50           HB1      LEU  50 140.652   2.814   4.251
  387    HG   LEU  50           HG       LEU  50 138.278   0.949   3.947
  388   1HD1  LEU  50          HD13      LEU  50 141.199   0.571   3.248
  389   2HD1  LEU  50          HD12      LEU  50 140.080  -0.776   3.468
  390   3HD1  LEU  50          HD11      LEU  50 139.805   0.400   2.182
  391   1HD2  LEU  50          HD23      LEU  50 140.510   1.259   5.956
  392   2HD2  LEU  50          HD22      LEU  50 138.796   0.957   6.235
  393   3HD2  LEU  50          HD21      LEU  50 139.833  -0.341   5.660
  394    H    VAL  51           HN       VAL  51 138.329   5.145   2.773
  395    HA   VAL  51           HA       VAL  51 140.244   7.131   3.548
  396    HB   VAL  51           HB       VAL  51 137.881   7.235   1.655
  397   1HG1  VAL  51          HG13      VAL  51 140.011   9.289   2.291
  398   2HG1  VAL  51          HG12      VAL  51 139.130   9.288   0.763
  399   3HG1  VAL  51          HG11      VAL  51 138.262   9.510   2.282
  400   1HG2  VAL  51          HG23      VAL  51 139.917   5.738   1.207
  401   2HG2  VAL  51          HG22      VAL  51 139.520   6.905  -0.054
  402   3HG2  VAL  51          HG21      VAL  51 140.849   7.227   1.061
  403    H    LEU  52           HN       LEU  52 136.885   6.626   4.416
  404    HA   LEU  52           HA       LEU  52 136.607   9.344   5.543
  405   1HB   LEU  52           HB2      LEU  52 134.776   6.932   5.545
  406   2HB   LEU  52           HB1      LEU  52 134.363   8.472   6.289
  407    HG   LEU  52           HG       LEU  52 135.118   8.150   3.368
  408   1HD1  LEU  52          HD12      LEU  52 132.457   8.087   4.793
  409   2HD1  LEU  52          HD11      LEU  52 132.568   8.641   3.123
  410   3HD1  LEU  52          HD13      LEU  52 133.068   7.003   3.544
  411   1HD2  LEU  52          HD23      LEU  52 134.225  10.456   5.101
  412   2HD2  LEU  52          HD22      LEU  52 135.468  10.416   3.849
  413   3HD2  LEU  52          HD21      LEU  52 133.768  10.435   3.398
  414    H    LYS  53           HN       LYS  53 138.435   6.962   6.615
  415    HA   LYS  53           HA       LYS  53 139.068   6.162   8.737
  416   1HB   LYS  53           HB2      LYS  53 138.048   8.938   9.354
  417   2HB   LYS  53           HB1      LYS  53 138.899   7.940  10.528
  418   1HG   LYS  53           HG2      LYS  53 140.833   7.781   9.002
  419   2HG   LYS  53           HG1      LYS  53 139.994   8.787   7.827
  420   1HD   LYS  53           HD2      LYS  53 140.359   9.821  10.634
  421   2HD   LYS  53           HD1      LYS  53 141.725   9.868   9.524
  422   1HE   LYS  53           HE2      LYS  53 140.577  11.983   9.362
  423   2HE   LYS  53           HE1      LYS  53 140.255  11.091   7.878
  424   1HZ   LYS  53           HZ2      LYS  53 138.407  10.835  10.147
  425   2HZ   LYS  53           HZ1      LYS  53 138.326  12.219   9.164
  426   3HZ   LYS  53           HZ3      LYS  53 138.099  10.683   8.484
  427    H    LYS  54           HN       LYS  54 136.445   5.320   7.956
  428    HA   LYS  54           HA       LYS  54 134.553   4.279   8.858
  429   1HB   LYS  54           HB2      LYS  54 136.069   4.624  11.470
  430   2HB   LYS  54           HB1      LYS  54 134.694   3.559  11.207
  431   1HG   LYS  54           HG2      LYS  54 135.966   2.313   9.507
  432   2HG   LYS  54           HG1      LYS  54 137.347   3.379   9.751
  433   1HD   LYS  54           HD2      LYS  54 137.471   2.669  12.118
  434   2HD   LYS  54           HD1      LYS  54 136.104   1.585  11.858
  435   1HE   LYS  54           HE2      LYS  54 137.414   0.396  10.104
  436   2HE   LYS  54           HE1      LYS  54 138.790   1.440  10.458
  437   1HZ   LYS  54           HZ1      LYS  54 137.454  -0.289  12.464
  438   2HZ   LYS  54           HZ3      LYS  54 138.856  -0.725  11.617
  439   3HZ   LYS  54           HZ2      LYS  54 138.883   0.604  12.675
  440    H    ASP  55           HN       ASP  55 134.858   7.400   8.906
  441    HA   ASP  55           HA       ASP  55 133.278   8.258  11.176
  442   1HB   ASP  55           HB2      ASP  55 133.841   9.506   8.477
  443   2HB   ASP  55           HB1      ASP  55 132.856  10.306   9.702
  444    H    GLU  56           HN       GLU  56 131.283   7.323  11.454
  445    HA   GLU  56           HA       GLU  56 129.668   6.263   9.361
  446   1HB   GLU  56           HB2      GLU  56 129.520   5.593  11.753
  447   2HB   GLU  56           HB1      GLU  56 128.760   7.146  12.107
  448   1HG   GLU  56           HG2      GLU  56 126.876   6.643  10.708
  449   2HG   GLU  56           HG1      GLU  56 127.677   5.222  10.037
  450    H    ASP  57           HN       ASP  57 129.504   9.443  10.977
  451    HA   ASP  57           HA       ASP  57 127.022  10.216   9.731
  452   1HB   ASP  57           HB2      ASP  57 129.295  11.846  10.901
  453   2HB   ASP  57           HB1      ASP  57 127.793  12.558  10.314
  454    H    LEU  58           HN       LEU  58 130.397  10.629   8.847
  455    HA   LEU  58           HA       LEU  58 129.811  12.222   6.484
  456   1HB   LEU  58           HB2      LEU  58 132.244  10.581   7.222
  457   2HB   LEU  58           HB1      LEU  58 132.150  11.585   5.782
  458    HG   LEU  58           HG       LEU  58 131.772  12.604   8.616
  459   1HD1  LEU  58          HD11      LEU  58 134.155  12.630   6.748
  460   2HD1  LEU  58          HD13      LEU  58 134.023  13.695   8.148
  461   3HD1  LEU  58          HD12      LEU  58 134.069  11.946   8.372
  462   1HD2  LEU  58          HD21      LEU  58 131.648  13.858   5.881
  463   2HD2  LEU  58          HD23      LEU  58 130.681  14.199   7.315
  464   3HD2  LEU  58          HD22      LEU  58 132.327  14.813   7.198
  465    H    PHE  59           HN       PHE  59 130.276   8.771   7.098
  466    HA   PHE  59           HA       PHE  59 130.171   7.934   4.350
  467   1HB   PHE  59           HB2      PHE  59 130.988   6.416   6.072
  468   2HB   PHE  59           HB1      PHE  59 129.435   6.472   6.904
  469    HD1  PHE  59           HD1      PHE  59 131.107   5.435   3.741
  470    HD2  PHE  59           HD2      PHE  59 127.628   5.075   6.236
  471    HE1  PHE  59           HE1      PHE  59 130.293   3.557   2.338
  472    HE2  PHE  59           HE2      PHE  59 126.814   3.199   4.833
  473    HZ   PHE  59           HZ       PHE  59 128.148   2.439   2.884
  474    H    ARG  60           HN       ARG  60 127.654   8.118   6.878
  475    HA   ARG  60           HA       ARG  60 125.499   7.230   5.262
  476   1HB   ARG  60           HB2      ARG  60 125.580   9.102   7.639
  477   2HB   ARG  60           HB1      ARG  60 124.076   8.550   6.902
  478   1HG   ARG  60           HG2      ARG  60 124.716   6.215   7.321
  479   2HG   ARG  60           HG1      ARG  60 126.229   6.743   8.041
  480   1HD   ARG  60           HD2      ARG  60 124.982   7.962   9.782
  481   2HD   ARG  60           HD1      ARG  60 123.460   7.457   9.051
  482    HE   ARG  60           HE       ARG  60 124.780   5.070   9.542
  483   1HH1  ARG  60          HH21      ARG  60 123.953   7.882  11.357
  484   2HH1  ARG  60          HH22      ARG  60 123.759   7.025  12.850
  485   1HH2  ARG  60          HH11      ARG  60 124.528   3.933  11.481
  486   2HH2  ARG  60          HH12      ARG  60 124.087   4.790  12.920
  487    H    GLU  61           HN       GLU  61 126.618  10.590   5.881
  488    HA   GLU  61           HA       GLU  61 124.617  11.820   4.245
  489   1HB   GLU  61           HB2      GLU  61 127.403  12.698   5.048
  490   2HB   GLU  61           HB1      GLU  61 126.275  13.733   4.171
  491   1HG   GLU  61           HG2      GLU  61 124.631  13.494   5.996
  492   2HG   GLU  61           HG1      GLU  61 125.757  12.461   6.876
  493    H    TRP  62           HN       TRP  62 127.821  10.483   3.514
  494    HA   TRP  62           HA       TRP  62 127.939  11.462   0.814
  495   1HB   TRP  62           HB2      TRP  62 129.980  10.721   1.799
  496   2HB   TRP  62           HB1      TRP  62 129.284   9.166   2.247
  497    HD1  TRP  62           HD1      TRP  62 130.637  11.096  -0.765
  498    HE1  TRP  62           HE1      TRP  62 131.092   9.432  -2.679
  499    HE3  TRP  62           HE3      TRP  62 128.593   6.861   1.241
  500    HZ2  TRP  62           HZ2      TRP  62 130.632   6.664  -3.290
  501    HZ3  TRP  62           HZ3      TRP  62 128.629   4.733  -0.020
  502    HH2  TRP  62           HH2      TRP  62 129.638   4.628  -2.281
  503    H    LEU  63           HN       LEU  63 126.775   8.381   2.183
  504    HA   LEU  63           HA       LEU  63 126.179   7.208  -0.374
  505   1HB   LEU  63           HB2      LEU  63 126.486   5.864   1.659
  506   2HB   LEU  63           HB1      LEU  63 125.052   6.598   2.371
  507    HG   LEU  63           HG       LEU  63 123.668   5.650   0.560
  508   1HD1  LEU  63          HD13      LEU  63 126.348   4.724  -0.441
  509   2HD1  LEU  63          HD12      LEU  63 124.908   3.776  -0.803
  510   3HD1  LEU  63          HD11      LEU  63 125.016   5.450  -1.339
  511   1HD2  LEU  63          HD22      LEU  63 125.443   3.732   2.084
  512   2HD2  LEU  63          HD21      LEU  63 123.849   4.323   2.552
  513   3HD2  LEU  63          HD23      LEU  63 124.014   3.215   1.190
  514    H    LYS  64           HN       LYS  64 124.095   8.780   2.045
  515    HA   LYS  64           HA       LYS  64 121.672   8.523   0.549
  516   1HB   LYS  64           HB2      LYS  64 121.699   9.119   2.948
  517   2HB   LYS  64           HB1      LYS  64 122.404  10.686   2.543
  518   1HG   LYS  64           HG2      LYS  64 120.440  11.293   1.245
  519   2HG   LYS  64           HG1      LYS  64 119.748   9.686   1.472
  520   1HD   LYS  64           HD2      LYS  64 119.587  10.053   3.875
  521   2HD   LYS  64           HD1      LYS  64 120.383  11.620   3.717
  522   1HE   LYS  64           HE2      LYS  64 117.735  10.864   2.444
  523   2HE   LYS  64           HE1      LYS  64 117.924  11.877   3.875
  524   1HZ   LYS  64           HZ3      LYS  64 119.458  13.251   2.356
  525   2HZ   LYS  64           HZ2      LYS  64 118.662  12.457   1.082
  526   3HZ   LYS  64           HZ1      LYS  64 117.778  13.410   2.178
  527    H    ASP  65           HN       ASP  65 124.001  11.211   0.711
  528    HA   ASP  65           HA       ASP  65 122.578  12.849  -1.186
  529   1HB   ASP  65           HB2      ASP  65 125.451  12.846  -0.234
  530   2HB   ASP  65           HB1      ASP  65 124.827  14.033  -1.379
  531    H    THR  66           HN       THR  66 124.881  10.231  -1.500
  532    HA   THR  66           HA       THR  66 125.526  10.837  -4.270
  533    HB   THR  66           HB       THR  66 126.044   8.389  -2.565
  534    HG1  THR  66           HG1      THR  66 127.067  10.655  -2.363
  535   1HG2  THR  66          HG23      THR  66 126.900   9.098  -5.379
  536   2HG2  THR  66          HG22      THR  66 127.740   7.900  -4.394
  537   3HG2  THR  66          HG21      THR  66 126.054   7.646  -4.843
  538    H    CYS  67           HN       CYS  67 123.201   8.629  -2.666
  539    HA   CYS  67           HA       CYS  67 122.131   8.009  -5.410
  540   1HB   CYS  67           HB2      CYS  67 121.704   5.722  -4.679
  541   2HB   CYS  67           HB1      CYS  67 123.416   6.104  -4.493
  542    HG   CYS  67           HG       CYS  67 123.038   5.340  -2.153
  543    H    GLY  68           HN       GLY  68 121.368   8.527  -1.991
  544   1HA   GLY  68           HA2      GLY  68 119.264   9.620  -1.385
  545   2HA   GLY  68           HA1      GLY  68 118.495   8.849  -2.773
  546    H    ALA  69           HN       ALA  69 120.669   6.821  -1.068
  547    HA   ALA  69           HA       ALA  69 118.762   4.841  -0.453
  548   1HB   ALA  69           HB1      ALA  69 121.376   5.431   0.968
  549   2HB   ALA  69           HB3      ALA  69 120.472   3.921   1.086
  550   3HB   ALA  69           HB2      ALA  69 121.182   4.406  -0.455
  551    H    ASN  70           HN       ASN  70 117.810   4.211   1.617
  552    HA   ASN  70           HA       ASN  70 117.011   6.557   3.211
  553   1HB   ASN  70           HB2      ASN  70 115.380   4.801   2.437
  554   2HB   ASN  70           HB1      ASN  70 116.183   3.657   3.514
  555   1HD2  ASN  70          HD21      ASN  70 114.031   3.566   4.673
  556   2HD2  ASN  70          HD22      ASN  70 113.655   4.783   5.796
  557    H    ALA  71           HN       ALA  71 116.930   6.213   5.649
  558    HA   ALA  71           HA       ALA  71 119.567   5.871   6.662
  559   1HB   ALA  71           HB2      ALA  71 117.719   7.232   7.711
  560   2HB   ALA  71           HB1      ALA  71 117.010   5.717   8.273
  561   3HB   ALA  71           HB3      ALA  71 118.606   6.207   8.841
  562    H    LYS  72           HN       LYS  72 116.921   3.542   6.353
  563    HA   LYS  72           HA       LYS  72 118.070   1.644   8.214
  564   1HB   LYS  72           HB2      LYS  72 115.673   1.649   7.477
  565   2HB   LYS  72           HB1      LYS  72 116.202   1.068   5.899
  566   1HG   LYS  72           HG2      LYS  72 117.231  -0.908   6.989
  567   2HG   LYS  72           HG1      LYS  72 116.654  -0.332   8.553
  568   1HD   LYS  72           HD2      LYS  72 114.886  -1.010   6.182
  569   2HD   LYS  72           HD1      LYS  72 115.136  -2.042   7.589
  570   1HE   LYS  72           HE2      LYS  72 113.188  -0.959   8.238
  571   2HE   LYS  72           HE1      LYS  72 114.375   0.164   8.899
  572   1HZ   LYS  72           HZ1      LYS  72 113.581   0.560   6.121
  573   2HZ   LYS  72           HZ3      LYS  72 112.420   0.923   7.301
  574   3HZ   LYS  72           HZ2      LYS  72 113.925   1.705   7.327
  575    H    GLN  73           HN       GLN  73 118.274   2.080   4.706
  576    HA   GLN  73           HA       GLN  73 119.775  -0.302   4.189
  577   1HB   GLN  73           HB2      GLN  73 119.654   2.310   2.651
  578   2HB   GLN  73           HB1      GLN  73 120.330   0.802   2.034
  579   1HG   GLN  73           HG2      GLN  73 117.475   1.105   3.008
  580   2HG   GLN  73           HG1      GLN  73 117.954   1.205   1.314
  581   1HE2  GLN  73          HE22      GLN  73 117.073  -2.377   2.519
  582   2HE2  GLN  73          HE21      GLN  73 116.342  -0.909   2.956
  583    H    SER  74           HN       SER  74 120.743   3.037   4.937
  584    HA   SER  74           HA       SER  74 123.526   2.653   4.486
  585   1HB   SER  74           HB2      SER  74 122.083   4.582   6.321
  586   2HB   SER  74           HB1      SER  74 123.785   4.683   5.883
  587    HG   SER  74           HG       SER  74 121.531   5.306   4.434
  588    H    ARG  75           HN       ARG  75 121.526   2.192   7.429
  589    HA   ARG  75           HA       ARG  75 123.708   1.769   9.207
  590   1HB   ARG  75           HB2      ARG  75 120.882   0.681   9.253
  591   2HB   ARG  75           HB1      ARG  75 122.038   0.421  10.561
  592   1HG   ARG  75           HG2      ARG  75 122.320   2.904  10.735
  593   2HG   ARG  75           HG1      ARG  75 121.046   3.096   9.539
  594   1HD   ARG  75           HD2      ARG  75 120.790   1.828  12.277
  595   2HD   ARG  75           HD1      ARG  75 120.051   3.331  11.731
  596    HE   ARG  75           HE       ARG  75 119.094   1.401   9.963
  597   1HH1  ARG  75          HH21      ARG  75 119.205   1.893  13.376
  598   2HH1  ARG  75          HH22      ARG  75 117.736   1.027  13.684
  599   1HH2  ARG  75          HH11      ARG  75 117.176   0.259  10.350
  600   2HH2  ARG  75          HH12      ARG  75 116.592   0.101  11.972
  601    H    ASP  76           HN       ASP  76 122.056  -0.487   6.996
  602    HA   ASP  76           HA       ASP  76 123.371  -2.829   7.988
  603   1HB   ASP  76           HB2      ASP  76 122.151  -2.182   5.297
  604   2HB   ASP  76           HB1      ASP  76 122.776  -3.777   5.719
  605    H    CYS  77           HN       CYS  77 124.300  -0.511   5.416
  606    HA   CYS  77           HA       CYS  77 126.553  -2.063   4.528
  607   1HB   CYS  77           HB2      CYS  77 125.874   0.879   4.316
  608   2HB   CYS  77           HB1      CYS  77 127.299   0.162   3.565
  609    HG   CYS  77           HG       CYS  77 125.326  -1.536   2.467
  610    H    PHE  78           HN       PHE  78 126.198   0.534   6.964
  611    HA   PHE  78           HA       PHE  78 128.961   0.929   7.472
  612   1HB   PHE  78           HB2      PHE  78 127.279   2.413   8.411
  613   2HB   PHE  78           HB1      PHE  78 126.575   1.091   9.339
  614    HD1  PHE  78           HD2      PHE  78 127.700   0.188  11.314
  615    HD2  PHE  78           HD1      PHE  78 129.411   3.428   9.070
  616    HE1  PHE  78           HE2      PHE  78 129.262   0.654  13.180
  617    HE2  PHE  78           HE1      PHE  78 130.974   3.894  10.939
  618    HZ   PHE  78           HZ       PHE  78 130.900   2.507  12.993
  619    H    GLY  79           HN       GLY  79 126.728  -1.073   9.429
  620   1HA   GLY  79           HA2      GLY  79 128.780  -2.347  10.928
  621   2HA   GLY  79           HA1      GLY  79 127.145  -2.971  10.736
  622    H    CYS  80           HN       CYS  80 127.388  -3.147   7.792
  623    HA   CYS  80           HA       CYS  80 128.482  -5.826   7.673
  624   1HB   CYS  80           HB2      CYS  80 126.644  -5.012   6.207
  625   2HB   CYS  80           HB1      CYS  80 127.793  -3.955   5.390
  626    HG   CYS  80           HG       CYS  80 127.490  -6.395   4.201
  627    H    LEU  81           HN       LEU  81 129.604  -2.695   6.305
  628    HA   LEU  81           HA       LEU  81 132.071  -3.843   5.337
  629   1HB   LEU  81           HB2      LEU  81 131.331  -0.960   5.939
  630   2HB   LEU  81           HB1      LEU  81 132.744  -1.478   5.018
  631    HG   LEU  81           HG       LEU  81 129.867  -2.089   4.264
  632   1HD1  LEU  81          HD13      LEU  81 130.397   0.309   4.045
  633   2HD1  LEU  81          HD12      LEU  81 131.830  -0.092   3.098
  634   3HD1  LEU  81          HD11      LEU  81 130.224  -0.445   2.461
  635   1HD2  LEU  81          HD22      LEU  81 132.551  -2.780   3.076
  636   2HD2  LEU  81          HD21      LEU  81 131.115  -3.791   3.251
  637   3HD2  LEU  81          HD23      LEU  81 131.169  -2.549   2.005
  638    H    ARG  82           HN       ARG  82 131.132  -2.125   8.311
  639    HA   ARG  82           HA       ARG  82 133.752  -1.867   9.404
  640   1HB   ARG  82           HB2      ARG  82 131.756  -0.709  10.314
  641   2HB   ARG  82           HB1      ARG  82 131.140  -2.257  10.892
  642   1HG   ARG  82           HG2      ARG  82 133.116  -2.532  12.328
  643   2HG   ARG  82           HG1      ARG  82 133.778  -1.010  11.729
  644   1HD   ARG  82           HD2      ARG  82 131.827   0.199  12.631
  645   2HD   ARG  82           HD1      ARG  82 131.153  -1.319  13.221
  646    HE   ARG  82           HE       ARG  82 133.665  -1.219  14.384
  647   1HH1  ARG  82          HH21      ARG  82 130.938   0.881  14.155
  648   2HH1  ARG  82          HH22      ARG  82 131.200   1.606  15.707
  649   1HH2  ARG  82          HH11      ARG  82 134.022  -0.285  16.410
  650   2HH2  ARG  82          HH12      ARG  82 132.950   0.949  16.981
  651    H    GLU  83           HN       GLU  83 131.398  -4.518   9.618
  652    HA   GLU  83           HA       GLU  83 133.000  -6.104  11.418
  653   1HB   GLU  83           HB2      GLU  83 130.688  -6.793   9.591
  654   2HB   GLU  83           HB1      GLU  83 131.477  -7.984  10.630
  655   1HG   GLU  83           HG2      GLU  83 130.944  -6.688  12.614
  656   2HG   GLU  83           HG1      GLU  83 130.297  -5.377  11.634
  657    H    TRP  84           HN       TRP  84 132.767  -5.945   7.863
  658    HA   TRP  84           HA       TRP  84 134.330  -8.262   7.297
  659   1HB   TRP  84           HB2      TRP  84 133.026  -6.884   5.620
  660   2HB   TRP  84           HB1      TRP  84 134.296  -5.667   5.722
  661    HD1  TRP  84           HD1      TRP  84 133.559  -9.146   4.399
  662    HE1  TRP  84           HE1      TRP  84 135.479  -9.879   2.837
  663    HE3  TRP  84           HE3      TRP  84 136.884  -5.362   5.241
  664    HZ2  TRP  84           HZ2      TRP  84 138.076  -8.992   2.062
  665    HZ3  TRP  84           HZ3      TRP  84 139.073  -5.335   4.084
  666    HH2  TRP  84           HH2      TRP  84 139.674  -7.143   2.500
  667    H    CYS  85           HN       CYS  85 135.213  -4.869   7.833
  668    HA   CYS  85           HA       CYS  85 138.031  -5.165   7.477
  669   1HB   CYS  85           HB2      CYS  85 136.409  -3.213   9.132
  670   2HB   CYS  85           HB1      CYS  85 138.152  -3.083   8.917
  671    HG   CYS  85           HG       CYS  85 136.906  -3.300   6.206
  672    H    ASP  86           HN       ASP  86 135.950  -5.528  10.317
  673    HA   ASP  86           HA       ASP  86 137.993  -5.906  12.260
  674   1HB   ASP  86           HB2      ASP  86 135.172  -6.989  12.085
  675   2HB   ASP  86           HB1      ASP  86 136.207  -7.215  13.495
  676    H    ALA  87           HN       ALA  87 136.554  -8.122   9.914
  677    HA   ALA  87           HA       ALA  87 137.949 -10.446  11.060
  678   1HB   ALA  87           HB1      ALA  87 135.703 -10.648   9.971
  679   2HB   ALA  87           HB3      ALA  87 136.450 -10.206   8.433
  680   3HB   ALA  87           HB2      ALA  87 136.918 -11.699   9.244
  681    H    PHE  88           HN       PHE  88 138.278  -8.289   8.261
  682    HA   PHE  88           HA       PHE  88 140.769  -9.744   7.466
  683   1HB   PHE  88           HB2      PHE  88 139.034  -7.733   6.018
  684   2HB   PHE  88           HB1      PHE  88 140.575  -8.319   5.391
  685    HD1  PHE  88           HD2      PHE  88 140.879 -10.770   4.927
  686    HD2  PHE  88           HD1      PHE  88 137.055  -9.083   5.921
  687    HE1  PHE  88           HE2      PHE  88 139.755 -12.797   4.043
  688    HE2  PHE  88           HE1      PHE  88 135.929 -11.113   5.037
  689    HZ   PHE  88           HZ       PHE  88 137.282 -12.967   4.097
  690    H    LEU  89           HN       LEU  89 140.070  -6.324   6.872
  691    HA   LEU  89           HA       LEU  89 142.732  -5.633   7.916
  692   1HB   LEU  89           HB2      LEU  89 142.079  -4.601   5.827
  693   2HB   LEU  89           HB1      LEU  89 140.564  -4.043   6.514
  694    HG   LEU  89           HG       LEU  89 141.673  -2.439   7.906
  695   1HD1  LEU  89          HD13      LEU  89 144.187  -3.920   7.109
  696   2HD1  LEU  89          HD12      LEU  89 144.236  -2.293   7.786
  697   3HD1  LEU  89          HD11      LEU  89 143.570  -3.622   8.733
  698   1HD2  LEU  89          HD23      LEU  89 141.498  -1.998   5.385
  699   2HD2  LEU  89          HD22      LEU  89 142.661  -1.008   6.269
  700   3HD2  LEU  89          HD21      LEU  89 143.219  -2.377   5.305
  701   1H    MET   1           HT1      MET   1 166.735  -3.422  -5.004
  702   2H    MET   1           HT3      MET   1 167.945  -2.241  -5.141
  703   3H    MET   1           HT2      MET   1 167.768  -3.419  -6.352
  704    HA   MET   1           HA       MET   1 169.190  -4.738  -5.319
  705   1HB   MET   1           HB2      MET   1 169.915  -2.396  -4.404
  706   2HB   MET   1           HB1      MET   1 169.198  -2.940  -2.890
  707   1HG   MET   1           HG2      MET   1 170.661  -4.944  -2.933
  708   2HG   MET   1           HG1      MET   1 171.388  -4.367  -4.431
  709   1HE   MET   1           HE1      MET   1 173.551  -4.743  -3.342
  710   2HE   MET   1           HE3      MET   1 174.300  -3.751  -2.084
  711   3HE   MET   1           HE2      MET   1 173.122  -4.986  -1.650
  712    H    THR   2           HN       THR   2 169.098  -4.645  -2.136
  713    HA   THR   2           HA       THR   2 167.100  -6.823  -1.954
  714    HB   THR   2           HB       THR   2 168.001  -7.018   0.393
  715    HG1  THR   2           HG1      THR   2 169.214  -5.483   1.104
  716   1HG2  THR   2          HG23      THR   2 168.932  -8.311  -1.522
  717   2HG2  THR   2          HG22      THR   2 170.106  -7.021  -1.787
  718   3HG2  THR   2          HG21      THR   2 170.144  -7.954  -0.291
  719    H    THR   3           HN       THR   3 165.213  -6.682  -0.715
  720    HA   THR   3           HA       THR   3 164.217  -3.982  -0.192
  721    HB   THR   3           HB       THR   3 162.153  -5.147   0.531
  722    HG1  THR   3           HG1      THR   3 162.132  -7.272   0.811
  723   1HG2  THR   3          HG23      THR   3 163.414  -6.191  -2.022
  724   2HG2  THR   3          HG22      THR   3 161.697  -6.315  -1.633
  725   3HG2  THR   3          HG21      THR   3 162.440  -4.730  -1.848
  726    H    SER   4           HN       SER   4 163.490  -3.258   1.928
  727    HA   SER   4           HA       SER   4 165.345  -4.029   4.052
  728   1HB   SER   4           HB2      SER   4 164.320  -2.230   5.319
  729   2HB   SER   4           HB1      SER   4 164.566  -1.670   3.668
  730    HG   SER   4           HG       SER   4 162.158  -2.806   4.659
  731    H    GLN   5           HN       GLN   5 164.518  -4.613   6.234
  732    HA   GLN   5           HA       GLN   5 162.909  -6.952   6.165
  733   1HB   GLN   5           HB2      GLN   5 163.730  -5.139   8.446
  734   2HB   GLN   5           HB1      GLN   5 162.844  -6.645   8.692
  735   1HG   GLN   5           HG2      GLN   5 165.183  -7.152   8.954
  736   2HG   GLN   5           HG1      GLN   5 164.685  -7.822   7.401
  737   1HE2  GLN   5          HE22      GLN   5 167.410  -6.105   5.957
  738   2HE2  GLN   5          HE21      GLN   5 166.665  -7.601   6.249
  739    H    LYS   6           HN       LYS   6 161.994  -3.584   6.483
  740    HA   LYS   6           HA       LYS   6 159.476  -3.921   7.743
  741   1HB   LYS   6           HB2      LYS   6 160.492  -1.880   5.755
  742   2HB   LYS   6           HB1      LYS   6 158.921  -1.759   6.552
  743   1HG   LYS   6           HG2      LYS   6 159.937  -1.652   8.727
  744   2HG   LYS   6           HG1      LYS   6 161.519  -2.067   8.073
  745   1HD   LYS   6           HD2      LYS   6 161.494   0.315   8.456
  746   2HD   LYS   6           HD1      LYS   6 161.430   0.054   6.715
  747   1HE   LYS   6           HE2      LYS   6 159.116   0.572   6.610
  748   2HE   LYS   6           HE1      LYS   6 158.916   0.408   8.354
  749   1HZ   LYS   6           HZ3      LYS   6 160.795   2.403   7.302
  750   2HZ   LYS   6           HZ2      LYS   6 159.131   2.745   7.283
  751   3HZ   LYS   6           HZ1      LYS   6 159.917   2.412   8.752
  752    H    HIS   7           HN       HIS   7 160.467  -4.189   4.348
  753    HA   HIS   7           HA       HIS   7 157.872  -4.301   3.214
  754   1HB   HIS   7           HB2      HIS   7 159.815  -4.067   1.792
  755   2HB   HIS   7           HB1      HIS   7 160.467  -5.608   2.348
  756    HD2  HIS   7           HD2      HIS   7 159.315  -7.896   1.150
  757    HE1  HIS   7           HE1      HIS   7 156.724  -5.822  -1.459
  758    HE2  HIS   7           HE2      HIS   7 157.680  -8.096  -0.869
  759    H    ARG   8           HN       ARG   8 159.949  -7.032   4.264
  760    HA   ARG   8           HA       ARG   8 157.942  -9.026   3.749
  761   1HB   ARG   8           HB2      ARG   8 160.446  -9.016   5.454
  762   2HB   ARG   8           HB1      ARG   8 159.443 -10.449   5.214
  763   1HG   ARG   8           HG2      ARG   8 159.770 -10.281   2.778
  764   2HG   ARG   8           HG1      ARG   8 160.767  -8.844   3.008
  765   1HD   ARG   8           HD2      ARG   8 162.227 -10.773   2.751
  766   2HD   ARG   8           HD1      ARG   8 162.320 -10.207   4.418
  767    HE   ARG   8           HE       ARG   8 160.338 -12.135   4.495
  768   1HH1  ARG   8          HH21      ARG   8 163.573 -11.943   3.323
  769   2HH1  ARG   8          HH22      ARG   8 163.931 -13.606   3.649
  770   1HH2  ARG   8          HH11      ARG   8 160.788 -14.308   4.930
  771   2HH2  ARG   8          HH12      ARG   8 162.356 -14.946   4.561
  772    H    ASP   9           HN       ASP   9 158.779  -7.060   6.537
  773    HA   ASP   9           HA       ASP   9 157.180  -8.548   8.436
  774   1HB   ASP   9           HB2      ASP   9 158.260  -5.728   8.458
  775   2HB   ASP   9           HB1      ASP   9 157.375  -6.429   9.806
  776    H    PHE  10           HN       PHE  10 156.574  -5.727   6.355
  777    HA   PHE  10           HA       PHE  10 153.998  -5.119   7.488
  778   1HB   PHE  10           HB2      PHE  10 155.432  -3.582   6.090
  779   2HB   PHE  10           HB1      PHE  10 154.973  -4.536   4.681
  780    HD1  PHE  10           HD2      PHE  10 152.687  -4.507   3.820
  781    HD2  PHE  10           HD1      PHE  10 153.807  -2.172   7.248
  782    HE1  PHE  10           HE2      PHE  10 150.581  -3.209   3.625
  783    HE2  PHE  10           HE1      PHE  10 151.702  -0.872   7.052
  784    HZ   PHE  10           HZ       PHE  10 150.091  -1.391   5.239
  785    H    VAL  11           HN       VAL  11 154.989  -7.146   4.715
  786    HA   VAL  11           HA       VAL  11 152.176  -7.764   4.087
  787    HB   VAL  11           HB       VAL  11 153.129  -9.182   2.316
  788   1HG1  VAL  11          HG12      VAL  11 154.443  -6.457   2.579
  789   2HG1  VAL  11          HG11      VAL  11 154.329  -7.382   1.081
  790   3HG1  VAL  11          HG13      VAL  11 152.865  -6.789   1.864
  791   1HG2  VAL  11          HG22      VAL  11 155.686  -8.550   3.788
  792   2HG2  VAL  11          HG21      VAL  11 155.067 -10.123   3.296
  793   3HG2  VAL  11          HG23      VAL  11 155.706  -9.010   2.087
  794    H    ALA  12           HN       ALA  12 153.769  -8.676   6.661
  795    HA   ALA  12           HA       ALA  12 153.036 -11.588   6.463
  796   1HB   ALA  12           HB3      ALA  12 155.101 -10.247   8.227
  797   2HB   ALA  12           HB2      ALA  12 154.724 -11.970   8.212
  798   3HB   ALA  12           HB1      ALA  12 155.446 -11.213   6.792
  799    H    GLU  13           HN       GLU  13 152.131  -8.649   7.874
  800    HA   GLU  13           HA       GLU  13 150.328 -10.068   9.695
  801   1HB   GLU  13           HB2      GLU  13 151.064  -8.847  11.713
  802   2HB   GLU  13           HB1      GLU  13 152.363  -9.849  11.073
  803   1HG   GLU  13           HG2      GLU  13 153.148  -7.783   9.804
  804   2HG   GLU  13           HG1      GLU  13 152.024  -6.859  10.797
  805    HA   PRO  14           HA       PRO  14 147.476  -6.806   8.668
  806   1HB   PRO  14           HB2      PRO  14 147.305  -6.341  11.639
  807   2HB   PRO  14           HB1      PRO  14 145.996  -6.452  10.442
  808   1HG   PRO  14           HG2      PRO  14 146.577  -8.504  12.035
  809   2HG   PRO  14           HG1      PRO  14 146.098  -8.755  10.347
  810   1HD   PRO  14           HD2      PRO  14 148.781  -9.080  11.595
  811   2HD   PRO  14           HD1      PRO  14 148.113  -9.846  10.137
  812    H    MET  15           HN       MET  15 147.296  -4.435   8.713
  813    HA   MET  15           HA       MET  15 149.906  -3.143   9.253
  814   1HB   MET  15           HB2      MET  15 148.792  -1.194   8.070
  815   2HB   MET  15           HB1      MET  15 148.960  -2.657   7.099
  816   1HG   MET  15           HG2      MET  15 146.668  -3.226   7.362
  817   2HG   MET  15           HG1      MET  15 146.453  -2.083   8.688
  818   1HE   MET  15           HE2      MET  15 147.632  -2.554   5.177
  819   2HE   MET  15           HE1      MET  15 145.910  -2.521   4.812
  820   3HE   MET  15           HE3      MET  15 146.965  -1.225   4.230
  821    H    GLY  16           HN       GLY  16 146.766  -3.388  10.650
  822   1HA   GLY  16           HA2      GLY  16 145.746  -2.249  12.443
  823   2HA   GLY  16           HA1      GLY  16 147.390  -2.139  13.073
  824    H    GLU  17           HN       GLU  17 147.427  -0.029  13.808
  825    HA   GLU  17           HA       GLU  17 146.588   2.145  11.928
  826   1HB   GLU  17           HB2      GLU  17 146.985   2.098  14.928
  827   2HB   GLU  17           HB1      GLU  17 146.676   3.570  14.007
  828   1HG   GLU  17           HG2      GLU  17 144.566   2.586  13.158
  829   2HG   GLU  17           HG1      GLU  17 144.869   1.136  14.116
  830    H    LYS  18           HN       LYS  18 149.238   0.722  11.793
  831    HA   LYS  18           HA       LYS  18 151.291   2.333  12.930
  832   1HB   LYS  18           HB2      LYS  18 151.230   0.646  10.413
  833   2HB   LYS  18           HB1      LYS  18 152.697   1.424  11.001
  834   1HG   LYS  18           HG2      LYS  18 152.487   0.229  13.143
  835   2HG   LYS  18           HG1      LYS  18 151.002  -0.536  12.575
  836   1HD   LYS  18           HD2      LYS  18 152.282  -1.552  10.694
  837   2HD   LYS  18           HD1      LYS  18 153.761  -0.861  11.363
  838   1HE   LYS  18           HE2      LYS  18 153.425  -3.232  12.058
  839   2HE   LYS  18           HE1      LYS  18 153.461  -2.126  13.431
  840   1HZ   LYS  18           HZ3      LYS  18 150.915  -2.875  12.134
  841   2HZ   LYS  18           HZ2      LYS  18 151.606  -3.853  13.340
  842   3HZ   LYS  18           HZ1      LYS  18 151.168  -2.249  13.690
  843    HA   PRO  19           HA       PRO  19 150.978   6.107  10.626
  844   1HB   PRO  19           HB2      PRO  19 153.657   6.823  10.397
  845   2HB   PRO  19           HB1      PRO  19 152.685   7.039  11.865
  846   1HG   PRO  19           HG2      PRO  19 154.614   4.862  11.181
  847   2HG   PRO  19           HG1      PRO  19 154.363   5.703  12.722
  848   1HD   PRO  19           HD2      PRO  19 153.364   3.228  12.288
  849   2HD   PRO  19           HD1      PRO  19 152.495   4.420  13.275
  850    H    VAL  20           HN       VAL  20 151.247   7.019   8.536
  851    HA   VAL  20           HA       VAL  20 151.350   5.237   6.366
  852    HB   VAL  20           HB       VAL  20 150.332   7.349   5.991
  853   1HG1  VAL  20          HG12      VAL  20 152.966   8.564   6.870
  854   2HG1  VAL  20          HG11      VAL  20 151.634   9.484   6.178
  855   3HG1  VAL  20          HG13      VAL  20 151.423   8.653   7.718
  856   1HG2  VAL  20          HG22      VAL  20 151.837   6.421   4.116
  857   2HG2  VAL  20          HG21      VAL  20 151.374   8.119   3.994
  858   3HG2  VAL  20          HG23      VAL  20 152.981   7.680   4.568
  859    H    GLY  21           HN       GLY  21 153.949   7.238   7.725
  860   1HA   GLY  21           HA2      GLY  21 155.937   6.716   5.792
  861   2HA   GLY  21           HA1      GLY  21 156.271   7.093   7.480
  862    H    SER  22           HN       SER  22 154.350   4.440   7.670
  863    HA   SER  22           HA       SER  22 156.663   2.698   8.139
  864   1HB   SER  22           HB2      SER  22 153.707   2.049   8.292
  865   2HB   SER  22           HB1      SER  22 155.027   1.094   8.959
  866    HG   SER  22           HG       SER  22 153.718   3.048  10.117
  867    H    LEU  23           HN       LEU  23 154.417   3.330   5.580
  868    HA   LEU  23           HA       LEU  23 154.499   0.771   4.282
  869   1HB   LEU  23           HB2      LEU  23 154.165   3.530   3.061
  870   2HB   LEU  23           HB1      LEU  23 153.810   2.007   2.250
  871    HG   LEU  23           HG       LEU  23 152.469   2.965   4.798
  872   1HD1  LEU  23          HD13      LEU  23 151.632   3.017   1.890
  873   2HD1  LEU  23          HD12      LEU  23 150.472   3.151   3.211
  874   3HD1  LEU  23          HD11      LEU  23 151.727   4.372   3.012
  875   1HD2  LEU  23          HD23      LEU  23 152.242   0.481   3.094
  876   2HD2  LEU  23          HD22      LEU  23 152.272   0.624   4.851
  877   3HD2  LEU  23          HD21      LEU  23 150.824   1.072   3.959
  878    H    ALA  24           HN       ALA  24 155.970  -0.091   2.885
  879    HA   ALA  24           HA       ALA  24 158.674   0.854   2.973
  880   1HB   ALA  24           HB3      ALA  24 157.293  -1.096   1.113
  881   2HB   ALA  24           HB2      ALA  24 159.034  -0.821   1.113
  882   3HB   ALA  24           HB1      ALA  24 158.244  -1.487   2.544
  883    H    GLY  25           HN       GLY  25 159.780   2.208   1.633
  884   1HA   GLY  25           HA2      GLY  25 160.204   3.305  -0.504
  885   2HA   GLY  25           HA1      GLY  25 158.496   3.132  -0.905
  886    H    ILE  26           HN       ILE  26 157.937   4.033   2.011
  887    HA   ILE  26           HA       ILE  26 158.023   6.958   1.400
  888    HB   ILE  26           HB       ILE  26 156.544   5.513   3.623
  889   1HG1  ILE  26          HG12      ILE  26 155.724   4.643   1.512
  890   2HG1  ILE  26          HG11      ILE  26 154.538   5.791   2.129
  891   1HG2  ILE  26          HG23      ILE  26 156.212   8.260   2.385
  892   2HG2  ILE  26          HG22      ILE  26 155.185   7.577   3.647
  893   3HG2  ILE  26          HG21      ILE  26 156.883   7.918   3.981
  894   1HD1  ILE  26          HD13      ILE  26 155.808   7.543   0.675
  895   2HD1  ILE  26          HD12      ILE  26 156.484   6.137  -0.146
  896   3HD1  ILE  26          HD11      ILE  26 154.742   6.397  -0.135
  897    H    GLY  27           HN       GLY  27 159.755   8.045   2.314
  898   1HA   GLY  27           HA2      GLY  27 161.098   6.861   4.672
  899   2HA   GLY  27           HA1      GLY  27 161.703   8.192   3.685
  900    H    GLU  28           HN       GLU  28 161.873   8.693   6.291
  901    HA   GLU  28           HA       GLU  28 159.571   9.664   7.623
  902   1HB   GLU  28           HB2      GLU  28 162.472  10.511   7.832
  903   2HB   GLU  28           HB1      GLU  28 161.211  11.106   8.912
  904   1HG   GLU  28           HG2      GLU  28 162.223   9.240  10.024
  905   2HG   GLU  28           HG1      GLU  28 160.666   8.672   9.425
  906    H    VAL  29           HN       VAL  29 161.749  11.364   5.356
  907    HA   VAL  29           HA       VAL  29 160.474  13.927   5.713
  908    HB   VAL  29           HB       VAL  29 162.110  12.797   3.422
  909   1HG1  VAL  29          HG12      VAL  29 160.990  15.567   3.897
  910   2HG1  VAL  29          HG11      VAL  29 162.354  15.266   2.821
  911   3HG1  VAL  29          HG13      VAL  29 160.782  14.547   2.472
  912   1HG2  VAL  29          HG22      VAL  29 163.131  13.197   5.759
  913   2HG2  VAL  29          HG21      VAL  29 163.942  13.963   4.393
  914   3HG2  VAL  29          HG23      VAL  29 162.886  14.914   5.439
  915    H    LEU  30           HN       LEU  30 160.048  11.337   3.313
  916    HA   LEU  30           HA       LEU  30 157.985  12.665   1.827
  917   1HB   LEU  30           HB2      LEU  30 158.549   9.699   2.146
  918   2HB   LEU  30           HB1      LEU  30 157.513  10.409   0.909
  919    HG   LEU  30           HG       LEU  30 160.444  11.105   1.265
  920   1HD1  LEU  30          HD12      LEU  30 160.034   8.706   0.621
  921   2HD1  LEU  30          HD11      LEU  30 159.190   9.290  -0.813
  922   3HD1  LEU  30          HD13      LEU  30 160.907   9.633  -0.599
  923   1HD2  LEU  30          HD22      LEU  30 158.295  11.864  -0.716
  924   2HD2  LEU  30          HD21      LEU  30 159.491  12.889   0.076
  925   3HD2  LEU  30          HD23      LEU  30 159.979  11.818  -1.233
  926    H    GLY  31           HN       GLY  31 157.944  10.438   4.563
  927   1HA   GLY  31           HA2      GLY  31 155.132  10.002   4.678
  928   2HA   GLY  31           HA1      GLY  31 156.224   9.896   6.061
  929    H    LYS  32           HN       LYS  32 157.163  12.578   6.039
  930    HA   LYS  32           HA       LYS  32 155.149  13.863   7.589
  931   1HB   LYS  32           HB2      LYS  32 157.584  14.346   7.744
  932   2HB   LYS  32           HB1      LYS  32 157.504  15.136   6.169
  933   1HG   LYS  32           HG2      LYS  32 155.880  16.761   7.054
  934   2HG   LYS  32           HG1      LYS  32 155.931  15.965   8.627
  935   1HD   LYS  32           HD2      LYS  32 158.364  16.443   8.766
  936   2HD   LYS  32           HD1      LYS  32 158.269  17.295   7.225
  937   1HE   LYS  32           HE2      LYS  32 156.803  18.965   8.146
  938   2HE   LYS  32           HE1      LYS  32 156.585  18.038   9.630
  939   1HZ   LYS  32           HZ1      LYS  32 159.337  18.588   9.009
  940   2HZ   LYS  32           HZ3      LYS  32 158.417  19.991   9.263
  941   3HZ   LYS  32           HZ2      LYS  32 158.488  18.794  10.467
  942    H    LYS  33           HN       LYS  33 156.047  14.295   4.154
  943    HA   LYS  33           HA       LYS  33 154.281  16.530   3.734
  944   1HB   LYS  33           HB2      LYS  33 155.427  14.476   1.823
  945   2HB   LYS  33           HB1      LYS  33 154.501  15.884   1.302
  946   1HG   LYS  33           HG2      LYS  33 156.127  17.369   2.411
  947   2HG   LYS  33           HG1      LYS  33 157.055  15.962   2.930
  948   1HD   LYS  33           HD2      LYS  33 157.411  15.324   0.571
  949   2HD   LYS  33           HD1      LYS  33 156.487  16.733   0.052
  950   1HE   LYS  33           HE2      LYS  33 158.870  17.247  -0.063
  951   2HE   LYS  33           HE1      LYS  33 158.130  18.200   1.224
  952   1HZ   LYS  33           HZ2      LYS  33 158.811  16.190   2.681
  953   2HZ   LYS  33           HZ1      LYS  33 159.910  15.869   1.427
  954   3HZ   LYS  33           HZ3      LYS  33 159.980  17.346   2.254
  955    H    LEU  34           HN       LEU  34 153.860  13.013   3.236
  956    HA   LEU  34           HA       LEU  34 151.210  13.167   2.175
  957   1HB   LEU  34           HB2      LEU  34 152.610  11.003   3.769
  958   2HB   LEU  34           HB1      LEU  34 151.027  10.790   3.030
  959    HG   LEU  34           HG       LEU  34 153.493  11.622   1.481
  960   1HD1  LEU  34          HD13      LEU  34 153.672   9.332   2.526
  961   2HD1  LEU  34          HD12      LEU  34 152.237   8.868   1.613
  962   3HD1  LEU  34          HD11      LEU  34 153.713   9.328   0.763
  963   1HD2  LEU  34          HD22      LEU  34 150.638  10.962   0.765
  964   2HD2  LEU  34          HD21      LEU  34 151.687  12.227   0.128
  965   3HD2  LEU  34          HD23      LEU  34 151.913  10.558  -0.381
  966    H    GLU  35           HN       GLU  35 152.450  12.999   5.480
  967    HA   GLU  35           HA       GLU  35 149.930  12.772   6.809
  968   1HB   GLU  35           HB2      GLU  35 152.050  12.489   8.014
  969   2HB   GLU  35           HB1      GLU  35 152.453  14.184   7.737
  970   1HG   GLU  35           HG2      GLU  35 150.587  14.918   9.083
  971   2HG   GLU  35           HG1      GLU  35 149.972  13.271   9.215
  972    H    GLU  36           HN       GLU  36 151.717  15.620   5.681
  973    HA   GLU  36           HA       GLU  36 149.841  17.541   6.736
  974   1HB   GLU  36           HB2      GLU  36 151.894  17.693   4.513
  975   2HB   GLU  36           HB1      GLU  36 150.942  19.080   5.044
  976   1HG   GLU  36           HG2      GLU  36 151.815  18.815   7.332
  977   2HG   GLU  36           HG1      GLU  36 152.754  17.415   6.819
  978    H    ARG  37           HN       ARG  37 149.831  15.418   4.045
  979    HA   ARG  37           HA       ARG  37 147.808  16.977   2.554
  980   1HB   ARG  37           HB2      ARG  37 149.066  14.268   2.035
  981   2HB   ARG  37           HB1      ARG  37 147.906  15.040   0.959
  982   1HG   ARG  37           HG2      ARG  37 150.433  16.462   1.794
  983   2HG   ARG  37           HG1      ARG  37 150.439  15.323   0.452
  984   1HD   ARG  37           HD2      ARG  37 148.622  16.644  -0.637
  985   2HD   ARG  37           HD1      ARG  37 148.725  17.820   0.672
  986    HE   ARG  37           HE       ARG  37 151.321  17.669  -0.247
  987   1HH1  ARG  37          HH21      ARG  37 148.211  18.176  -1.642
  988   2HH1  ARG  37          HH22      ARG  37 148.796  19.207  -2.905
  989   1HH2  ARG  37          HH11      ARG  37 152.109  19.020  -1.875
  990   2HH2  ARG  37          HH12      ARG  37 151.011  19.685  -3.039
  991    H    GLY  38           HN       GLY  38 147.684  15.040   5.238
  992   1HA   GLY  38           HA2      GLY  38 145.512  14.619   6.258
  993   2HA   GLY  38           HA1      GLY  38 144.828  14.352   4.662
  994    H    PHE  39           HN       PHE  39 147.801  12.738   4.838
  995    HA   PHE  39           HA       PHE  39 146.376  10.157   5.400
  996   1HB   PHE  39           HB2      PHE  39 148.979  10.747   3.985
  997   2HB   PHE  39           HB1      PHE  39 148.332   9.131   4.248
  998    HD1  PHE  39           HD2      PHE  39 146.329   8.369   3.057
  999    HD2  PHE  39           HD1      PHE  39 147.948  12.285   2.421
 1000    HE1  PHE  39           HE2      PHE  39 144.924   8.618   1.026
 1001    HE2  PHE  39           HE1      PHE  39 146.551  12.540   0.388
 1002    HZ   PHE  39           HZ       PHE  39 145.033  10.707  -0.308
 1003    H    ASP  40           HN       ASP  40 146.604  10.769   7.775
 1004    HA   ASP  40           HA       ASP  40 149.320  10.713   8.881
 1005   1HB   ASP  40           HB2      ASP  40 148.195  10.902  11.055
 1006   2HB   ASP  40           HB1      ASP  40 147.543  12.086   9.922
 1007    H    LYS  41           HN       LYS  41 146.991   8.353   7.994
 1008    HA   LYS  41           HA       LYS  41 148.501   6.274   9.550
 1009   1HB   LYS  41           HB2      LYS  41 145.520   6.302   8.966
 1010   2HB   LYS  41           HB1      LYS  41 146.395   5.022   9.804
 1011   1HG   LYS  41           HG2      LYS  41 146.291   7.892  10.773
 1012   2HG   LYS  41           HG1      LYS  41 145.192   6.635  11.331
 1013   1HD   LYS  41           HD2      LYS  41 147.329   5.298  11.929
 1014   2HD   LYS  41           HD1      LYS  41 148.178   6.833  11.747
 1015   1HE   LYS  41           HE2      LYS  41 145.805   6.397  13.580
 1016   2HE   LYS  41           HE1      LYS  41 147.489   6.404  14.101
 1017   1HZ   LYS  41           HZ2      LYS  41 147.242   8.687  12.642
 1018   2HZ   LYS  41           HZ1      LYS  41 145.768   8.604  13.482
 1019   3HZ   LYS  41           HZ3      LYS  41 147.232   8.586  14.338
 1020    H    ALA  42           HN       ALA  42 148.762   4.280   8.467
 1021    HA   ALA  42           HA       ALA  42 149.151   4.474   5.646
 1022   1HB   ALA  42           HB3      ALA  42 149.105   2.124   7.539
 1023   2HB   ALA  42           HB2      ALA  42 149.473   1.951   5.822
 1024   3HB   ALA  42           HB1      ALA  42 150.510   2.939   6.851
 1025    H    TYR  43           HN       TYR  43 146.501   2.942   7.500
 1026    HA   TYR  43           HA       TYR  43 145.305   1.646   5.284
 1027   1HB   TYR  43           HB2      TYR  43 143.293   1.447   6.589
 1028   2HB   TYR  43           HB1      TYR  43 144.672   1.244   7.667
 1029    HD1  TYR  43           HD1      TYR  43 142.152   3.708   6.467
 1030    HD2  TYR  43           HD2      TYR  43 144.998   2.688   9.513
 1031    HE1  TYR  43           HE1      TYR  43 141.302   5.560   7.881
 1032    HE2  TYR  43           HE2      TYR  43 144.154   4.541  10.926
 1033    HH   TYR  43           HH       TYR  43 141.874   5.824  11.099
 1034    H    VAL  44           HN       VAL  44 145.369   5.048   5.980
 1035    HA   VAL  44           HA       VAL  44 142.988   5.633   4.351
 1036    HB   VAL  44           HB       VAL  44 145.240   7.477   5.254
 1037   1HG1  VAL  44          HG12      VAL  44 142.490   8.073   4.111
 1038   2HG1  VAL  44          HG11      VAL  44 143.631   9.279   4.704
 1039   3HG1  VAL  44          HG13      VAL  44 144.018   8.324   3.274
 1040   1HG2  VAL  44          HG21      VAL  44 142.485   6.899   6.384
 1041   2HG2  VAL  44          HG23      VAL  44 144.034   6.630   7.180
 1042   3HG2  VAL  44          HG22      VAL  44 143.474   8.273   6.875
 1043    H    VAL  45           HN       VAL  45 146.408   5.305   4.005
 1044    HA   VAL  45           HA       VAL  45 146.614   6.350   1.293
 1045    HB   VAL  45           HB       VAL  45 148.466   4.585   2.924
 1046   1HG1  VAL  45          HG12      VAL  45 148.823   5.944   0.239
 1047   2HG1  VAL  45          HG11      VAL  45 150.173   5.364   1.214
 1048   3HG1  VAL  45          HG13      VAL  45 148.977   4.225   0.598
 1049   1HG2  VAL  45          HG21      VAL  45 148.503   7.547   2.276
 1050   2HG2  VAL  45          HG23      VAL  45 148.103   6.840   3.840
 1051   3HG2  VAL  45          HG22      VAL  45 149.732   6.685   3.193
 1052    H    LEU  46           HN       LEU  46 146.308   3.130   2.773
 1053    HA   LEU  46           HA       LEU  46 146.565   1.632   0.358
 1054   1HB   LEU  46           HB2      LEU  46 146.547   0.560   2.605
 1055   2HB   LEU  46           HB1      LEU  46 144.854   1.013   2.796
 1056    HG   LEU  46           HG       LEU  46 144.266  -0.344   0.818
 1057   1HD1  LEU  46          HD12      LEU  46 147.242  -0.706   0.698
 1058   2HD1  LEU  46          HD11      LEU  46 146.205  -2.014   0.133
 1059   3HD1  LEU  46          HD13      LEU  46 146.096  -0.422  -0.611
 1060   1HD2  LEU  46          HD21      LEU  46 144.633  -1.276   3.298
 1061   2HD2  LEU  46          HD23      LEU  46 144.186  -2.341   1.968
 1062   3HD2  LEU  46          HD22      LEU  46 145.865  -2.244   2.486
 1063    H    GLY  47           HN       GLY  47 143.882   3.282   1.906
 1064   1HA   GLY  47           HA2      GLY  47 141.762   2.401   0.246
 1065   2HA   GLY  47           HA1      GLY  47 141.814   3.980   1.035
 1066    H    GLN  48           HN       GLN  48 144.126   5.049  -0.232
 1067    HA   GLN  48           HA       GLN  48 143.022   6.071  -2.652
 1068   1HB   GLN  48           HB2      GLN  48 144.859   7.124  -1.265
 1069   2HB   GLN  48           HB1      GLN  48 145.965   5.924  -1.931
 1070   1HG   GLN  48           HG2      GLN  48 146.157   7.930  -3.268
 1071   2HG   GLN  48           HG1      GLN  48 145.319   6.714  -4.235
 1072   1HE2  GLN  48          HE22      GLN  48 142.484   8.745  -4.641
 1073   2HE2  GLN  48          HE21      GLN  48 143.419   7.440  -5.191
 1074    H    PHE  49           HN       PHE  49 145.460   3.533  -2.093
 1075    HA   PHE  49           HA       PHE  49 146.026   2.925  -4.818
 1076   1HB   PHE  49           HB2      PHE  49 147.353   2.107  -2.898
 1077   2HB   PHE  49           HB1      PHE  49 145.998   1.108  -2.386
 1078    HD1  PHE  49           HD1      PHE  49 148.080   1.766  -5.445
 1079    HD2  PHE  49           HD2      PHE  49 145.969  -1.129  -3.070
 1080    HE1  PHE  49           HE1      PHE  49 148.887  -0.049  -6.933
 1081    HE2  PHE  49           HE2      PHE  49 146.775  -2.938  -4.561
 1082    HZ   PHE  49           HZ       PHE  49 148.235  -2.399  -6.489
 1083    H    LEU  50           HN       LEU  50 143.562   1.741  -2.601
 1084    HA   LEU  50           HA       LEU  50 142.446  -0.208  -4.426
 1085   1HB   LEU  50           HB2      LEU  50 141.269   1.220  -2.025
 1086   2HB   LEU  50           HB1      LEU  50 140.442  -0.077  -2.883
 1087    HG   LEU  50           HG       LEU  50 143.212  -0.361  -1.676
 1088   1HD1  LEU  50          HD13      LEU  50 140.481  -1.024  -0.550
 1089   2HD1  LEU  50          HD12      LEU  50 141.975  -1.720   0.080
 1090   3HD1  LEU  50          HD11      LEU  50 141.711   0.023   0.156
 1091   1HD2  LEU  50          HD23      LEU  50 141.270  -2.225  -3.043
 1092   2HD2  LEU  50          HD22      LEU  50 143.016  -2.092  -3.247
 1093   3HD2  LEU  50          HD21      LEU  50 142.358  -2.865  -1.811
 1094    H    VAL  51           HN       VAL  51 141.729   3.187  -3.728
 1095    HA   VAL  51           HA       VAL  51 139.413   3.363  -5.410
 1096    HB   VAL  51           HB       VAL  51 141.361   5.466  -4.428
 1097   1HG1  VAL  51          HG13      VAL  51 138.806   5.718  -6.032
 1098   2HG1  VAL  51          HG12      VAL  51 139.440   7.040  -5.052
 1099   3HG1  VAL  51          HG11      VAL  51 140.388   6.408  -6.398
 1100   1HG2  VAL  51          HG23      VAL  51 139.838   4.166  -2.824
 1101   2HG2  VAL  51          HG22      VAL  51 139.690   5.923  -2.783
 1102   3HG2  VAL  51          HG21      VAL  51 138.486   4.954  -3.634
 1103    H    LEU  52           HN       LEU  52 142.849   3.468  -6.102
 1104    HA   LEU  52           HA       LEU  52 142.421   4.563  -8.812
 1105   1HB   LEU  52           HB2      LEU  52 144.891   3.543  -7.384
 1106   2HB   LEU  52           HB1      LEU  52 144.902   4.171  -9.028
 1107    HG   LEU  52           HG       LEU  52 143.911   5.738  -6.626
 1108   1HD1  LEU  52          HD12      LEU  52 146.625   5.533  -7.930
 1109   2HD1  LEU  52          HD11      LEU  52 146.136   7.013  -7.107
 1110   3HD1  LEU  52          HD13      LEU  52 146.218   5.494  -6.215
 1111   1HD2  LEU  52          HD23      LEU  52 144.270   6.330  -9.564
 1112   2HD2  LEU  52          HD22      LEU  52 142.948   6.783  -8.488
 1113   3HD2  LEU  52          HD21      LEU  52 144.485   7.633  -8.395
 1114    H    LYS  53           HN       LYS  53 141.568   1.693  -7.707
 1115    HA   LYS  53           HA       LYS  53 141.492  -0.481  -8.592
 1116   1HB   LYS  53           HB2      LYS  53 141.690   1.228 -11.074
 1117   2HB   LYS  53           HB1      LYS  53 141.342  -0.499 -11.115
 1118   1HG   LYS  53           HG2      LYS  53 139.371  -0.147  -9.675
 1119   2HG   LYS  53           HG1      LYS  53 139.703   1.582  -9.634
 1120   1HD   LYS  53           HD2      LYS  53 139.407   0.217 -12.305
 1121   2HD   LYS  53           HD1      LYS  53 137.960   0.590 -11.376
 1122   1HE   LYS  53           HE2      LYS  53 138.376   2.443 -12.863
 1123   2HE   LYS  53           HE1      LYS  53 138.755   2.981 -11.230
 1124   1HZ   LYS  53           HZ2      LYS  53 140.875   1.816 -12.899
 1125   2HZ   LYS  53           HZ1      LYS  53 140.401   3.425 -13.164
 1126   3HZ   LYS  53           HZ3      LYS  53 140.995   2.957 -11.646
 1127    H    LYS  54           HN       LYS  54 144.126   0.311  -7.782
 1128    HA   LYS  54           HA       LYS  54 146.347  -0.413  -7.941
 1129   1HB   LYS  54           HB2      LYS  54 145.151  -2.452  -9.854
 1130   2HB   LYS  54           HB1      LYS  54 146.740  -2.545  -9.104
 1131   1HG   LYS  54           HG2      LYS  54 145.701  -2.578  -6.872
 1132   2HG   LYS  54           HG1      LYS  54 144.103  -2.474  -7.607
 1133   1HD   LYS  54           HD2      LYS  54 144.512  -4.609  -8.789
 1134   2HD   LYS  54           HD1      LYS  54 146.099  -4.721  -8.026
 1135   1HE   LYS  54           HE2      LYS  54 144.998  -4.702  -5.793
 1136   2HE   LYS  54           HE1      LYS  54 143.427  -4.679  -6.592
 1137   1HZ   LYS  54           HZ1      LYS  54 145.473  -6.788  -7.003
 1138   2HZ   LYS  54           HZ3      LYS  54 144.173  -6.923  -5.922
 1139   3HZ   LYS  54           HZ2      LYS  54 143.878  -6.782  -7.589
 1140    H    ASP  55           HN       ASP  55 145.112   1.508 -10.090
 1141    HA   ASP  55           HA       ASP  55 146.632   0.999 -12.502
 1142   1HB   ASP  55           HB2      ASP  55 145.363   3.498 -11.360
 1143   2HB   ASP  55           HB1      ASP  55 146.208   3.490 -12.908
 1144    H    GLU  56           HN       GLU  56 148.835   0.805 -12.301
 1145    HA   GLU  56           HA       GLU  56 150.410   2.056 -10.282
 1146   1HB   GLU  56           HB2      GLU  56 151.069   0.010 -11.543
 1147   2HB   GLU  56           HB1      GLU  56 151.359   1.020 -12.961
 1148   1HG   GLU  56           HG2      GLU  56 153.104   2.233 -11.851
 1149   2HG   GLU  56           HG1      GLU  56 152.695   1.519 -10.292
 1150    H    ASP  57           HN       ASP  57 149.803   3.074 -13.650
 1151    HA   ASP  57           HA       ASP  57 151.746   5.204 -13.602
 1152   1HB   ASP  57           HB2      ASP  57 149.257   4.765 -15.271
 1153   2HB   ASP  57           HB1      ASP  57 150.376   6.103 -15.536
 1154    H    LEU  58           HN       LEU  58 148.318   5.045 -12.836
 1155    HA   LEU  58           HA       LEU  58 148.074   7.900 -12.324
 1156   1HB   LEU  58           HB2      LEU  58 146.384   5.560 -11.415
 1157   2HB   LEU  58           HB1      LEU  58 145.973   7.238 -11.089
 1158    HG   LEU  58           HG       LEU  58 146.387   6.075 -13.860
 1159   1HD1  LEU  58          HD11      LEU  58 143.886   6.642 -12.248
 1160   2HD1  LEU  58          HD13      LEU  58 143.870   6.413 -13.997
 1161   3HD1  LEU  58          HD12      LEU  58 144.395   5.102 -12.941
 1162   1HD2  LEU  58          HD21      LEU  58 145.765   8.820 -12.792
 1163   2HD2  LEU  58          HD23      LEU  58 146.761   8.353 -14.170
 1164   3HD2  LEU  58          HD22      LEU  58 145.007   8.329 -14.306
 1165    H    PHE  59           HN       PHE  59 148.771   5.070 -10.322
 1166    HA   PHE  59           HA       PHE  59 148.769   6.443  -7.798
 1167   1HB   PHE  59           HB2      PHE  59 148.692   4.008  -7.879
 1168   2HB   PHE  59           HB1      PHE  59 150.249   3.954  -8.705
 1169    HD1  PHE  59           HD1      PHE  59 148.576   4.938  -5.524
 1170    HD2  PHE  59           HD2      PHE  59 152.292   4.051  -7.490
 1171    HE1  PHE  59           HE1      PHE  59 149.734   4.920  -3.329
 1172    HE2  PHE  59           HE2      PHE  59 153.450   4.036  -5.297
 1173    HZ   PHE  59           HZ       PHE  59 152.171   4.472  -3.216
 1174    H    ARG  60           HN       ARG  60 151.418   5.604 -10.043
 1175    HA   ARG  60           HA       ARG  60 153.511   6.796  -8.545
 1176   1HB   ARG  60           HB2      ARG  60 153.174   6.360 -11.520
 1177   2HB   ARG  60           HB1      ARG  60 154.665   6.969 -10.804
 1178   1HG   ARG  60           HG2      ARG  60 154.829   4.951  -9.411
 1179   2HG   ARG  60           HG1      ARG  60 153.336   4.336 -10.104
 1180   1HD   ARG  60           HD2      ARG  60 154.367   4.325 -12.341
 1181   2HD   ARG  60           HD1      ARG  60 155.862   4.965 -11.659
 1182    HE   ARG  60           HE       ARG  60 155.408   2.652 -10.199
 1183   1HH1  ARG  60          HH21      ARG  60 155.569   3.503 -13.539
 1184   2HH1  ARG  60          HH22      ARG  60 156.205   1.970 -14.034
 1185   1HH2  ARG  60          HH11      ARG  60 156.244   0.649 -10.829
 1186   2HH2  ARG  60          HH12      ARG  60 156.591   0.358 -12.501
 1187    H    GLU  61           HN       GLU  61 151.506   8.227 -11.164
 1188    HA   GLU  61           HA       GLU  61 152.805  10.778 -11.099
 1189   1HB   GLU  61           HB2      GLU  61 150.013   9.943 -11.927
 1190   2HB   GLU  61           HB1      GLU  61 150.644  11.574 -12.156
 1191   1HG   GLU  61           HG2      GLU  61 152.510  10.665 -13.497
 1192   2HG   GLU  61           HG1      GLU  61 151.873   9.036 -13.271
 1193    H    TRP  62           HN       TRP  62 150.097   9.418  -9.253
 1194    HA   TRP  62           HA       TRP  62 149.331  11.881  -7.987
 1195   1HB   TRP  62           HB2      TRP  62 147.761  10.086  -7.920
 1196   2HB   TRP  62           HB1      TRP  62 148.953   8.973  -7.255
 1197    HD1  TRP  62           HD1      TRP  62 146.697  11.899  -6.271
 1198    HE1  TRP  62           HE1      TRP  62 146.527  11.990  -3.702
 1199    HE3  TRP  62           HE3      TRP  62 150.178   8.368  -5.037
 1200    HZ2  TRP  62           HZ2      TRP  62 147.730  10.733  -1.415
 1201    HZ3  TRP  62           HZ3      TRP  62 150.632   7.830  -2.661
 1202    HH2  TRP  62           HH2      TRP  62 149.416   9.007  -0.852
 1203    H    LEU  63           HN       LEU  63 151.550   9.277  -6.981
 1204    HA   LEU  63           HA       LEU  63 152.142  10.454  -4.425
 1205   1HB   LEU  63           HB2      LEU  63 152.527   8.075  -4.912
 1206   2HB   LEU  63           HB1      LEU  63 153.748   8.508  -6.105
 1207    HG   LEU  63           HG       LEU  63 155.108   9.559  -4.332
 1208   1HD1  LEU  63          HD13      LEU  63 152.731   8.817  -2.647
 1209   2HD1  LEU  63          HD12      LEU  63 154.331   8.886  -1.912
 1210   3HD1  LEU  63          HD11      LEU  63 153.650  10.321  -2.670
 1211   1HD2  LEU  63          HD22      LEU  63 154.216   6.706  -3.873
 1212   2HD2  LEU  63          HD21      LEU  63 155.601   7.260  -4.815
 1213   3HD2  LEU  63          HD23      LEU  63 155.607   7.423  -3.058
 1214    H    LYS  64           HN       LYS  64 153.939  10.462  -7.496
 1215    HA   LYS  64           HA       LYS  64 156.108  12.069  -6.556
 1216   1HB   LYS  64           HB2      LYS  64 156.211  10.798  -8.673
 1217   2HB   LYS  64           HB1      LYS  64 155.017  11.890  -9.377
 1218   1HG   LYS  64           HG2      LYS  64 156.517  13.787  -9.116
 1219   2HG   LYS  64           HG1      LYS  64 157.689  12.786  -8.256
 1220   1HD   LYS  64           HD2      LYS  64 158.042  11.423 -10.240
 1221   2HD   LYS  64           HD1      LYS  64 156.792  12.313 -11.109
 1222   1HE   LYS  64           HE2      LYS  64 159.355  13.508 -10.014
 1223   2HE   LYS  64           HE1      LYS  64 159.049  13.131 -11.710
 1224   1HZ   LYS  64           HZ3      LYS  64 156.987  14.611 -11.373
 1225   2HZ   LYS  64           HZ2      LYS  64 157.823  15.208 -10.020
 1226   3HZ   LYS  64           HZ1      LYS  64 158.500  15.352 -11.572
 1227    H    ASP  65           HN       ASP  65 153.112  13.005  -8.231
 1228    HA   ASP  65           HA       ASP  65 153.703  15.825  -8.189
 1229   1HB   ASP  65           HB2      ASP  65 151.120  14.279  -8.506
 1230   2HB   ASP  65           HB1      ASP  65 151.194  16.039  -8.586
 1231    H    THR  66           HN       THR  66 152.293  13.612  -5.871
 1232    HA   THR  66           HA       THR  66 151.137  15.723  -4.235
 1233    HB   THR  66           HB       THR  66 151.625  12.782  -3.697
 1234    HG1  THR  66           HG1      THR  66 149.989  13.805  -5.276
 1235   1HG2  THR  66          HG23      THR  66 150.230  14.918  -2.072
 1236   2HG2  THR  66          HG22      THR  66 149.931  13.195  -1.845
 1237   3HG2  THR  66          HG21      THR  66 151.540  13.856  -1.557
 1238    H    CYS  67           HN       CYS  67 154.216  13.885  -4.147
 1239    HA   CYS  67           HA       CYS  67 155.054  15.693  -1.891
 1240   1HB   CYS  67           HB2      CYS  67 156.250  13.821  -0.889
 1241   2HB   CYS  67           HB1      CYS  67 154.542  13.416  -1.071
 1242    HG   CYS  67           HG       CYS  67 155.436  11.420  -2.261
 1243    H    GLY  68           HN       GLY  68 156.061  13.918  -4.783
 1244   1HA   GLY  68           HA2      GLY  68 157.790  14.859  -6.234
 1245   2HA   GLY  68           HA1      GLY  68 158.573  15.549  -4.812
 1246    H    ALA  69           HN       ALA  69 157.364  12.374  -4.350
 1247    HA   ALA  69           HA       ALA  69 159.847  11.239  -3.659
 1248   1HB   ALA  69           HB1      ALA  69 157.391   9.842  -4.756
 1249   2HB   ALA  69           HB3      ALA  69 158.720   9.049  -3.912
 1250   3HB   ALA  69           HB2      ALA  69 157.700  10.207  -3.059
 1251    H    ASN  70           HN       ASN  70 161.213   9.692  -4.819
 1252    HA   ASN  70           HA       ASN  70 161.457  10.384  -7.674
 1253   1HB   ASN  70           HB2      ASN  70 163.428  10.261  -6.114
 1254   2HB   ASN  70           HB1      ASN  70 163.160   8.522  -5.996
 1255   1HD2  ASN  70          HD22      ASN  70 165.500   8.474  -8.716
 1256   2HD2  ASN  70          HD21      ASN  70 165.373   8.326  -7.029
 1257    H    ALA  71           HN       ALA  71 161.956   8.500  -9.196
 1258    HA   ALA  71           HA       ALA  71 159.704   6.766  -9.348
 1259   1HB   ALA  71           HB2      ALA  71 161.170   7.508 -11.260
 1260   2HB   ALA  71           HB1      ALA  71 162.374   6.346 -10.703
 1261   3HB   ALA  71           HB3      ALA  71 160.795   5.785 -11.252
 1262    H    LYS  72           HN       LYS  72 162.875   6.266  -7.850
 1263    HA   LYS  72           HA       LYS  72 162.612   3.382  -7.725
 1264   1HB   LYS  72           HB2      LYS  72 164.777   4.631  -7.503
 1265   2HB   LYS  72           HB1      LYS  72 164.249   5.174  -5.912
 1266   1HG   LYS  72           HG2      LYS  72 164.022   2.814  -5.194
 1267   2HG   LYS  72           HG1      LYS  72 164.593   2.288  -6.778
 1268   1HD   LYS  72           HD2      LYS  72 166.160   4.021  -4.841
 1269   2HD   LYS  72           HD1      LYS  72 166.422   2.298  -5.101
 1270   1HE   LYS  72           HE2      LYS  72 168.015   3.161  -6.552
 1271   2HE   LYS  72           HE1      LYS  72 166.641   3.076  -7.652
 1272   1HZ   LYS  72           HZ1      LYS  72 166.904   5.496  -6.046
 1273   2HZ   LYS  72           HZ3      LYS  72 168.044   5.277  -7.283
 1274   3HZ   LYS  72           HZ2      LYS  72 166.389   5.309  -7.653
 1275    H    GLN  73           HN       GLN  73 161.831   6.022  -5.502
 1276    HA   GLN  73           HA       GLN  73 161.072   4.351  -3.301
 1277   1HB   GLN  73           HB2      GLN  73 160.193   7.164  -4.020
 1278   2HB   GLN  73           HB1      GLN  73 159.934   6.391  -2.456
 1279   1HG   GLN  73           HG2      GLN  73 162.664   6.800  -3.711
 1280   2HG   GLN  73           HG1      GLN  73 161.956   7.883  -2.514
 1281   1HE2  GLN  73          HE22      GLN  73 164.035   4.978  -1.008
 1282   2HE2  GLN  73          HE21      GLN  73 164.334   5.861  -2.427
 1283    H    SER  74           HN       SER  74 159.236   5.733  -6.016
 1284    HA   SER  74           HA       SER  74 156.671   4.934  -5.082
 1285   1HB   SER  74           HB2      SER  74 157.686   5.377  -7.898
 1286   2HB   SER  74           HB1      SER  74 155.992   5.222  -7.447
 1287    HG   SER  74           HG       SER  74 157.736   7.324  -7.122
 1288    H    ARG  75           HN       ARG  75 159.081   3.217  -7.115
 1289    HA   ARG  75           HA       ARG  75 157.384   1.044  -7.815
 1290   1HB   ARG  75           HB2      ARG  75 160.388   1.169  -7.450
 1291   2HB   ARG  75           HB1      ARG  75 159.551  -0.258  -8.061
 1292   1HG   ARG  75           HG2      ARG  75 158.548   1.165  -9.860
 1293   2HG   ARG  75           HG1      ARG  75 159.534   2.508  -9.296
 1294   1HD   ARG  75           HD2      ARG  75 160.522  -0.131 -10.405
 1295   2HD   ARG  75           HD1      ARG  75 160.689   1.457 -11.147
 1296    HE   ARG  75           HE       ARG  75 161.951   1.702  -8.674
 1297   1HH1  ARG  75          HH21      ARG  75 162.139  -0.358 -11.438
 1298   2HH1  ARG  75          HH22      ARG  75 163.829  -0.686 -11.244
 1299   1HH2  ARG  75          HH11      ARG  75 164.157   1.281  -8.404
 1300   2HH2  ARG  75          HH12      ARG  75 164.971   0.244  -9.527
 1301    H    ASP  76           HN       ASP  76 159.348   1.596  -4.887
 1302    HA   ASP  76           HA       ASP  76 158.952  -1.027  -3.815
 1303   1HB   ASP  76           HB2      ASP  76 159.551   1.627  -2.494
 1304   2HB   ASP  76           HB1      ASP  76 159.506   0.098  -1.615
 1305    H    CYS  77           HN       CYS  77 157.029   1.981  -3.464
 1306    HA   CYS  77           HA       CYS  77 155.265   0.877  -1.481
 1307   1HB   CYS  77           HB2      CYS  77 154.972   3.163  -3.444
 1308   2HB   CYS  77           HB1      CYS  77 153.756   2.771  -2.230
 1309    HG   CYS  77           HG       CYS  77 155.986   3.023  -0.524
 1310    H    PHE  78           HN       PHE  78 155.125   1.011  -5.054
 1311    HA   PHE  78           HA       PHE  78 152.465   0.073  -5.341
 1312   1HB   PHE  78           HB2      PHE  78 153.718   0.916  -7.244
 1313   2HB   PHE  78           HB1      PHE  78 154.908  -0.373  -7.084
 1314    HD1  PHE  78           HD2      PHE  78 154.378  -2.673  -7.727
 1315    HD2  PHE  78           HD1      PHE  78 151.485   0.474  -8.152
 1316    HE1  PHE  78           HE2      PHE  78 153.003  -4.134  -9.185
 1317    HE2  PHE  78           HE1      PHE  78 150.111  -0.987  -9.608
 1318    HZ   PHE  78           HZ       PHE  78 150.870  -3.291 -10.128
 1319    H    GLY  79           HN       GLY  79 155.433  -1.901  -5.636
 1320   1HA   GLY  79           HA2      GLY  79 154.087  -4.403  -5.572
 1321   2HA   GLY  79           HA1      GLY  79 155.795  -4.174  -5.208
 1322    H    CYS  80           HN       CYS  80 155.235  -2.342  -2.957
 1323    HA   CYS  80           HA       CYS  80 155.008  -4.353  -0.884
 1324   1HB   CYS  80           HB2      CYS  80 156.301  -2.240  -0.632
 1325   2HB   CYS  80           HB1      CYS  80 154.784  -1.341  -0.636
 1326    HG   CYS  80           HG       CYS  80 155.659  -2.033   1.860
 1327    H    LEU  81           HN       LEU  81 152.812  -1.701  -1.929
 1328    HA   LEU  81           HA       LEU  81 150.710  -2.547  -0.138
 1329   1HB   LEU  81           HB2      LEU  81 150.606  -0.842  -2.651
 1330   2HB   LEU  81           HB1      LEU  81 149.310  -0.983  -1.461
 1331    HG   LEU  81           HG       LEU  81 152.112   0.022  -0.862
 1332   1HD1  LEU  81          HD13      LEU  81 150.845   1.575  -2.298
 1333   2HD1  LEU  81          HD12      LEU  81 149.499   1.535  -1.160
 1334   3HD1  LEU  81          HD11      LEU  81 151.042   2.235  -0.675
 1335   1HD2  LEU  81          HD22      LEU  81 149.638  -0.441   0.801
 1336   2HD2  LEU  81          HD21      LEU  81 151.324  -0.785   1.192
 1337   3HD2  LEU  81          HD23      LEU  81 150.731   0.873   1.231
 1338    H    ARG  82           HN       ARG  82 151.454  -3.178  -3.565
 1339    HA   ARG  82           HA       ARG  82 149.050  -4.572  -4.196
 1340   1HB   ARG  82           HB2      ARG  82 150.702  -3.826  -5.892
 1341   2HB   ARG  82           HB1      ARG  82 151.828  -5.051  -5.310
 1342   1HG   ARG  82           HG2      ARG  82 150.236  -6.827  -5.901
 1343   2HG   ARG  82           HG1      ARG  82 149.069  -5.620  -6.439
 1344   1HD   ARG  82           HD2      ARG  82 150.655  -4.843  -8.158
 1345   2HD   ARG  82           HD1      ARG  82 151.833  -6.040  -7.617
 1346    HE   ARG  82           HE       ARG  82 149.581  -7.547  -8.203
 1347   1HH1  ARG  82          HH21      ARG  82 151.483  -5.172  -9.829
 1348   2HH1  ARG  82          HH22      ARG  82 151.213  -5.844 -11.403
 1349   1HH2  ARG  82          HH11      ARG  82 149.222  -8.439 -10.251
 1350   2HH2  ARG  82          HH12      ARG  82 149.936  -7.692 -11.641
 1351    H    GLU  83           HN       GLU  83 152.111  -5.733  -2.812
 1352    HA   GLU  83           HA       GLU  83 151.319  -8.506  -2.800
 1353   1HB   GLU  83           HB2      GLU  83 153.470  -6.992  -1.310
 1354   2HB   GLU  83           HB1      GLU  83 153.225  -8.733  -1.135
 1355   1HG   GLU  83           HG2      GLU  83 153.590  -9.079  -3.508
 1356   2HG   GLU  83           HG1      GLU  83 153.671  -7.343  -3.792
 1357    H    TRP  84           HN       TRP  84 151.024  -5.886  -0.402
 1358    HA   TRP  84           HA       TRP  84 150.181  -7.496   1.797
 1359   1HB   TRP  84           HB2      TRP  84 150.775  -5.031   1.876
 1360   2HB   TRP  84           HB1      TRP  84 149.215  -4.696   1.124
 1361    HD1  TRP  84           HD1      TRP  84 150.807  -5.839   4.373
 1362    HE1  TRP  84           HE1      TRP  84 149.015  -5.844   6.231
 1363    HE3  TRP  84           HE3      TRP  84 146.625  -4.967   1.575
 1364    HZ2  TRP  84           HZ2      TRP  84 146.194  -5.527   6.493
 1365    HZ3  TRP  84           HZ3      TRP  84 144.399  -4.828   2.657
 1366    HH2  TRP  84           HH2      TRP  84 144.187  -5.112   5.107
 1367    H    CYS  85           HN       CYS  85 148.381  -5.907  -0.820
 1368    HA   CYS  85           HA       CYS  85 145.768  -6.723  -0.009
 1369   1HB   CYS  85           HB2      CYS  85 146.920  -6.086  -2.738
 1370   2HB   CYS  85           HB1      CYS  85 145.207  -6.388  -2.461
 1371    HG   CYS  85           HG       CYS  85 146.094  -4.284  -0.531
 1372    H    ASP  86           HN       ASP  86 148.214  -8.280  -2.043
 1373    HA   ASP  86           HA       ASP  86 146.657 -10.497  -2.911
 1374   1HB   ASP  86           HB2      ASP  86 149.627 -10.216  -2.396
 1375   2HB   ASP  86           HB1      ASP  86 148.905 -11.657  -3.114
 1376    H    ALA  87           HN       ALA  87 148.388  -9.891   0.107
 1377    HA   ALA  87           HA       ALA  87 147.928 -12.635   1.067
 1378   1HB   ALA  87           HB1      ALA  87 149.968 -11.327   1.704
 1379   2HB   ALA  87           HB3      ALA  87 148.926 -10.208   2.587
 1380   3HB   ALA  87           HB2      ALA  87 149.045 -11.891   3.098
 1381    H    PHE  88           HN       PHE  88 146.592  -9.390   1.617
 1382    HA   PHE  88           HA       PHE  88 144.588 -10.567   3.505
 1383   1HB   PHE  88           HB2      PHE  88 145.418  -7.714   2.930
 1384   2HB   PHE  88           HB1      PHE  88 144.065  -8.144   3.976
 1385    HD1  PHE  88           HD2      PHE  88 144.467  -9.528   6.034
 1386    HD2  PHE  88           HD1      PHE  88 147.688  -7.928   3.679
 1387    HE1  PHE  88           HE2      PHE  88 146.033  -9.899   7.922
 1388    HE2  PHE  88           HE1      PHE  88 149.256  -8.303   5.571
 1389    HZ   PHE  88           HZ       PHE  88 148.424  -9.285   7.691
 1390    H    LEU  89           HN       LEU  89 144.123  -7.701   1.481
 1391    HA   LEU  89           HA       LEU  89 141.538  -8.789   0.589
 1392   1HB   LEU  89           HB2      LEU  89 141.551  -6.481   1.295
 1393   2HB   LEU  89           HB1      LEU  89 142.907  -6.109   0.239
 1394    HG   LEU  89           HG       LEU  89 141.560  -6.360  -1.734
 1395   1HD1  LEU  89          HD13      LEU  89 139.535  -7.554   0.170
 1396   2HD1  LEU  89          HD12      LEU  89 139.079  -6.966  -1.429
 1397   3HD1  LEU  89          HD11      LEU  89 140.235  -8.286  -1.274
 1398   1HD2  LEU  89          HD23      LEU  89 141.260  -4.278  -0.266
 1399   2HD2  LEU  89          HD22      LEU  89 139.976  -4.597  -1.432
 1400   3HD2  LEU  89          HD21      LEU  89 139.743  -5.001   0.269
   
  No H/Q in entry =        1400
  Start of MODEL    4
    1   1H    MET   1           HT1      MET   1 114.426 -10.412  10.597
    2   2H    MET   1           HT3      MET   1 113.409 -11.641  11.172
    3   3H    MET   1           HT2      MET   1 113.104 -10.023  11.589
    4    HA   MET   1           HA       MET   1 114.645  -9.975  13.204
    5   1HB   MET   1           HB2      MET   1 113.172 -11.947  13.659
    6   2HB   MET   1           HB1      MET   1 114.362 -12.978  12.870
    7   1HG   MET   1           HG2      MET   1 114.759 -13.072  15.258
    8   2HG   MET   1           HG1      MET   1 116.074 -12.160  14.525
    9   1HE   MET   1           HE3      MET   1 112.718 -12.196  15.975
   10   2HE   MET   1           HE2      MET   1 112.622 -10.863  17.122
   11   3HE   MET   1           HE1      MET   1 112.256 -10.580  15.422
   12    H    THR   2           HN       THR   2 115.767 -12.920  11.484
   13    HA   THR   2           HA       THR   2 118.543 -12.224  11.962
   14    HB   THR   2           HB       THR   2 119.038 -14.179  10.530
   15    HG1  THR   2           HG1      THR   2 117.366 -15.238   9.518
   16   1HG2  THR   2          HG22      THR   2 118.407 -14.500  12.910
   17   2HG2  THR   2          HG21      THR   2 116.723 -14.679  12.420
   18   3HG2  THR   2          HG23      THR   2 117.921 -15.866  11.905
   19    H    THR   3           HN       THR   3 120.124 -11.807  10.235
   20    HA   THR   3           HA       THR   3 119.109  -9.850   8.310
   21    HB   THR   3           HB       THR   3 121.481  -9.520   7.746
   22    HG1  THR   3           HG1      THR   3 122.879 -10.893   9.260
   23   1HG2  THR   3          HG23      THR   3 120.512  -8.487   9.816
   24   2HG2  THR   3          HG22      THR   3 121.136  -9.855  10.737
   25   3HG2  THR   3          HG21      THR   3 122.250  -8.763   9.918
   26    H    SER   4           HN       SER   4 119.972 -10.034   5.970
   27    HA   SER   4           HA       SER   4 118.985 -12.499   4.829
   28   1HB   SER   4           HB2      SER   4 119.587 -11.530   2.695
   29   2HB   SER   4           HB1      SER   4 118.952 -10.230   3.699
   30    HG   SER   4           HG       SER   4 120.872  -9.559   2.757
   31    H    GLN   5           HN       GLN   5 120.308 -13.967   3.492
   32    HA   GLN   5           HA       GLN   5 122.555 -14.979   4.899
   33   1HB   GLN   5           HB2      GLN   5 121.588 -15.456   2.074
   34   2HB   GLN   5           HB1      GLN   5 122.945 -16.333   2.784
   35   1HG   GLN   5           HG2      GLN   5 121.487 -17.111   4.617
   36   2HG   GLN   5           HG1      GLN   5 120.127 -16.240   3.908
   37   1HE2  GLN   5          HE22      GLN   5 120.896 -18.642   0.925
   38   2HE2  GLN   5          HE21      GLN   5 121.497 -17.073   1.163
   39    H    LYS   6           HN       LYS   6 122.408 -12.506   2.394
   40    HA   LYS   6           HA       LYS   6 125.093 -12.704   1.478
   41   1HB   LYS   6           HB2      LYS   6 123.216 -10.342   1.711
   42   2HB   LYS   6           HB1      LYS   6 124.792 -10.252   0.927
   43   1HG   LYS   6           HG2      LYS   6 124.116 -12.028  -0.648
   44   2HG   LYS   6           HG1      LYS   6 122.534 -12.116   0.133
   45   1HD   LYS   6           HD2      LYS   6 122.118  -9.750  -0.439
   46   2HD   LYS   6           HD1      LYS   6 123.694  -9.662  -1.223
   47   1HE   LYS   6           HE2      LYS   6 123.005 -11.412  -2.818
   48   2HE   LYS   6           HE1      LYS   6 121.429 -11.508  -2.033
   49   1HZ   LYS   6           HZ1      LYS   6 121.379  -8.982  -2.492
   50   2HZ   LYS   6           HZ3      LYS   6 122.563  -9.331  -3.655
   51   3HZ   LYS   6           HZ2      LYS   6 121.032 -10.061  -3.757
   52    H    HIS   7           HN       HIS   7 123.679 -10.956   4.247
   53    HA   HIS   7           HA       HIS   7 126.009  -9.502   4.941
   54   1HB   HIS   7           HB2      HIS   7 123.877  -8.982   5.982
   55   2HB   HIS   7           HB1      HIS   7 123.799 -10.586   6.711
   56    HD2  HIS   7           HD2      HIS   7 125.424 -10.941   9.004
   57    HE1  HIS   7           HE1      HIS   7 126.874  -6.978   9.176
   58    HE2  HIS   7           HE2      HIS   7 126.763  -9.195  10.404
   59    H    ARG   8           HN       ARG   8 124.936 -12.666   6.261
   60    HA   ARG   8           HA       ARG   8 127.329 -13.036   7.797
   61   1HB   ARG   8           HB2      ARG   8 125.268 -15.030   6.808
   62   2HB   ARG   8           HB1      ARG   8 126.518 -15.389   7.999
   63   1HG   ARG   8           HG2      ARG   8 124.591 -13.098   8.403
   64   2HG   ARG   8           HG1      ARG   8 124.160 -14.740   8.870
   65   1HD   ARG   8           HD2      ARG   8 126.299 -14.810  10.237
   66   2HD   ARG   8           HD1      ARG   8 126.479 -13.087   9.913
   67    HE   ARG   8           HE       ARG   8 123.911 -13.304  10.920
   68   1HH1  ARG   8          HH21      ARG   8 127.068 -14.285  11.884
   69   2HH1  ARG   8          HH22      ARG   8 126.742 -14.140  13.579
   70   1HH2  ARG   8          HH11      ARG   8 123.463 -13.107  13.125
   71   2HH2  ARG   8          HH12      ARG   8 124.700 -13.473  14.282
   72    H    ASP   9           HN       ASP   9 126.338 -13.918   4.555
   73    HA   ASP   9           HA       ASP   9 128.568 -15.690   4.061
   74   1HB   ASP   9           HB2      ASP   9 126.649 -14.251   2.226
   75   2HB   ASP   9           HB1      ASP   9 127.894 -15.353   1.643
   76    H    PHE  10           HN       PHE  10 127.976 -12.229   3.479
   77    HA   PHE  10           HA       PHE  10 130.390 -11.824   1.962
   78   1HB   PHE  10           HB2      PHE  10 128.394 -10.277   2.030
   79   2HB   PHE  10           HB1      PHE  10 128.913  -9.779   3.639
   80    HD1  PHE  10           HD1      PHE  10 129.721  -9.721   0.041
   81    HD2  PHE  10           HD2      PHE  10 130.923  -8.433   3.960
   82    HE1  PHE  10           HE1      PHE  10 131.308  -8.108  -0.976
   83    HE2  PHE  10           HE2      PHE  10 132.512  -6.823   2.942
   84    HZ   PHE  10           HZ       PHE  10 132.705  -6.662   0.475
   85    H    VAL  11           HN       VAL  11 129.644 -11.541   5.438
   86    HA   VAL  11           HA       VAL  11 132.387 -10.653   6.039
   87    HB   VAL  11           HB       VAL  11 131.652 -10.560   8.340
   88   1HG1  VAL  11          HG12      VAL  11 129.517  -9.656   6.385
   89   2HG1  VAL  11          HG11      VAL  11 129.553  -9.182   8.083
   90   3HG1  VAL  11          HG13      VAL  11 130.866  -8.707   7.007
   91   1HG2  VAL  11          HG22      VAL  11 129.430 -12.311   7.304
   92   2HG2  VAL  11          HG21      VAL  11 130.460 -12.552   8.712
   93   3HG2  VAL  11          HG23      VAL  11 129.182 -11.337   8.753
   94    H    ALA  12           HN       ALA  12 131.499 -13.501   4.976
   95    HA   ALA  12           HA       ALA  12 133.024 -15.089   7.027
   96   1HB   ALA  12           HB3      ALA  12 130.859 -15.956   5.096
   97   2HB   ALA  12           HB2      ALA  12 131.794 -17.058   6.109
   98   3HB   ALA  12           HB1      ALA  12 130.729 -15.863   6.852
   99    H    GLU  13           HN       GLU  13 133.184 -13.812   3.895
  100    HA   GLU  13           HA       GLU  13 135.551 -15.454   3.338
  101   1HB   GLU  13           HB2      GLU  13 134.640 -15.947   0.974
  102   2HB   GLU  13           HB1      GLU  13 133.999 -16.917   2.300
  103   1HG   GLU  13           HG2      GLU  13 131.992 -15.643   2.394
  104   2HG   GLU  13           HG1      GLU  13 132.658 -14.373   1.368
  105    HA   PRO  14           HA       PRO  14 137.206 -11.723   1.564
  106   1HB   PRO  14           HB2      PRO  14 137.580 -13.364  -0.933
  107   2HB   PRO  14           HB1      PRO  14 138.722 -12.268  -0.127
  108   1HG   PRO  14           HG2      PRO  14 138.906 -14.919   0.149
  109   2HG   PRO  14           HG1      PRO  14 139.284 -13.815   1.484
  110   1HD   PRO  14           HD2      PRO  14 136.945 -15.627   1.168
  111   2HD   PRO  14           HD1      PRO  14 137.649 -14.934   2.647
  112    H    MET  15           HN       MET  15 136.685 -10.103  -0.103
  113    HA   MET  15           HA       MET  15 133.896 -10.366  -1.069
  114   1HB   MET  15           HB2      MET  15 134.300  -7.916  -1.707
  115   2HB   MET  15           HB1      MET  15 134.345  -8.288   0.018
  116   1HG   MET  15           HG2      MET  15 136.735  -8.272   0.057
  117   2HG   MET  15           HG1      MET  15 136.832  -8.267  -1.705
  118   1HE   MET  15           HE1      MET  15 135.507  -6.690   1.352
  119   2HE   MET  15           HE3      MET  15 137.054  -5.836   1.394
  120   3HE   MET  15           HE2      MET  15 135.558  -4.941   1.133
  121    H    GLY  16           HN       GLY  16 137.123 -10.556  -2.260
  122   1HA   GLY  16           HA2      GLY  16 138.001 -10.755  -4.433
  123   2HA   GLY  16           HA1      GLY  16 136.478 -11.572  -4.787
  124    H    GLU  17           HN       GLU  17 136.045 -10.684  -6.800
  125    HA   GLU  17           HA       GLU  17 135.975  -7.703  -7.042
  126   1HB   GLU  17           HB2      GLU  17 136.053  -9.919  -9.107
  127   2HB   GLU  17           HB1      GLU  17 135.809  -8.220  -9.514
  128   1HG   GLU  17           HG2      GLU  17 137.951  -7.623  -8.538
  129   2HG   GLU  17           HG1      GLU  17 138.184  -9.269  -7.949
  130    H    LYS  18           HN       LYS  18 133.864  -9.348  -5.709
  131    HA   LYS  18           HA       LYS  18 131.608  -9.648  -7.420
  132   1HB   LYS  18           HB2      LYS  18 131.843  -9.104  -4.451
  133   2HB   LYS  18           HB1      LYS  18 130.284  -9.342  -5.240
  134   1HG   LYS  18           HG2      LYS  18 131.112 -11.535  -6.114
  135   2HG   LYS  18           HG1      LYS  18 132.594 -11.309  -5.189
  136   1HD   LYS  18           HD2      LYS  18 129.875 -11.197  -3.870
  137   2HD   LYS  18           HD1      LYS  18 130.717 -12.725  -4.107
  138   1HE   LYS  18           HE2      LYS  18 132.712 -11.679  -2.913
  139   2HE   LYS  18           HE1      LYS  18 131.644 -10.342  -2.488
  140   1HZ   LYS  18           HZ2      LYS  18 130.378 -12.802  -1.935
  141   2HZ   LYS  18           HZ1      LYS  18 131.903 -12.770  -1.188
  142   3HZ   LYS  18           HZ3      LYS  18 130.777 -11.544  -0.866
  143    HA   PRO  19           HA       PRO  19 130.591  -5.435  -8.323
  144   1HB   PRO  19           HB2      PRO  19 127.827  -5.557  -8.481
  145   2HB   PRO  19           HB1      PRO  19 128.923  -6.138  -9.751
  146   1HG   PRO  19           HG2      PRO  19 127.505  -7.685  -7.627
  147   2HG   PRO  19           HG1      PRO  19 127.774  -8.095  -9.331
  148   1HD   PRO  19           HD2      PRO  19 129.270  -9.180  -7.336
  149   2HD   PRO  19           HD1      PRO  19 129.946  -8.849  -8.946
  150    H    VAL  20           HN       VAL  20 129.697  -3.498  -7.430
  151    HA   VAL  20           HA       VAL  20 129.821  -3.232  -4.645
  152    HB   VAL  20           HB       VAL  20 129.976  -1.287  -6.087
  153   1HG1  VAL  20          HG12      VAL  20 128.290  -2.219  -7.770
  154   2HG1  VAL  20          HG11      VAL  20 127.030  -1.606  -6.700
  155   3HG1  VAL  20          HG13      VAL  20 128.176  -0.492  -7.444
  156   1HG2  VAL  20          HG21      VAL  20 128.965  -1.083  -3.747
  157   2HG2  VAL  20          HG23      VAL  20 128.603   0.240  -4.857
  158   3HG2  VAL  20          HG22      VAL  20 127.393  -0.998  -4.538
  159    H    GLY  21           HN       GLY  21 126.941  -3.688  -6.677
  160   1HA   GLY  21           HA2      GLY  21 124.972  -3.423  -4.678
  161   2HA   GLY  21           HA1      GLY  21 124.782  -4.404  -6.128
  162    H    SER  22           HN       SER  22 127.455  -5.674  -4.676
  163    HA   SER  22           HA       SER  22 125.904  -7.923  -3.610
  164   1HB   SER  22           HB2      SER  22 127.970  -8.379  -4.845
  165   2HB   SER  22           HB1      SER  22 128.892  -7.392  -3.716
  166    HG   SER  22           HG       SER  22 127.791  -9.936  -3.416
  167    H    LEU  23           HN       LEU  23 127.416  -5.057  -2.401
  168    HA   LEU  23           HA       LEU  23 127.895  -5.911   0.299
  169   1HB   LEU  23           HB2      LEU  23 127.243  -3.158  -0.791
  170   2HB   LEU  23           HB1      LEU  23 127.886  -3.481   0.816
  171    HG   LEU  23           HG       LEU  23 129.281  -4.328  -1.741
  172   1HD1  LEU  23          HD13      LEU  23 129.020  -1.826  -1.513
  173   2HD1  LEU  23          HD12      LEU  23 129.918  -1.931   0.001
  174   3HD1  LEU  23          HD11      LEU  23 130.694  -2.382  -1.517
  175   1HD2  LEU  23          HD23      LEU  23 130.002  -4.322   1.198
  176   2HD2  LEU  23          HD22      LEU  23 130.159  -5.632   0.027
  177   3HD2  LEU  23          HD21      LEU  23 131.264  -4.263  -0.031
  178    H    ALA  24           HN       ALA  24 126.559  -5.959   2.053
  179    HA   ALA  24           HA       ALA  24 123.731  -6.231   1.630
  180   1HB   ALA  24           HB1      ALA  24 125.059  -7.256   3.525
  181   2HB   ALA  24           HB3      ALA  24 125.100  -5.659   4.270
  182   3HB   ALA  24           HB2      ALA  24 123.557  -6.474   4.021
  183    H    GLY  25           HN       GLY  25 122.099  -4.769   1.785
  184   1HA   GLY  25           HA2      GLY  25 121.057  -2.734   2.617
  185   2HA   GLY  25           HA1      GLY  25 122.659  -2.043   2.873
  186    H    ILE  26           HN       ILE  26 123.410  -3.179   0.105
  187    HA   ILE  26           HA       ILE  26 122.357  -0.851  -1.440
  188    HB   ILE  26           HB       ILE  26 124.538  -2.819  -2.206
  189   1HG1  ILE  26          HG12      ILE  26 125.233  -1.716  -0.159
  190   2HG1  ILE  26          HG11      ILE  26 126.101  -0.976  -1.502
  191   1HG2  ILE  26          HG23      ILE  26 123.451  -1.478  -4.027
  192   2HG2  ILE  26          HG22      ILE  26 123.957  -0.011  -3.188
  193   3HG2  ILE  26          HG21      ILE  26 125.166  -1.125  -3.825
  194   1HD1  ILE  26          HD13      ILE  26 124.130   0.743  -1.517
  195   2HD1  ILE  26          HD12      ILE  26 123.816   0.141   0.110
  196   3HD1  ILE  26          HD11      ILE  26 125.369   0.884  -0.270
  197    H    GLY  27           HN       GLY  27 120.523  -1.321  -2.657
  198   1HA   GLY  27           HA2      GLY  27 120.026  -4.133  -3.429
  199   2HA   GLY  27           HA1      GLY  27 118.883  -2.797  -3.563
  200    H    GLU  28           HN       GLU  28 118.947  -4.240  -5.757
  201    HA   GLU  28           HA       GLU  28 120.999  -3.807  -7.650
  202   1HB   GLU  28           HB2      GLU  28 118.024  -4.228  -8.018
  203   2HB   GLU  28           HB1      GLU  28 119.170  -4.207  -9.358
  204   1HG   GLU  28           HG2      GLU  28 119.444  -6.043  -6.964
  205   2HG   GLU  28           HG1      GLU  28 118.648  -6.516  -8.466
  206    H    VAL  29           HN       VAL  29 118.149  -1.778  -6.908
  207    HA   VAL  29           HA       VAL  29 118.633   0.078  -9.060
  208    HB   VAL  29           HB       VAL  29 117.155   0.401  -6.431
  209   1HG1  VAL  29          HG11      VAL  29 117.481   2.269  -8.786
  210   2HG1  VAL  29          HG13      VAL  29 116.101   2.380  -7.693
  211   3HG1  VAL  29          HG12      VAL  29 117.737   2.616  -7.076
  212   1HG2  VAL  29          HG23      VAL  29 116.279  -0.126  -9.285
  213   2HG2  VAL  29          HG22      VAL  29 116.099  -1.205  -7.902
  214   3HG2  VAL  29          HG21      VAL  29 115.168   0.290  -7.980
  215    H    LEU  30           HN       LEU  30 119.545   0.087  -5.625
  216    HA   LEU  30           HA       LEU  30 120.913   2.610  -5.714
  217   1HB   LEU  30           HB2      LEU  30 121.323   0.245  -3.858
  218   2HB   LEU  30           HB1      LEU  30 121.963   1.862  -3.589
  219    HG   LEU  30           HG       LEU  30 119.010   1.241  -3.902
  220   1HD1  LEU  30          HD11      LEU  30 120.762   1.511  -1.451
  221   2HD1  LEU  30          HD13      LEU  30 119.012   1.725  -1.389
  222   3HD1  LEU  30          HD12      LEU  30 119.694   0.175  -1.882
  223   1HD2  LEU  30          HD23      LEU  30 120.611   3.721  -3.259
  224   2HD2  LEU  30          HD22      LEU  30 119.274   3.529  -4.393
  225   3HD2  LEU  30          HD21      LEU  30 118.961   3.552  -2.662
  226    H    GLY  31           HN       GLY  31 121.957  -0.724  -6.254
  227   1HA   GLY  31           HA2      GLY  31 124.753  -0.255  -6.362
  228   2HA   GLY  31           HA1      GLY  31 123.924  -1.551  -7.227
  229    H    LYS  32           HN       LYS  32 122.242   0.104  -8.858
  230    HA   LYS  32           HA       LYS  32 124.048   0.640 -11.021
  231   1HB   LYS  32           HB2      LYS  32 121.154   1.412 -10.573
  232   2HB   LYS  32           HB1      LYS  32 122.018   1.723 -12.079
  233   1HG   LYS  32           HG2      LYS  32 122.497  -0.689 -12.308
  234   2HG   LYS  32           HG1      LYS  32 121.629  -1.003 -10.804
  235   1HD   LYS  32           HD2      LYS  32 119.566  -0.080 -11.802
  236   2HD   LYS  32           HD1      LYS  32 120.433   0.221 -13.308
  237   1HE   LYS  32           HE2      LYS  32 120.181  -2.517 -12.040
  238   2HE   LYS  32           HE1      LYS  32 119.105  -1.922 -13.302
  239   1HZ   LYS  32           HZ3      LYS  32 121.212  -1.487 -14.610
  240   2HZ   LYS  32           HZ2      LYS  32 122.006  -2.459 -13.465
  241   3HZ   LYS  32           HZ1      LYS  32 120.756  -3.109 -14.414
  242    H    LYS  33           HN       LYS  33 122.513   2.794  -8.623
  243    HA   LYS  33           HA       LYS  33 123.318   5.240  -9.889
  244   1HB   LYS  33           HB2      LYS  33 122.736   4.586  -6.988
  245   2HB   LYS  33           HB1      LYS  33 123.024   6.220  -7.579
  246   1HG   LYS  33           HG2      LYS  33 121.129   5.993  -9.142
  247   2HG   LYS  33           HG1      LYS  33 120.837   4.357  -8.549
  248   1HD   LYS  33           HD2      LYS  33 120.434   5.247  -6.281
  249   2HD   LYS  33           HD1      LYS  33 120.722   6.883  -6.873
  250   1HE   LYS  33           HE2      LYS  33 118.801   6.775  -8.327
  251   2HE   LYS  33           HE1      LYS  33 118.585   5.056  -7.996
  252   1HZ   LYS  33           HZ1      LYS  33 118.631   6.348  -5.543
  253   2HZ   LYS  33           HZ3      LYS  33 117.616   7.270  -6.541
  254   3HZ   LYS  33           HZ2      LYS  33 117.299   5.617  -6.304
  255    H    LEU  34           HN       LEU  34 124.882   3.300  -7.323
  256    HA   LEU  34           HA       LEU  34 127.127   5.031  -6.978
  257   1HB   LEU  34           HB2      LEU  34 126.827   2.045  -6.553
  258   2HB   LEU  34           HB1      LEU  34 128.253   2.954  -6.070
  259    HG   LEU  34           HG       LEU  34 125.460   3.670  -5.146
  260   1HD1  LEU  34          HD12      LEU  34 126.101   1.377  -4.412
  261   2HD1  LEU  34          HD11      LEU  34 127.565   2.044  -3.688
  262   3HD1  LEU  34          HD13      LEU  34 125.982   2.506  -3.062
  263   1HD2  LEU  34          HD23      LEU  34 128.264   4.556  -4.422
  264   2HD2  LEU  34          HD22      LEU  34 126.849   5.544  -4.778
  265   3HD2  LEU  34          HD21      LEU  34 126.956   4.690  -3.248
  266    H    GLU  35           HN       GLU  35 126.510   2.370  -9.210
  267    HA   GLU  35           HA       GLU  35 129.142   2.206 -10.312
  268   1HB   GLU  35           HB2      GLU  35 127.400   0.525 -10.794
  269   2HB   GLU  35           HB1      GLU  35 126.502   1.725 -11.725
  270   1HG   GLU  35           HG2      GLU  35 128.395   1.944 -13.291
  271   2HG   GLU  35           HG1      GLU  35 129.318   0.776 -12.346
  272    H    GLU  36           HN       GLU  36 126.404   4.307 -11.171
  273    HA   GLU  36           HA       GLU  36 127.709   5.541 -13.429
  274   1HB   GLU  36           HB2      GLU  36 125.463   6.484 -11.624
  275   2HB   GLU  36           HB1      GLU  36 126.002   7.374 -13.047
  276   1HG   GLU  36           HG2      GLU  36 125.510   5.414 -14.463
  277   2HG   GLU  36           HG1      GLU  36 124.967   4.523 -13.041
  278    H    ARG  37           HN       ARG  37 128.016   5.871 -10.025
  279    HA   ARG  37           HA       ARG  37 129.253   8.551 -10.195
  280   1HB   ARG  37           HB2      ARG  37 128.731   6.657  -7.889
  281   2HB   ARG  37           HB1      ARG  37 129.536   8.212  -7.698
  282   1HG   ARG  37           HG2      ARG  37 126.842   8.024  -9.047
  283   2HG   ARG  37           HG1      ARG  37 126.964   8.081  -7.291
  284   1HD   ARG  37           HD2      ARG  37 128.263  10.201  -7.479
  285   2HD   ARG  37           HD1      ARG  37 128.029  10.169  -9.224
  286    HE   ARG  37           HE       ARG  37 125.460   9.974  -8.210
  287   1HH1  ARG  37          HH21      ARG  37 128.159  12.085  -7.838
  288   2HH1  ARG  37          HH22      ARG  37 127.188  13.480  -7.503
  289   1HH2  ARG  37          HH11      ARG  37 124.180  11.779  -7.779
  290   2HH2  ARG  37          HH12      ARG  37 124.935  13.306  -7.471
  291    H    GLY  38           HN       GLY  38 130.315   5.506 -10.899
  292   1HA   GLY  38           HA2      GLY  38 132.602   5.100 -11.537
  293   2HA   GLY  38           HA1      GLY  38 133.134   6.321 -10.387
  294    H    PHE  39           HN       PHE  39 130.928   3.601  -9.761
  295    HA   PHE  39           HA       PHE  39 133.039   2.313  -8.075
  296   1HB   PHE  39           HB2      PHE  39 130.189   2.909  -7.258
  297   2HB   PHE  39           HB1      PHE  39 131.277   1.860  -6.352
  298    HD1  PHE  39           HD2      PHE  39 133.226   2.783  -5.178
  299    HD2  PHE  39           HD1      PHE  39 130.526   5.306  -7.349
  300    HE1  PHE  39           HE2      PHE  39 134.213   4.779  -4.082
  301    HE2  PHE  39           HE1      PHE  39 131.507   7.307  -6.257
  302    HZ   PHE  39           HZ       PHE  39 133.352   7.041  -4.621
  303    H    ASP  40           HN       ASP  40 133.012   0.990 -10.166
  304    HA   ASP  40           HA       ASP  40 130.623  -0.652 -10.604
  305   1HB   ASP  40           HB2      ASP  40 131.934  -1.713 -12.381
  306   2HB   ASP  40           HB1      ASP  40 132.072   0.042 -12.491
  307    H    LYS  41           HN       LYS  41 133.335  -0.844  -8.517
  308    HA   LYS  41           HA       LYS  41 132.740  -3.743  -8.007
  309   1HB   LYS  41           HB2      LYS  41 135.461  -2.404  -7.901
  310   2HB   LYS  41           HB1      LYS  41 135.122  -4.091  -7.516
  311   1HG   LYS  41           HG2      LYS  41 134.402  -2.947 -10.214
  312   2HG   LYS  41           HG1      LYS  41 136.029  -3.534  -9.887
  313   1HD   LYS  41           HD2      LYS  41 135.074  -5.735  -9.217
  314   2HD   LYS  41           HD1      LYS  41 133.468  -5.149  -9.647
  315   1HE   LYS  41           HE2      LYS  41 134.459  -6.447 -11.498
  316   2HE   LYS  41           HE1      LYS  41 134.207  -4.763 -11.959
  317   1HZ   LYS  41           HZ2      LYS  41 136.781  -5.539 -10.783
  318   2HZ   LYS  41           HZ1      LYS  41 136.477  -5.933 -12.407
  319   3HZ   LYS  41           HZ3      LYS  41 136.432  -4.313 -11.906
  320    H    ALA  42           HN       ALA  42 132.938  -4.402  -5.833
  321    HA   ALA  42           HA       ALA  42 132.099  -2.489  -3.888
  322   1HB   ALA  42           HB1      ALA  42 131.626  -4.933  -3.780
  323   2HB   ALA  42           HB3      ALA  42 133.326  -5.216  -3.406
  324   3HB   ALA  42           HB2      ALA  42 132.314  -4.308  -2.281
  325    H    TYR  43           HN       TYR  43 135.329  -3.914  -4.487
  326    HA   TYR  43           HA       TYR  43 136.553  -2.888  -2.147
  327   1HB   TYR  43           HB2      TYR  43 138.693  -3.227  -3.232
  328   2HB   TYR  43           HB1      TYR  43 137.621  -4.571  -3.614
  329    HD1  TYR  43           HD1      TYR  43 138.999  -1.370  -4.918
  330    HD2  TYR  43           HD2      TYR  43 137.027  -5.065  -5.860
  331    HE1  TYR  43           HE1      TYR  43 139.344  -0.934  -7.337
  332    HE2  TYR  43           HE2      TYR  43 137.366  -4.631  -8.278
  333    HH   TYR  43           HH       TYR  43 137.711  -2.302  -9.695
  334    H    VAL  44           HN       VAL  44 135.549  -1.131  -4.979
  335    HA   VAL  44           HA       VAL  44 137.390   1.110  -4.486
  336    HB   VAL  44           HB       VAL  44 134.829   1.024  -6.128
  337   1HG1  VAL  44          HG13      VAL  44 137.116   3.020  -6.060
  338   2HG1  VAL  44          HG12      VAL  44 135.764   3.061  -7.191
  339   3HG1  VAL  44          HG11      VAL  44 135.481   3.308  -5.469
  340   1HG2  VAL  44          HG21      VAL  44 136.561  -0.535  -6.957
  341   2HG2  VAL  44          HG23      VAL  44 136.340   0.818  -8.061
  342   3HG2  VAL  44          HG22      VAL  44 137.735   0.781  -6.980
  343    H    VAL  45           HN       VAL  45 134.210   0.085  -3.630
  344    HA   VAL  45           HA       VAL  45 133.396   2.597  -2.353
  345    HB   VAL  45           HB       VAL  45 132.226  -0.191  -2.086
  346   1HG1  VAL  45          HG12      VAL  45 131.177   2.566  -1.387
  347   2HG1  VAL  45          HG11      VAL  45 130.172   1.117  -1.441
  348   3HG1  VAL  45          HG13      VAL  45 131.490   1.234  -0.275
  349   1HG2  VAL  45          HG21      VAL  45 132.300   0.702  -4.424
  350   2HG2  VAL  45          HG23      VAL  45 130.660   0.508  -3.811
  351   3HG2  VAL  45          HG22      VAL  45 131.388   2.109  -3.877
  352    H    LEU  46           HN       LEU  46 134.748  -0.517  -1.371
  353    HA   LEU  46           HA       LEU  46 134.614  -0.133   1.459
  354   1HB   LEU  46           HB2      LEU  46 135.248  -2.300   0.373
  355   2HB   LEU  46           HB1      LEU  46 136.749  -1.563  -0.172
  356    HG   LEU  46           HG       LEU  46 137.258  -1.068   2.278
  357   1HD1  LEU  46          HD11      LEU  46 134.784  -2.754   2.582
  358   2HD1  LEU  46          HD13      LEU  46 136.032  -2.760   3.826
  359   3HD1  LEU  46          HD12      LEU  46 135.217  -1.257   3.407
  360   1HD2  LEU  46          HD21      LEU  46 137.437  -3.605   0.828
  361   2HD2  LEU  46          HD23      LEU  46 138.632  -2.797   1.836
  362   3HD2  LEU  46          HD22      LEU  46 137.431  -3.849   2.573
  363    H    GLY  47           HN       GLY  47 136.902   0.837  -1.032
  364   1HA   GLY  47           HA2      GLY  47 138.953   1.932   0.591
  365   2HA   GLY  47           HA1      GLY  47 138.586   2.472  -1.047
  366    H    GLN  48           HN       GLN  48 135.951   3.431  -0.638
  367    HA   GLN  48           HA       GLN  48 136.454   6.065   0.336
  368   1HB   GLN  48           HB2      GLN  48 134.570   5.382  -1.202
  369   2HB   GLN  48           HB1      GLN  48 133.761   4.672   0.196
  370   1HG   GLN  48           HG2      GLN  48 132.867   6.894  -0.105
  371   2HG   GLN  48           HG1      GLN  48 133.908   6.932   1.319
  372   1HE2  GLN  48          HE22      GLN  48 135.810   9.541  -0.061
  373   2HE2  GLN  48          HE21      GLN  48 135.114   8.831   1.315
  374    H    PHE  49           HN       PHE  49 135.003   3.224   1.883
  375    HA   PHE  49           HA       PHE  49 134.232   4.440   4.341
  376   1HB   PHE  49           HB2      PHE  49 133.564   2.157   3.583
  377   2HB   PHE  49           HB1      PHE  49 135.216   1.611   3.840
  378    HD1  PHE  49           HD1      PHE  49 132.602   3.545   5.738
  379    HD2  PHE  49           HD2      PHE  49 135.591   0.457   5.836
  380    HE1  PHE  49           HE1      PHE  49 132.044   3.076   8.106
  381    HE2  PHE  49           HE2      PHE  49 135.032  -0.006   8.205
  382    HZ   PHE  49           HZ       PHE  49 133.259   1.303   9.340
  383    H    LEU  50           HN       LEU  50 137.262   3.019   3.247
  384    HA   LEU  50           HA       LEU  50 138.662   3.285   5.769
  385   1HB   LEU  50           HB2      LEU  50 139.802   3.292   2.954
  386   2HB   LEU  50           HB1      LEU  50 140.720   3.021   4.433
  387    HG   LEU  50           HG       LEU  50 138.473   1.271   3.395
  388   1HD1  LEU  50          HD13      LEU  50 141.471   0.855   3.553
  389   2HD1  LEU  50          HD12      LEU  50 140.308  -0.385   3.078
  390   3HD1  LEU  50          HD11      LEU  50 140.522   1.055   2.085
  391   1HD2  LEU  50          HD22      LEU  50 140.102   1.250   5.935
  392   2HD2  LEU  50          HD21      LEU  50 138.367   1.002   5.728
  393   3HD2  LEU  50          HD23      LEU  50 139.497  -0.263   5.259
  394    H    VAL  51           HN       VAL  51 138.289   5.400   2.965
  395    HA   VAL  51           HA       VAL  51 140.121   7.428   3.833
  396    HB   VAL  51           HB       VAL  51 137.767   7.518   1.932
  397   1HG1  VAL  51          HG11      VAL  51 139.863   9.592   2.618
  398   2HG1  VAL  51          HG13      VAL  51 138.977   9.612   1.094
  399   3HG1  VAL  51          HG12      VAL  51 138.109   9.783   2.620
  400   1HG2  VAL  51          HG23      VAL  51 139.704   6.048   1.347
  401   2HG2  VAL  51          HG22      VAL  51 139.499   7.389   0.220
  402   3HG2  VAL  51          HG21      VAL  51 140.761   7.456   1.450
  403    H    LEU  52           HN       LEU  52 136.737   6.837   4.617
  404    HA   LEU  52           HA       LEU  52 136.404   9.529   5.770
  405   1HB   LEU  52           HB2      LEU  52 134.595   7.100   5.790
  406   2HB   LEU  52           HB1      LEU  52 134.144   8.702   6.373
  407    HG   LEU  52           HG       LEU  52 135.080   8.119   3.547
  408   1HD1  LEU  52          HD11      LEU  52 132.326   8.325   4.759
  409   2HD1  LEU  52          HD13      LEU  52 132.610   8.586   3.039
  410   3HD1  LEU  52          HD12      LEU  52 132.988   7.027   3.769
  411   1HD2  LEU  52          HD22      LEU  52 134.162  10.586   5.013
  412   2HD2  LEU  52          HD21      LEU  52 135.470  10.402   3.846
  413   3HD2  LEU  52          HD23      LEU  52 133.798  10.432   3.295
  414    H    LYS  53           HN       LYS  53 138.258   7.222   6.876
  415    HA   LYS  53           HA       LYS  53 138.999   6.588   9.010
  416   1HB   LYS  53           HB2      LYS  53 137.252   8.847  10.043
  417   2HB   LYS  53           HB1      LYS  53 138.664   8.146  10.818
  418   1HG   LYS  53           HG2      LYS  53 138.782   9.546   8.135
  419   2HG   LYS  53           HG1      LYS  53 139.068  10.368   9.667
  420   1HD   LYS  53           HD2      LYS  53 140.842   8.585  10.134
  421   2HD   LYS  53           HD1      LYS  53 140.678   8.122   8.439
  422   1HE   LYS  53           HE2      LYS  53 141.667  10.722   9.596
  423   2HE   LYS  53           HE1      LYS  53 142.433   9.687   8.389
  424   1HZ   LYS  53           HZ3      LYS  53 139.895  11.160   7.950
  425   2HZ   LYS  53           HZ2      LYS  53 141.421  11.725   7.462
  426   3HZ   LYS  53           HZ1      LYS  53 140.786  10.298   6.794
  427    H    LYS  54           HN       LYS  54 136.249   5.760   7.872
  428    HA   LYS  54           HA       LYS  54 134.515   4.346   8.500
  429   1HB   LYS  54           HB2      LYS  54 136.146   3.954  11.025
  430   2HB   LYS  54           HB1      LYS  54 134.899   2.881  10.394
  431   1HG   LYS  54           HG2      LYS  54 136.246   2.523   8.352
  432   2HG   LYS  54           HG1      LYS  54 137.499   3.573   9.001
  433   1HD   LYS  54           HD2      LYS  54 137.785   2.060  10.925
  434   2HD   LYS  54           HD1      LYS  54 136.529   1.002  10.279
  435   1HE   LYS  54           HE2      LYS  54 137.866   0.601   8.264
  436   2HE   LYS  54           HE1      LYS  54 139.111   1.703   8.850
  437   1HZ   LYS  54           HZ2      LYS  54 138.719  -0.032  10.916
  438   2HZ   LYS  54           HZ1      LYS  54 138.631  -1.027   9.540
  439   3HZ   LYS  54           HZ3      LYS  54 140.006  -0.072   9.809
  440    H    ASP  55           HN       ASP  55 134.636   7.298   9.558
  441    HA   ASP  55           HA       ASP  55 133.187   7.245  12.060
  442   1HB   ASP  55           HB2      ASP  55 134.336   9.275  11.157
  443   2HB   ASP  55           HB1      ASP  55 133.115   9.364   9.897
  444    H    GLU  56           HN       GLU  56 131.089   6.590  12.361
  445    HA   GLU  56           HA       GLU  56 129.514   5.534  10.246
  446   1HB   GLU  56           HB2      GLU  56 129.385   4.848  12.632
  447   2HB   GLU  56           HB1      GLU  56 128.581   6.375  12.995
  448   1HG   GLU  56           HG2      GLU  56 126.744   5.817  11.495
  449   2HG   GLU  56           HG1      GLU  56 127.565   4.338  10.992
  450    H    ASP  57           HN       ASP  57 129.208   8.689  11.902
  451    HA   ASP  57           HA       ASP  57 126.721   9.360  10.588
  452   1HB   ASP  57           HB2      ASP  57 128.809  11.052  11.978
  453   2HB   ASP  57           HB1      ASP  57 127.305  11.714  11.335
  454    H    LEU  58           HN       LEU  58 130.089  10.040   9.865
  455    HA   LEU  58           HA       LEU  58 129.474  11.759   7.595
  456   1HB   LEU  58           HB2      LEU  58 132.007  10.177   8.099
  457   2HB   LEU  58           HB1      LEU  58 131.830  11.508   6.967
  458    HG   LEU  58           HG       LEU  58 131.469  11.706   9.973
  459   1HD1  LEU  58          HD12      LEU  58 133.837  11.404   9.014
  460   2HD1  LEU  58          HD11      LEU  58 133.617  12.991   8.278
  461   3HD1  LEU  58          HD13      LEU  58 133.570  12.818  10.032
  462   1HD2  LEU  58          HD22      LEU  58 131.073  13.642   7.694
  463   2HD2  LEU  58          HD21      LEU  58 130.072  13.389   9.124
  464   3HD2  LEU  58          HD23      LEU  58 131.604  14.248   9.262
  465    H    PHE  59           HN       PHE  59 130.077   8.290   7.969
  466    HA   PHE  59           HA       PHE  59 130.155   7.664   5.172
  467   1HB   PHE  59           HB2      PHE  59 130.881   6.070   6.917
  468   2HB   PHE  59           HB1      PHE  59 129.216   5.941   7.486
  469    HD1  PHE  59           HD1      PHE  59 131.239   5.615   4.346
  470    HD2  PHE  59           HD2      PHE  59 127.846   4.246   6.594
  471    HE1  PHE  59           HE1      PHE  59 130.820   3.866   2.643
  472    HE2  PHE  59           HE2      PHE  59 127.424   2.495   4.887
  473    HZ   PHE  59           HZ       PHE  59 128.913   2.306   2.911
  474    H    ARG  60           HN       ARG  60 127.468   7.735   7.509
  475    HA   ARG  60           HA       ARG  60 125.448   6.804   5.753
  476   1HB   ARG  60           HB2      ARG  60 125.311   8.680   8.121
  477   2HB   ARG  60           HB1      ARG  60 123.880   8.086   7.280
  478   1HG   ARG  60           HG2      ARG  60 124.449   5.792   7.804
  479   2HG   ARG  60           HG1      ARG  60 125.997   6.285   8.487
  480   1HD   ARG  60           HD2      ARG  60 124.945   7.386  10.325
  481   2HD   ARG  60           HD1      ARG  60 123.362   7.316   9.556
  482    HE   ARG  60           HE       ARG  60 124.128   4.650   9.826
  483   1HH1  ARG  60          HH21      ARG  60 123.827   7.402  11.880
  484   2HH1  ARG  60          HH22      ARG  60 123.377   6.479  13.274
  485   1HH2  ARG  60          HH11      ARG  60 123.530   3.429  11.631
  486   2HH2  ARG  60          HH12      ARG  60 123.209   4.229  13.134
  487    H    GLU  61           HN       GLU  61 126.493  10.188   6.374
  488    HA   GLU  61           HA       GLU  61 124.525  11.323   4.620
  489   1HB   GLU  61           HB2      GLU  61 127.207  12.345   5.586
  490   2HB   GLU  61           HB1      GLU  61 126.101  13.310   4.608
  491   1HG   GLU  61           HG2      GLU  61 125.326  12.024   7.239
  492   2HG   GLU  61           HG1      GLU  61 125.883  13.690   7.092
  493    H    TRP  62           HN       TRP  62 127.830  10.114   4.101
  494    HA   TRP  62           HA       TRP  62 128.140  11.092   1.456
  495   1HB   TRP  62           HB2      TRP  62 130.065  10.182   2.576
  496   2HB   TRP  62           HB1      TRP  62 129.269   8.622   2.800
  497    HD1  TRP  62           HD1      TRP  62 130.808  10.834   0.066
  498    HE1  TRP  62           HE1      TRP  62 131.280   9.371  -2.015
  499    HE3  TRP  62           HE3      TRP  62 128.685   6.435   1.568
  500    HZ2  TRP  62           HZ2      TRP  62 130.842   6.688  -2.903
  501    HZ3  TRP  62           HZ3      TRP  62 128.738   4.448   0.093
  502    HH2  TRP  62           HH2      TRP  62 129.810   4.569  -2.138
  503    H    LEU  63           HN       LEU  63 126.868   7.920   2.540
  504    HA   LEU  63           HA       LEU  63 126.326   7.030  -0.138
  505   1HB   LEU  63           HB2      LEU  63 126.557   5.460   1.743
  506   2HB   LEU  63           HB1      LEU  63 125.111   6.131   2.492
  507    HG   LEU  63           HG       LEU  63 123.772   5.416   0.543
  508   1HD1  LEU  63          HD11      LEU  63 126.470   4.551  -0.472
  509   2HD1  LEU  63          HD13      LEU  63 125.020   3.694  -0.992
  510   3HD1  LEU  63          HD12      LEU  63 125.189   5.415  -1.321
  511   1HD2  LEU  63          HD21      LEU  63 124.088   3.905   2.493
  512   2HD2  LEU  63          HD23      LEU  63 123.853   3.013   0.991
  513   3HD2  LEU  63          HD22      LEU  63 125.470   3.174   1.676
  514    H    LYS  64           HN       LYS  64 124.247   8.464   2.365
  515    HA   LYS  64           HA       LYS  64 121.829   8.374   0.860
  516   1HB   LYS  64           HB2      LYS  64 121.868   8.836   3.278
  517   2HB   LYS  64           HB1      LYS  64 122.660  10.383   2.970
  518   1HG   LYS  64           HG2      LYS  64 120.729  11.180   1.717
  519   2HG   LYS  64           HG1      LYS  64 119.952   9.603   1.852
  520   1HD   LYS  64           HD2      LYS  64 119.914   9.844   4.310
  521   2HD   LYS  64           HD1      LYS  64 120.649  11.441   4.158
  522   1HE   LYS  64           HE2      LYS  64 118.736  12.307   2.995
  523   2HE   LYS  64           HE1      LYS  64 118.051  10.694   2.797
  524   1HZ   LYS  64           HZ3      LYS  64 118.554  11.917   5.447
  525   2HZ   LYS  64           HZ2      LYS  64 117.073  12.064   4.629
  526   3HZ   LYS  64           HZ1      LYS  64 117.639  10.533   5.098
  527    H    ASP  65           HN       ASP  65 124.174  11.033   1.217
  528    HA   ASP  65           HA       ASP  65 122.800  12.762  -0.633
  529   1HB   ASP  65           HB2      ASP  65 125.650  12.737   0.392
  530   2HB   ASP  65           HB1      ASP  65 125.009  14.000  -0.660
  531    H    THR  66           HN       THR  66 125.125  10.180  -1.007
  532    HA   THR  66           HA       THR  66 125.879  10.949  -3.710
  533    HB   THR  66           HB       THR  66 126.318   8.396  -2.141
  534    HG1  THR  66           HG1      THR  66 127.951  10.618  -2.799
  535   1HG2  THR  66          HG21      THR  66 127.293   9.285  -4.864
  536   2HG2  THR  66          HG23      THR  66 128.087   8.016  -3.931
  537   3HG2  THR  66          HG22      THR  66 126.419   7.808  -4.463
  538    H    CYS  67           HN       CYS  67 123.500   8.651  -2.315
  539    HA   CYS  67           HA       CYS  67 122.515   8.210  -5.127
  540   1HB   CYS  67           HB2      CYS  67 122.042   5.892  -4.554
  541   2HB   CYS  67           HB1      CYS  67 123.750   6.236  -4.282
  542    HG   CYS  67           HG       CYS  67 121.762   6.342  -1.876
  543    H    GLY  68           HN       GLY  68 121.678   8.618  -1.730
  544   1HA   GLY  68           HA2      GLY  68 119.562   9.719  -1.161
  545   2HA   GLY  68           HA1      GLY  68 118.814   8.938  -2.554
  546    H    ALA  69           HN       ALA  69 120.982   6.936  -0.794
  547    HA   ALA  69           HA       ALA  69 119.098   4.941  -0.210
  548   1HB   ALA  69           HB1      ALA  69 121.600   4.694  -0.045
  549   2HB   ALA  69           HB3      ALA  69 121.536   5.579   1.479
  550   3HB   ALA  69           HB2      ALA  69 120.729   4.019   1.331
  551    H    ASN  70           HN       ASN  70 118.000   4.375   1.798
  552    HA   ASN  70           HA       ASN  70 117.108   6.775   3.271
  553   1HB   ASN  70           HB2      ASN  70 115.553   4.970   2.347
  554   2HB   ASN  70           HB1      ASN  70 116.163   3.926   3.632
  555   1HD2  ASN  70          HD22      ASN  70 113.640   5.252   5.711
  556   2HD2  ASN  70          HD21      ASN  70 114.315   3.870   4.994
  557    H    ALA  71           HN       ALA  71 116.773   6.424   5.703
  558    HA   ALA  71           HA       ALA  71 119.287   6.094   6.969
  559   1HB   ALA  71           HB2      ALA  71 117.380   7.393   7.904
  560   2HB   ALA  71           HB1      ALA  71 116.549   5.875   8.246
  561   3HB   ALA  71           HB3      ALA  71 118.061   6.256   9.068
  562    H    LYS  72           HN       LYS  72 116.665   3.744   6.451
  563    HA   LYS  72           HA       LYS  72 117.766   1.793   8.277
  564   1HB   LYS  72           HB2      LYS  72 115.844   1.544   5.950
  565   2HB   LYS  72           HB1      LYS  72 116.266   0.198   7.008
  566   1HG   LYS  72           HG2      LYS  72 115.461   1.475   8.959
  567   2HG   LYS  72           HG1      LYS  72 115.034   2.821   7.902
  568   1HD   LYS  72           HD2      LYS  72 113.462   1.367   6.677
  569   2HD   LYS  72           HD1      LYS  72 113.885   0.020   7.733
  570   1HE   LYS  72           HE2      LYS  72 112.683   2.644   8.664
  571   2HE   LYS  72           HE1      LYS  72 111.788   1.138   8.454
  572   1HZ   LYS  72           HZ2      LYS  72 114.143   1.431  10.235
  573   2HZ   LYS  72           HZ1      LYS  72 112.534   1.565  10.764
  574   3HZ   LYS  72           HZ3      LYS  72 113.097   0.097  10.128
  575    H    GLN  73           HN       GLN  73 118.062   2.298   4.773
  576    HA   GLN  73           HA       GLN  73 119.588  -0.073   4.273
  577   1HB   GLN  73           HB2      GLN  73 119.506   2.536   2.730
  578   2HB   GLN  73           HB1      GLN  73 120.183   1.022   2.133
  579   1HG   GLN  73           HG2      GLN  73 117.309   1.370   3.032
  580   2HG   GLN  73           HG1      GLN  73 117.840   1.419   1.351
  581   1HE2  GLN  73          HE22      GLN  73 116.891  -2.117   2.659
  582   2HE2  GLN  73          HE21      GLN  73 116.178  -0.628   3.056
  583    H    SER  74           HN       SER  74 120.522   3.219   5.187
  584    HA   SER  74           HA       SER  74 123.320   2.866   4.711
  585   1HB   SER  74           HB2      SER  74 123.594   4.926   5.817
  586   2HB   SER  74           HB1      SER  74 121.969   5.040   5.149
  587    HG   SER  74           HG       SER  74 122.752   4.409   7.798
  588    H    ARG  75           HN       ARG  75 121.261   2.234   7.567
  589    HA   ARG  75           HA       ARG  75 123.382   1.718   9.396
  590   1HB   ARG  75           HB2      ARG  75 120.565   0.621   9.261
  591   2HB   ARG  75           HB1      ARG  75 121.666   0.297  10.599
  592   1HG   ARG  75           HG2      ARG  75 121.876   2.719  11.016
  593   2HG   ARG  75           HG1      ARG  75 120.769   3.045   9.681
  594   1HD   ARG  75           HD2      ARG  75 119.015   1.721  10.826
  595   2HD   ARG  75           HD1      ARG  75 120.117   1.449  12.175
  596    HE   ARG  75           HE       ARG  75 120.037   4.206  11.946
  597   1HH1  ARG  75          HH21      ARG  75 117.749   1.644  12.201
  598   2HH1  ARG  75          HH22      ARG  75 116.573   2.595  13.044
  599   1HH2  ARG  75          HH11      ARG  75 118.512   5.468  13.052
  600   2HH2  ARG  75          HH12      ARG  75 117.005   4.759  13.527
  601    H    ASP  76           HN       ASP  76 121.747  -0.442   7.067
  602    HA   ASP  76           HA       ASP  76 123.034  -2.825   7.981
  603   1HB   ASP  76           HB2      ASP  76 121.820  -2.065   5.315
  604   2HB   ASP  76           HB1      ASP  76 122.417  -3.685   5.679
  605    H    CYS  77           HN       CYS  77 123.966  -0.443   5.483
  606    HA   CYS  77           HA       CYS  77 126.213  -1.977   4.548
  607   1HB   CYS  77           HB2      CYS  77 125.543   0.972   4.411
  608   2HB   CYS  77           HB1      CYS  77 126.960   0.268   3.633
  609    HG   CYS  77           HG       CYS  77 124.533   0.348   2.192
  610    H    PHE  78           HN       PHE  78 125.881   0.566   7.064
  611    HA   PHE  78           HA       PHE  78 128.672   0.865   7.518
  612   1HB   PHE  78           HB2      PHE  78 127.070   2.426   8.490
  613   2HB   PHE  78           HB1      PHE  78 126.389   1.141   9.492
  614    HD1  PHE  78           HD1      PHE  78 129.319   3.319   8.941
  615    HD2  PHE  78           HD2      PHE  78 127.588   0.266  11.418
  616    HE1  PHE  78           HE1      PHE  78 131.055   3.729  10.663
  617    HE2  PHE  78           HE2      PHE  78 129.325   0.675  13.140
  618    HZ   PHE  78           HZ       PHE  78 131.061   2.408  12.761
  619    H    GLY  79           HN       GLY  79 126.379  -1.105   9.456
  620   1HA   GLY  79           HA2      GLY  79 128.382  -2.409  10.979
  621   2HA   GLY  79           HA1      GLY  79 126.755  -3.030  10.718
  622    H    CYS  80           HN       CYS  80 127.060  -3.148   7.793
  623    HA   CYS  80           HA       CYS  80 128.197  -5.808   7.632
  624   1HB   CYS  80           HB2      CYS  80 126.379  -5.054   6.133
  625   2HB   CYS  80           HB1      CYS  80 127.476  -3.882   5.400
  626    HG   CYS  80           HG       CYS  80 127.527  -6.072   3.945
  627    H    LEU  81           HN       LEU  81 129.301  -2.608   6.413
  628    HA   LEU  81           HA       LEU  81 131.800  -3.685   5.434
  629   1HB   LEU  81           HB2      LEU  81 130.991  -0.849   6.148
  630   2HB   LEU  81           HB1      LEU  81 132.486  -1.281   5.324
  631    HG   LEU  81           HG       LEU  81 129.712  -1.951   4.294
  632   1HD1  LEU  81          HD13      LEU  81 131.596   0.335   3.688
  633   2HD1  LEU  81          HD12      LEU  81 130.328  -0.160   2.568
  634   3HD1  LEU  81          HD11      LEU  81 129.905   0.421   4.178
  635   1HD2  LEU  81          HD21      LEU  81 132.519  -2.398   3.283
  636   2HD2  LEU  81          HD23      LEU  81 131.132  -3.486   3.242
  637   3HD2  LEU  81          HD22      LEU  81 131.221  -2.137   2.117
  638    H    ARG  82           HN       ARG  82 130.766  -2.129   8.464
  639    HA   ARG  82           HA       ARG  82 133.353  -1.924   9.640
  640   1HB   ARG  82           HB2      ARG  82 131.261  -0.864  10.556
  641   2HB   ARG  82           HB1      ARG  82 130.726  -2.463  11.068
  642   1HG   ARG  82           HG2      ARG  82 131.720  -1.655  13.023
  643   2HG   ARG  82           HG1      ARG  82 133.053  -2.553  12.307
  644   1HD   ARG  82           HD2      ARG  82 133.600  -0.232  11.159
  645   2HD   ARG  82           HD1      ARG  82 132.648   0.423  12.484
  646    HE   ARG  82           HE       ARG  82 135.352  -0.504  12.640
  647   1HH1  ARG  82          HH21      ARG  82 132.357  -0.729  14.341
  648   2HH1  ARG  82          HH22      ARG  82 133.091  -1.271  15.811
  649   1HH2  ARG  82          HH11      ARG  82 136.314  -1.192  14.547
  650   2HH2  ARG  82          HH12      ARG  82 135.327  -1.527  15.931
  651    H    GLU  83           HN       GLU  83 131.007  -4.601   9.597
  652    HA   GLU  83           HA       GLU  83 132.562  -6.296  11.327
  653   1HB   GLU  83           HB2      GLU  83 130.291  -6.816   9.407
  654   2HB   GLU  83           HB1      GLU  83 131.083  -8.130  10.278
  655   1HG   GLU  83           HG2      GLU  83 130.582  -7.018  12.423
  656   2HG   GLU  83           HG1      GLU  83 129.788  -5.703  11.560
  657    H    TRP  84           HN       TRP  84 132.446  -6.018   7.736
  658    HA   TRP  84           HA       TRP  84 134.068  -8.309   7.227
  659   1HB   TRP  84           HB2      TRP  84 132.838  -6.988   5.468
  660   2HB   TRP  84           HB1      TRP  84 134.054  -5.721   5.640
  661    HD1  TRP  84           HD1      TRP  84 133.534  -9.231   4.296
  662    HE1  TRP  84           HE1      TRP  84 135.573  -9.913   2.879
  663    HE3  TRP  84           HE3      TRP  84 136.670  -5.330   5.326
  664    HZ2  TRP  84           HZ2      TRP  84 138.191  -8.940   2.264
  665    HZ3  TRP  84           HZ3      TRP  84 138.930  -5.237   4.311
  666    HH2  TRP  84           HH2      TRP  84 139.696  -7.036   2.783
  667    H    CYS  85           HN       CYS  85 134.892  -4.919   7.846
  668    HA   CYS  85           HA       CYS  85 137.721  -5.181   7.564
  669   1HB   CYS  85           HB2      CYS  85 136.025  -3.273   9.186
  670   2HB   CYS  85           HB1      CYS  85 137.779  -3.130   9.069
  671    HG   CYS  85           HG       CYS  85 136.156  -1.864   7.115
  672    H    ASP  86           HN       ASP  86 135.579  -5.622  10.351
  673    HA   ASP  86           HA       ASP  86 137.579  -5.980  12.336
  674   1HB   ASP  86           HB2      ASP  86 134.795  -7.143  12.075
  675   2HB   ASP  86           HB1      ASP  86 135.796  -7.342  13.513
  676    H    ALA  87           HN       ALA  87 136.264  -8.205   9.930
  677    HA   ALA  87           HA       ALA  87 137.724 -10.491  11.093
  678   1HB   ALA  87           HB3      ALA  87 135.438 -10.647   9.954
  679   2HB   ALA  87           HB2      ALA  87 136.297 -10.417   8.430
  680   3HB   ALA  87           HB1      ALA  87 136.650 -11.820   9.438
  681    H    PHE  88           HN       PHE  88 137.998  -8.315   8.304
  682    HA   PHE  88           HA       PHE  88 140.507  -9.729   7.489
  683   1HB   PHE  88           HB2      PHE  88 138.693  -7.792   6.040
  684   2HB   PHE  88           HB1      PHE  88 140.250  -8.323   5.403
  685    HD1  PHE  88           HD2      PHE  88 140.656 -10.773   4.988
  686    HD2  PHE  88           HD1      PHE  88 136.769  -9.221   5.965
  687    HE1  PHE  88           HE2      PHE  88 139.613 -12.857   4.146
  688    HE2  PHE  88           HE1      PHE  88 135.724 -11.311   5.120
  689    HZ   PHE  88           HZ       PHE  88 137.148 -13.122   4.206
  690    H    LEU  89           HN       LEU  89 139.760  -6.321   6.852
  691    HA   LEU  89           HA       LEU  89 142.419  -5.568   7.785
  692   1HB   LEU  89           HB2      LEU  89 141.298  -4.477   5.821
  693   2HB   LEU  89           HB1      LEU  89 140.082  -3.823   6.915
  694    HG   LEU  89           HG       LEU  89 142.144  -2.801   8.189
  695   1HD1  LEU  89          HD11      LEU  89 143.851  -4.046   6.865
  696   2HD1  LEU  89          HD13      LEU  89 143.327  -3.175   5.424
  697   3HD1  LEU  89          HD12      LEU  89 144.059  -2.301   6.767
  698   1HD2  LEU  89          HD22      LEU  89 140.441  -1.485   6.987
  699   2HD2  LEU  89          HD21      LEU  89 142.049  -0.800   6.751
  700   3HD2  LEU  89          HD23      LEU  89 141.300  -1.754   5.468
  701   1H    MET   1           HT1      MET   1 170.062  -5.040  -1.645
  702   2H    MET   1           HT3      MET   1 171.477  -5.925  -1.346
  703   3H    MET   1           HT2      MET   1 171.310  -5.056  -2.797
  704    HA   MET   1           HA       MET   1 170.052  -6.616  -3.778
  705   1HB   MET   1           HB2      MET   1 172.111  -7.765  -2.939
  706   2HB   MET   1           HB1      MET   1 171.210  -8.267  -1.512
  707   1HG   MET   1           HG2      MET   1 171.171 -10.096  -3.099
  708   2HG   MET   1           HG1      MET   1 169.555  -9.401  -3.034
  709   1HE   MET   1           HE3      MET   1 172.913  -9.382  -4.481
  710   2HE   MET   1           HE2      MET   1 172.739  -9.265  -6.229
  711   3HE   MET   1           HE1      MET   1 172.772  -7.798  -5.255
  712    H    THR   2           HN       THR   2 169.689  -7.711  -0.380
  713    HA   THR   2           HA       THR   2 166.919  -8.442  -0.840
  714    HB   THR   2           HB       THR   2 166.874  -8.893   1.590
  715    HG1  THR   2           HG1      THR   2 168.644  -8.373   2.828
  716   1HG2  THR   2          HG22      THR   2 167.882 -10.544   0.032
  717   2HG2  THR   2          HG21      THR   2 169.459  -9.800   0.295
  718   3HG2  THR   2          HG23      THR   2 168.626 -10.597   1.630
  719    H    THR   3           HN       THR   3 165.081  -7.473   0.313
  720    HA   THR   3           HA       THR   3 165.177  -4.548   0.207
  721    HB   THR   3           HB       THR   3 162.769  -4.679   0.693
  722    HG1  THR   3           HG1      THR   3 162.078  -7.059   0.742
  723   1HG2  THR   3          HG23      THR   3 163.626  -5.130  -1.621
  724   2HG2  THR   3          HG22      THR   3 163.577  -6.855  -1.255
  725   3HG2  THR   3          HG21      THR   3 162.085  -5.914  -1.278
  726    H    SER   4           HN       SER   4 164.121  -3.323   2.116
  727    HA   SER   4           HA       SER   4 165.674  -3.844   4.497
  728   1HB   SER   4           HB2      SER   4 164.533  -1.927   5.432
  729   2HB   SER   4           HB1      SER   4 164.846  -1.571   3.735
  730    HG   SER   4           HG       SER   4 162.711  -1.082   4.200
  731    H    GLN   5           HN       GLN   5 164.714  -4.297   6.634
  732    HA   GLN   5           HA       GLN   5 163.094  -6.627   6.622
  733   1HB   GLN   5           HB2      GLN   5 163.793  -4.696   8.841
  734   2HB   GLN   5           HB1      GLN   5 162.880  -6.181   9.113
  735   1HG   GLN   5           HG2      GLN   5 164.727  -7.500   8.148
  736   2HG   GLN   5           HG1      GLN   5 165.645  -6.018   7.877
  737   1HE2  GLN   5          HE22      GLN   5 165.288  -5.776  11.762
  738   2HE2  GLN   5          HE21      GLN   5 164.264  -5.099  10.590
  739    H    LYS   6           HN       LYS   6 162.143  -3.237   6.684
  740    HA   LYS   6           HA       LYS   6 159.559  -3.567   7.827
  741   1HB   LYS   6           HB2      LYS   6 160.621  -1.600   5.787
  742   2HB   LYS   6           HB1      LYS   6 159.009  -1.488   6.491
  743   1HG   LYS   6           HG2      LYS   6 159.999  -1.357   8.749
  744   2HG   LYS   6           HG1      LYS   6 161.615  -1.463   8.046
  745   1HD   LYS   6           HD2      LYS   6 161.197   0.611   6.770
  746   2HD   LYS   6           HD1      LYS   6 159.586   0.719   7.479
  747   1HE   LYS   6           HE2      LYS   6 160.578   0.880   9.731
  748   2HE   LYS   6           HE1      LYS   6 162.192   0.768   9.027
  749   1HZ   LYS   6           HZ1      LYS   6 161.393   2.758   7.615
  750   2HZ   LYS   6           HZ3      LYS   6 160.238   2.961   8.840
  751   3HZ   LYS   6           HZ2      LYS   6 161.893   3.028   9.215
  752    H    HIS   7           HN       HIS   7 160.699  -3.892   4.463
  753    HA   HIS   7           HA       HIS   7 158.142  -4.141   3.272
  754   1HB   HIS   7           HB2      HIS   7 160.119  -3.852   1.892
  755   2HB   HIS   7           HB1      HIS   7 160.790  -5.378   2.466
  756    HD2  HIS   7           HD2      HIS   7 159.662  -7.698   1.285
  757    HE1  HIS   7           HE1      HIS   7 157.085  -5.665  -1.373
  758    HE2  HIS   7           HE2      HIS   7 158.033  -7.930  -0.739
  759    H    ARG   8           HN       ARG   8 160.308  -6.789   4.367
  760    HA   ARG   8           HA       ARG   8 158.367  -8.834   3.838
  761   1HB   ARG   8           HB2      ARG   8 160.802  -8.818   5.645
  762   2HB   ARG   8           HB1      ARG   8 159.891 -10.261   5.205
  763   1HG   ARG   8           HG2      ARG   8 161.045  -8.436   3.091
  764   2HG   ARG   8           HG1      ARG   8 162.020  -9.704   3.830
  765   1HD   ARG   8           HD2      ARG   8 160.203 -11.351   3.179
  766   2HD   ARG   8           HD1      ARG   8 159.455 -10.055   2.249
  767    HE   ARG   8           HE       ARG   8 162.068 -10.089   1.342
  768   1HH1  ARG   8          HH21      ARG   8 159.526 -12.381   1.744
  769   2HH1  ARG   8          HH22      ARG   8 160.010 -13.353   0.395
  770   1HH2  ARG   8          HH11      ARG   8 162.714 -11.343  -0.423
  771   2HH2  ARG   8          HH12      ARG   8 161.815 -12.764  -0.834
  772    H    ASP   9           HN       ASP   9 159.162  -6.872   6.630
  773    HA   ASP   9           HA       ASP   9 157.547  -8.381   8.492
  774   1HB   ASP   9           HB2      ASP   9 158.669  -5.581   8.557
  775   2HB   ASP   9           HB1      ASP   9 157.763  -6.284   9.895
  776    H    PHE  10           HN       PHE  10 156.952  -5.530   6.450
  777    HA   PHE  10           HA       PHE  10 154.357  -4.969   7.566
  778   1HB   PHE  10           HB2      PHE  10 155.768  -3.384   6.196
  779   2HB   PHE  10           HB1      PHE  10 155.330  -4.326   4.771
  780    HD1  PHE  10           HD1      PHE  10 154.089  -2.063   7.406
  781    HD2  PHE  10           HD2      PHE  10 153.059  -4.289   3.878
  782    HE1  PHE  10           HE1      PHE  10 151.963  -0.799   7.231
  783    HE2  PHE  10           HE2      PHE  10 150.930  -3.026   3.705
  784    HZ   PHE  10           HZ       PHE  10 150.383  -1.280   5.381
  785    H    VAL  11           HN       VAL  11 155.417  -6.946   4.792
  786    HA   VAL  11           HA       VAL  11 152.634  -7.628   4.113
  787    HB   VAL  11           HB       VAL  11 153.593  -8.926   2.309
  788   1HG1  VAL  11          HG12      VAL  11 155.070  -6.323   2.801
  789   2HG1  VAL  11          HG11      VAL  11 155.103  -7.192   1.268
  790   3HG1  VAL  11          HG13      VAL  11 153.582  -6.547   1.884
  791   1HG2  VAL  11          HG22      VAL  11 156.095  -8.670   3.965
  792   2HG2  VAL  11          HG21      VAL  11 155.384 -10.115   3.251
  793   3HG2  VAL  11          HG23      VAL  11 156.215  -8.945   2.227
  794    H    ALA  12           HN       ALA  12 154.221  -8.485   6.715
  795    HA   ALA  12           HA       ALA  12 153.545 -11.412   6.544
  796   1HB   ALA  12           HB3      ALA  12 155.608  -9.973   8.230
  797   2HB   ALA  12           HB2      ALA  12 155.200 -11.680   8.396
  798   3HB   ALA  12           HB1      ALA  12 155.922 -11.087   6.901
  799    H    GLU  13           HN       GLU  13 152.598  -8.466   7.924
  800    HA   GLU  13           HA       GLU  13 150.807  -9.895   9.759
  801   1HB   GLU  13           HB2      GLU  13 151.516  -8.304  11.666
  802   2HB   GLU  13           HB1      GLU  13 152.588  -9.657  11.305
  803   1HG   GLU  13           HG2      GLU  13 154.099  -8.272  10.099
  804   2HG   GLU  13           HG1      GLU  13 152.947  -6.937  10.037
  805    HA   PRO  14           HA       PRO  14 147.859  -6.741   8.671
  806   1HB   PRO  14           HB2      PRO  14 147.701  -6.216  11.633
  807   2HB   PRO  14           HB1      PRO  14 146.386  -6.402  10.452
  808   1HG   PRO  14           HG2      PRO  14 147.067  -8.393  12.096
  809   2HG   PRO  14           HG1      PRO  14 146.545  -8.700  10.430
  810   1HD   PRO  14           HD2      PRO  14 149.266  -8.945  11.607
  811   2HD   PRO  14           HD1      PRO  14 148.581  -9.729  10.166
  812    H    MET  15           HN       MET  15 147.631  -4.368   8.680
  813    HA   MET  15           HA       MET  15 150.216  -3.009   9.186
  814   1HB   MET  15           HB2      MET  15 148.989  -1.093   8.010
  815   2HB   MET  15           HB1      MET  15 149.284  -2.538   7.040
  816   1HG   MET  15           HG2      MET  15 147.033  -3.297   7.311
  817   2HG   MET  15           HG1      MET  15 146.715  -2.112   8.579
  818   1HE   MET  15           HE1      MET  15 147.867  -2.765   5.136
  819   2HE   MET  15           HE3      MET  15 146.147  -2.720   4.722
  820   3HE   MET  15           HE2      MET  15 147.241  -1.486   4.098
  821    H    GLY  16           HN       GLY  16 147.082  -3.313  10.585
  822   1HA   GLY  16           HA2      GLY  16 146.038  -2.216  12.383
  823   2HA   GLY  16           HA1      GLY  16 147.678  -2.041  13.003
  824    H    GLU  17           HN       GLU  17 147.558   0.061  13.770
  825    HA   GLU  17           HA       GLU  17 146.666   2.204  11.883
  826   1HB   GLU  17           HB2      GLU  17 147.014   2.151  14.892
  827   2HB   GLU  17           HB1      GLU  17 146.664   3.619  13.979
  828   1HG   GLU  17           HG2      GLU  17 144.589   2.674  13.148
  829   2HG   GLU  17           HG1      GLU  17 144.954   1.118  13.896
  830    H    LYS  18           HN       LYS  18 149.338   0.862  11.787
  831    HA   LYS  18           HA       LYS  18 151.335   2.547  12.926
  832   1HB   LYS  18           HB2      LYS  18 151.324   0.786  10.463
  833   2HB   LYS  18           HB1      LYS  18 152.767   1.655  10.986
  834   1HG   LYS  18           HG2      LYS  18 152.554   0.564  13.229
  835   2HG   LYS  18           HG1      LYS  18 151.208  -0.386  12.603
  836   1HD   LYS  18           HD2      LYS  18 153.904  -0.378  11.233
  837   2HD   LYS  18           HD1      LYS  18 153.555  -1.477  12.565
  838   1HE   LYS  18           HE2      LYS  18 151.507  -2.237  11.259
  839   2HE   LYS  18           HE1      LYS  18 152.142  -1.320   9.893
  840   1HZ   LYS  18           HZ2      LYS  18 154.181  -2.914  11.015
  841   2HZ   LYS  18           HZ1      LYS  18 152.831  -3.886  10.666
  842   3HZ   LYS  18           HZ3      LYS  18 153.541  -2.951   9.442
  843    HA   PRO  19           HA       PRO  19 150.868   6.242  10.537
  844   1HB   PRO  19           HB2      PRO  19 153.489   7.130  10.372
  845   2HB   PRO  19           HB1      PRO  19 152.476   7.280  11.822
  846   1HG   PRO  19           HG2      PRO  19 154.565   5.245  11.182
  847   2HG   PRO  19           HG1      PRO  19 154.222   6.064  12.716
  848   1HD   PRO  19           HD2      PRO  19 153.404   3.517  12.235
  849   2HD   PRO  19           HD1      PRO  19 152.459   4.634  13.244
  850    H    VAL  20           HN       VAL  20 151.215   7.171   8.448
  851    HA   VAL  20           HA       VAL  20 151.375   5.391   6.293
  852    HB   VAL  20           HB       VAL  20 150.439   7.611   6.006
  853   1HG1  VAL  20          HG12      VAL  20 152.102   8.681   7.629
  854   2HG1  VAL  20          HG11      VAL  20 153.232   8.741   6.277
  855   3HG1  VAL  20          HG13      VAL  20 151.711   9.626   6.194
  856   1HG2  VAL  20          HG21      VAL  20 151.628   6.448   4.062
  857   2HG2  VAL  20          HG23      VAL  20 151.412   8.191   3.896
  858   3HG2  VAL  20          HG22      VAL  20 152.979   7.537   4.363
  859    H    GLY  21           HN       GLY  21 153.965   7.382   7.684
  860   1HA   GLY  21           HA2      GLY  21 155.997   6.794   5.820
  861   2HA   GLY  21           HA1      GLY  21 156.292   7.207   7.507
  862    H    SER  22           HN       SER  22 154.357   4.544   7.689
  863    HA   SER  22           HA       SER  22 156.652   2.817   8.273
  864   1HB   SER  22           HB2      SER  22 154.694   2.725   9.740
  865   2HB   SER  22           HB1      SER  22 153.659   2.311   8.377
  866    HG   SER  22           HG       SER  22 155.528   0.779   9.764
  867    H    LEU  23           HN       LEU  23 154.492   3.393   5.636
  868    HA   LEU  23           HA       LEU  23 154.655   0.827   4.357
  869   1HB   LEU  23           HB2      LEU  23 154.270   3.584   3.155
  870   2HB   LEU  23           HB1      LEU  23 153.972   2.064   2.315
  871    HG   LEU  23           HG       LEU  23 152.594   2.835   4.906
  872   1HD1  LEU  23          HD13      LEU  23 152.092   4.401   2.984
  873   2HD1  LEU  23          HD12      LEU  23 151.464   3.010   2.099
  874   3HD1  LEU  23          HD11      LEU  23 150.689   3.526   3.597
  875   1HD2  LEU  23          HD23      LEU  23 152.289   0.597   2.895
  876   2HD2  LEU  23          HD22      LEU  23 152.399   0.492   4.651
  877   3HD2  LEU  23          HD21      LEU  23 150.926   1.090   3.896
  878    H    ALA  24           HN       ALA  24 156.153   0.002   2.964
  879    HA   ALA  24           HA       ALA  24 158.846   0.994   3.083
  880   1HB   ALA  24           HB1      ALA  24 158.159  -1.395   2.614
  881   2HB   ALA  24           HB3      ALA  24 157.716  -0.878   0.989
  882   3HB   ALA  24           HB2      ALA  24 159.391  -0.760   1.525
  883    H    GLY  25           HN       GLY  25 159.945   2.352   1.757
  884   1HA   GLY  25           HA2      GLY  25 160.400   3.435  -0.376
  885   2HA   GLY  25           HA1      GLY  25 158.709   3.216  -0.824
  886    H    ILE  26           HN       ILE  26 158.006   4.144   2.034
  887    HA   ILE  26           HA       ILE  26 158.073   7.060   1.394
  888    HB   ILE  26           HB       ILE  26 156.535   5.619   3.580
  889   1HG1  ILE  26          HG12      ILE  26 155.794   4.715   1.454
  890   2HG1  ILE  26          HG11      ILE  26 154.579   5.861   2.013
  891   1HG2  ILE  26          HG23      ILE  26 156.903   8.088   3.817
  892   2HG2  ILE  26          HG22      ILE  26 156.080   8.316   2.273
  893   3HG2  ILE  26          HG21      ILE  26 155.205   7.647   3.649
  894   1HD1  ILE  26          HD13      ILE  26 155.902   7.602   0.579
  895   2HD1  ILE  26          HD12      ILE  26 156.594   6.183  -0.203
  896   3HD1  ILE  26          HD11      ILE  26 154.853   6.451  -0.246
  897    H    GLY  27           HN       GLY  27 159.796   8.157   2.344
  898   1HA   GLY  27           HA2      GLY  27 161.035   7.001   4.769
  899   2HA   GLY  27           HA1      GLY  27 161.681   8.324   3.798
  900    H    GLU  28           HN       GLU  28 161.784   8.868   6.364
  901    HA   GLU  28           HA       GLU  28 159.475   9.817   7.685
  902   1HB   GLU  28           HB2      GLU  28 162.361  10.720   7.850
  903   2HB   GLU  28           HB1      GLU  28 161.102  11.302   8.940
  904   1HG   GLU  28           HG2      GLU  28 161.725   8.365   8.531
  905   2HG   GLU  28           HG1      GLU  28 162.426   9.336   9.825
  906    H    VAL  29           HN       VAL  29 161.623  11.522   5.387
  907    HA   VAL  29           HA       VAL  29 160.314  14.070   5.707
  908    HB   VAL  29           HB       VAL  29 161.942  12.926   3.417
  909   1HG1  VAL  29          HG11      VAL  29 160.751  15.670   3.852
  910   2HG1  VAL  29          HG13      VAL  29 162.161  15.422   2.822
  911   3HG1  VAL  29          HG12      VAL  29 160.631  14.642   2.424
  912   1HG2  VAL  29          HG23      VAL  29 162.569  14.821   5.701
  913   2HG2  VAL  29          HG22      VAL  29 163.246  13.213   5.439
  914   3HG2  VAL  29          HG21      VAL  29 163.655  14.531   4.341
  915    H    LEU  30           HN       LEU  30 159.893  11.429   3.368
  916    HA   LEU  30           HA       LEU  30 157.808  12.720   1.872
  917   1HB   LEU  30           HB2      LEU  30 158.394   9.765   2.230
  918   2HB   LEU  30           HB1      LEU  30 157.324  10.442   1.005
  919    HG   LEU  30           HG       LEU  30 160.259  11.162   1.275
  920   1HD1  LEU  30          HD11      LEU  30 158.838   9.113  -0.435
  921   2HD1  LEU  30          HD13      LEU  30 160.429   9.751  -0.853
  922   3HD1  LEU  30          HD12      LEU  30 160.203   8.862   0.654
  923   1HD2  LEU  30          HD23      LEU  30 158.063  11.852  -0.683
  924   2HD2  LEU  30          HD22      LEU  30 159.236  12.922   0.084
  925   3HD2  LEU  30          HD21      LEU  30 159.745  11.843  -1.210
  926    H    GLY  31           HN       GLY  31 157.793  10.583   4.690
  927   1HA   GLY  31           HA2      GLY  31 154.999  10.098   4.807
  928   2HA   GLY  31           HA1      GLY  31 156.074  10.100   6.207
  929    H    LYS  32           HN       LYS  32 156.933  12.828   6.017
  930    HA   LYS  32           HA       LYS  32 154.790  14.111   7.428
  931   1HB   LYS  32           HB2      LYS  32 157.334  15.202   6.198
  932   2HB   LYS  32           HB1      LYS  32 156.231  16.176   7.172
  933   1HG   LYS  32           HG2      LYS  32 156.501  14.607   9.058
  934   2HG   LYS  32           HG1      LYS  32 157.605  13.630   8.089
  935   1HD   LYS  32           HD2      LYS  32 159.138  15.561   7.896
  936   2HD   LYS  32           HD1      LYS  32 158.036  16.530   8.873
  937   1HE   LYS  32           HE2      LYS  32 159.285  13.938   9.824
  938   2HE   LYS  32           HE1      LYS  32 159.953  15.531  10.176
  939   1HZ   LYS  32           HZ3      LYS  32 157.663  16.065  11.080
  940   2HZ   LYS  32           HZ2      LYS  32 157.363  14.394  11.038
  941   3HZ   LYS  32           HZ1      LYS  32 158.620  15.010  12.001
  942    H    LYS  33           HN       LYS  33 155.874  14.346   4.032
  943    HA   LYS  33           HA       LYS  33 154.194  16.570   3.355
  944   1HB   LYS  33           HB2      LYS  33 155.313  14.323   1.657
  945   2HB   LYS  33           HB1      LYS  33 154.460  15.716   0.993
  946   1HG   LYS  33           HG2      LYS  33 156.120  17.226   2.018
  947   2HG   LYS  33           HG1      LYS  33 156.977  15.835   2.680
  948   1HD   LYS  33           HD2      LYS  33 157.367  14.982   0.396
  949   2HD   LYS  33           HD1      LYS  33 156.514  16.376  -0.267
  950   1HE   LYS  33           HE2      LYS  33 158.173  17.897   0.594
  951   2HE   LYS  33           HE1      LYS  33 158.953  16.610   1.513
  952   1HZ   LYS  33           HZ1      LYS  33 158.820  15.753  -1.121
  953   2HZ   LYS  33           HZ3      LYS  33 159.360  17.359  -1.177
  954   3HZ   LYS  33           HZ2      LYS  33 160.205  16.213  -0.251
  955    H    LEU  34           HN       LEU  34 153.649  13.046   3.066
  956    HA   LEU  34           HA       LEU  34 151.041  13.248   1.921
  957   1HB   LEU  34           HB2      LEU  34 152.307  11.091   3.633
  958   2HB   LEU  34           HB1      LEU  34 150.742  10.912   2.851
  959    HG   LEU  34           HG       LEU  34 153.266  11.610   1.331
  960   1HD1  LEU  34          HD12      LEU  34 153.468   9.401   2.471
  961   2HD1  LEU  34          HD11      LEU  34 151.977   8.885   1.682
  962   3HD1  LEU  34          HD13      LEU  34 153.407   9.250   0.715
  963   1HD2  LEU  34          HD23      LEU  34 150.442  10.822   0.574
  964   2HD2  LEU  34          HD22      LEU  34 151.419  12.153  -0.040
  965   3HD2  LEU  34          HD21      LEU  34 151.779  10.505  -0.529
  966    H    GLU  35           HN       GLU  35 152.165  13.232   5.263
  967    HA   GLU  35           HA       GLU  35 149.596  13.070   6.507
  968   1HB   GLU  35           HB2      GLU  35 151.698  12.836   7.782
  969   2HB   GLU  35           HB1      GLU  35 152.055  14.543   7.506
  970   1HG   GLU  35           HG2      GLU  35 150.002  15.178   8.716
  971   2HG   GLU  35           HG1      GLU  35 149.618  13.476   8.966
  972    H    GLU  36           HN       GLU  36 151.412  15.885   5.317
  973    HA   GLU  36           HA       GLU  36 149.509  17.843   6.249
  974   1HB   GLU  36           HB2      GLU  36 151.566  17.921   4.021
  975   2HB   GLU  36           HB1      GLU  36 150.596  19.314   4.497
  976   1HG   GLU  36           HG2      GLU  36 151.484  19.156   6.793
  977   2HG   GLU  36           HG1      GLU  36 152.458  17.763   6.319
  978    H    ARG  37           HN       ARG  37 149.554  15.622   3.632
  979    HA   ARG  37           HA       ARG  37 147.534  17.112   2.069
  980   1HB   ARG  37           HB2      ARG  37 148.908  14.442   1.660
  981   2HB   ARG  37           HB1      ARG  37 147.690  15.082   0.559
  982   1HG   ARG  37           HG2      ARG  37 150.117  16.717   1.297
  983   2HG   ARG  37           HG1      ARG  37 150.202  15.508   0.019
  984   1HD   ARG  37           HD2      ARG  37 148.298  16.632  -1.133
  985   2HD   ARG  37           HD1      ARG  37 148.308  17.883   0.106
  986    HE   ARG  37           HE       ARG  37 150.918  17.850  -0.820
  987   1HH1  ARG  37          HH21      ARG  37 147.767  18.140  -2.188
  988   2HH1  ARG  37          HH22      ARG  37 148.289  19.129  -3.510
  989   1HH2  ARG  37          HH11      ARG  37 151.616  19.138  -2.537
  990   2HH2  ARG  37          HH12      ARG  37 150.467  19.692  -3.710
  991    H    GLY  38           HN       GLY  38 147.391  15.271   4.808
  992   1HA   GLY  38           HA2      GLY  38 145.281  14.736   5.841
  993   2HA   GLY  38           HA1      GLY  38 144.548  14.582   4.249
  994    H    PHE  39           HN       PHE  39 147.550  13.051   5.388
  995    HA   PHE  39           HA       PHE  39 146.181  10.389   5.343
  996   1HB   PHE  39           HB2      PHE  39 148.785  11.107   3.983
  997   2HB   PHE  39           HB1      PHE  39 148.205   9.456   4.198
  998    HD1  PHE  39           HD2      PHE  39 146.232   8.647   2.980
  999    HD2  PHE  39           HD1      PHE  39 147.708  12.635   2.442
 1000    HE1  PHE  39           HE2      PHE  39 144.824   8.892   0.951
 1001    HE2  PHE  39           HE1      PHE  39 146.303  12.887   0.413
 1002    HZ   PHE  39           HZ       PHE  39 144.859  11.013  -0.332
 1003    H    ASP  40           HN       ASP  40 146.347  10.969   7.748
 1004    HA   ASP  40           HA       ASP  40 149.054  10.938   8.876
 1005   1HB   ASP  40           HB2      ASP  40 147.924  11.061  11.045
 1006   2HB   ASP  40           HB1      ASP  40 147.231  12.242   9.934
 1007    H    LYS  41           HN       LYS  41 146.828   8.534   7.871
 1008    HA   LYS  41           HA       LYS  41 148.355   6.466   9.427
 1009   1HB   LYS  41           HB2      LYS  41 145.388   6.427   8.782
 1010   2HB   LYS  41           HB1      LYS  41 146.279   5.162   9.624
 1011   1HG   LYS  41           HG2      LYS  41 146.261   7.992  10.668
 1012   2HG   LYS  41           HG1      LYS  41 144.950   6.882  11.050
 1013   1HD   LYS  41           HD2      LYS  41 146.615   5.271  11.963
 1014   2HD   LYS  41           HD1      LYS  41 147.893   6.447  11.658
 1015   1HE   LYS  41           HE2      LYS  41 147.126   6.563  14.001
 1016   2HE   LYS  41           HE1      LYS  41 146.781   8.063  13.140
 1017   1HZ   LYS  41           HZ2      LYS  41 144.750   5.946  13.164
 1018   2HZ   LYS  41           HZ1      LYS  41 144.950   6.898  14.558
 1019   3HZ   LYS  41           HZ3      LYS  41 144.554   7.631  13.081
 1020    H    ALA  42           HN       ALA  42 148.653   4.477   8.354
 1021    HA   ALA  42           HA       ALA  42 149.102   4.646   5.540
 1022   1HB   ALA  42           HB1      ALA  42 150.317   3.118   7.088
 1023   2HB   ALA  42           HB3      ALA  42 148.851   2.148   7.234
 1024   3HB   ALA  42           HB2      ALA  42 149.669   2.282   5.677
 1025    H    TYR  43           HN       TYR  43 146.419   3.128   7.368
 1026    HA   TYR  43           HA       TYR  43 145.249   1.808   5.151
 1027   1HB   TYR  43           HB2      TYR  43 143.198   1.668   6.439
 1028   2HB   TYR  43           HB1      TYR  43 144.578   1.384   7.495
 1029    HD1  TYR  43           HD1      TYR  43 142.120   3.947   6.403
 1030    HD2  TYR  43           HD2      TYR  43 145.005   2.794   9.363
 1031    HE1  TYR  43           HE1      TYR  43 141.345   5.792   7.875
 1032    HE2  TYR  43           HE2      TYR  43 144.238   4.637  10.836
 1033    HH   TYR  43           HH       TYR  43 143.007   7.030  10.288
 1034    H    VAL  44           HN       VAL  44 145.285   5.221   5.836
 1035    HA   VAL  44           HA       VAL  44 142.917   5.778   4.181
 1036    HB   VAL  44           HB       VAL  44 145.144   7.647   5.077
 1037   1HG1  VAL  44          HG13      VAL  44 142.377   8.197   3.953
 1038   2HG1  VAL  44          HG12      VAL  44 143.492   9.422   4.557
 1039   3HG1  VAL  44          HG11      VAL  44 143.904   8.489   3.121
 1040   1HG2  VAL  44          HG21      VAL  44 143.894   6.660   6.968
 1041   2HG2  VAL  44          HG23      VAL  44 143.535   8.375   6.794
 1042   3HG2  VAL  44          HG22      VAL  44 142.376   7.170   6.230
 1043    H    VAL  45           HN       VAL  45 146.339   5.505   3.860
 1044    HA   VAL  45           HA       VAL  45 146.488   6.523   1.112
 1045    HB   VAL  45           HB       VAL  45 148.491   4.875   2.691
 1046   1HG1  VAL  45          HG12      VAL  45 148.712   6.526   0.158
 1047   2HG1  VAL  45          HG11      VAL  45 150.101   5.923   1.061
 1048   3HG1  VAL  45          HG13      VAL  45 148.972   4.790   0.320
 1049   1HG2  VAL  45          HG21      VAL  45 147.847   7.050   3.752
 1050   2HG2  VAL  45          HG23      VAL  45 149.529   7.007   3.234
 1051   3HG2  VAL  45          HG22      VAL  45 148.337   7.876   2.272
 1052    H    LEU  46           HN       LEU  46 146.311   3.389   2.737
 1053    HA   LEU  46           HA       LEU  46 146.679   1.733   0.437
 1054   1HB   LEU  46           HB2      LEU  46 146.621   0.860   2.783
 1055   2HB   LEU  46           HB1      LEU  46 144.909   1.253   2.865
 1056    HG   LEU  46           HG       LEU  46 144.584  -0.264   0.838
 1057   1HD1  LEU  46          HD11      LEU  46 147.477  -0.816   1.457
 1058   2HD1  LEU  46          HD13      LEU  46 146.460  -2.060   0.732
 1059   3HD1  LEU  46          HD12      LEU  46 146.711  -0.531  -0.105
 1060   1HD2  LEU  46          HD21      LEU  46 145.017  -0.986   3.642
 1061   2HD2  LEU  46          HD23      LEU  46 143.772  -1.523   2.520
 1062   3HD2  LEU  46          HD22      LEU  46 145.326  -2.346   2.563
 1063    H    GLY  47           HN       GLY  47 143.903   3.376   1.841
 1064   1HA   GLY  47           HA2      GLY  47 141.844   2.334   0.195
 1065   2HA   GLY  47           HA1      GLY  47 141.808   3.930   0.944
 1066    H    GLN  48           HN       GLN  48 144.043   5.096  -0.351
 1067    HA   GLN  48           HA       GLN  48 142.874   5.994  -2.792
 1068   1HB   GLN  48           HB2      GLN  48 144.660   7.190  -1.470
 1069   2HB   GLN  48           HB1      GLN  48 145.823   6.016  -2.082
 1070   1HG   GLN  48           HG2      GLN  48 145.934   7.956  -3.512
 1071   2HG   GLN  48           HG1      GLN  48 145.129   6.678  -4.422
 1072   1HE2  GLN  48          HE22      GLN  48 142.345   8.744  -4.988
 1073   2HE2  GLN  48          HE21      GLN  48 143.398   7.543  -5.568
 1074    H    PHE  49           HN       PHE  49 145.324   3.518  -2.131
 1075    HA   PHE  49           HA       PHE  49 145.985   2.859  -4.823
 1076   1HB   PHE  49           HB2      PHE  49 147.227   2.092  -2.796
 1077   2HB   PHE  49           HB1      PHE  49 145.874   1.044  -2.389
 1078    HD1  PHE  49           HD1      PHE  49 147.977   1.816  -5.415
 1079    HD2  PHE  49           HD2      PHE  49 146.135  -1.203  -2.970
 1080    HE1  PHE  49           HE1      PHE  49 148.950   0.052  -6.856
 1081    HE2  PHE  49           HE2      PHE  49 147.109  -2.964  -4.417
 1082    HZ   PHE  49           HZ       PHE  49 148.516  -2.337  -6.359
 1083    H    LEU  50           HN       LEU  50 143.432   1.742  -2.669
 1084    HA   LEU  50           HA       LEU  50 142.355  -0.255  -4.468
 1085   1HB   LEU  50           HB2      LEU  50 140.919   1.335  -2.317
 1086   2HB   LEU  50           HB1      LEU  50 140.329  -0.146  -3.065
 1087    HG   LEU  50           HG       LEU  50 142.858   0.117  -1.414
 1088   1HD1  LEU  50          HD13      LEU  50 140.179  -1.187  -0.845
 1089   2HD1  LEU  50          HD12      LEU  50 141.600  -1.316   0.194
 1090   3HD1  LEU  50          HD11      LEU  50 140.829   0.247  -0.059
 1091   1HD2  LEU  50          HD22      LEU  50 141.648  -2.149  -2.995
 1092   2HD2  LEU  50          HD21      LEU  50 143.333  -1.634  -2.905
 1093   3HD2  LEU  50          HD23      LEU  50 142.602  -2.488  -1.551
 1094    H    VAL  51           HN       VAL  51 141.686   3.178  -3.972
 1095    HA   VAL  51           HA       VAL  51 139.442   3.340  -5.749
 1096    HB   VAL  51           HB       VAL  51 141.390   5.438  -4.763
 1097   1HG1  VAL  51          HG11      VAL  51 138.861   5.678  -6.407
 1098   2HG1  VAL  51          HG13      VAL  51 139.496   7.015  -5.449
 1099   3HG1  VAL  51          HG12      VAL  51 140.455   6.343  -6.768
 1100   1HG2  VAL  51          HG23      VAL  51 139.948   4.280  -3.079
 1101   2HG2  VAL  51          HG22      VAL  51 139.578   5.998  -3.227
 1102   3HG2  VAL  51          HG21      VAL  51 138.528   4.801  -3.985
 1103    H    LEU  52           HN       LEU  52 142.914   3.461  -6.344
 1104    HA   LEU  52           HA       LEU  52 142.541   4.536  -9.063
 1105   1HB   LEU  52           HB2      LEU  52 145.000   3.490  -7.637
 1106   2HB   LEU  52           HB1      LEU  52 145.004   4.276  -9.215
 1107    HG   LEU  52           HG       LEU  52 143.942   5.553  -6.676
 1108   1HD1  LEU  52          HD11      LEU  52 146.626   5.707  -8.044
 1109   2HD1  LEU  52          HD13      LEU  52 146.059   6.973  -6.957
 1110   3HD1  LEU  52          HD12      LEU  52 146.282   5.330  -6.357
 1111   1HD2  LEU  52          HD22      LEU  52 144.229   6.444  -9.541
 1112   2HD2  LEU  52          HD21      LEU  52 142.905   6.723  -8.411
 1113   3HD2  LEU  52          HD23      LEU  52 144.401   7.639  -8.257
 1114    H    LYS  53           HN       LYS  53 141.652   1.685  -8.023
 1115    HA   LYS  53           HA       LYS  53 141.426  -0.431  -9.013
 1116   1HB   LYS  53           HB2      LYS  53 142.500   0.880 -11.531
 1117   2HB   LYS  53           HB1      LYS  53 141.488  -0.550 -11.418
 1118   1HG   LYS  53           HG2      LYS  53 140.601   2.179 -10.455
 1119   2HG   LYS  53           HG1      LYS  53 140.268   1.571 -12.073
 1120   1HD   LYS  53           HD2      LYS  53 139.211  -0.467 -10.941
 1121   2HD   LYS  53           HD1      LYS  53 139.296   0.452  -9.437
 1122   1HE   LYS  53           HE2      LYS  53 137.700   1.047 -11.919
 1123   2HE   LYS  53           HE1      LYS  53 137.150   0.969 -10.246
 1124   1HZ   LYS  53           HZ3      LYS  53 139.028   3.018 -11.284
 1125   2HZ   LYS  53           HZ2      LYS  53 137.352   3.253 -11.129
 1126   3HZ   LYS  53           HZ1      LYS  53 138.305   2.978  -9.750
 1127    H    LYS  54           HN       LYS  54 144.128   0.664  -7.987
 1128    HA   LYS  54           HA       LYS  54 146.280  -0.156  -7.689
 1129   1HB   LYS  54           HB2      LYS  54 145.187  -2.658  -9.005
 1130   2HB   LYS  54           HB1      LYS  54 146.615  -2.541  -7.980
 1131   1HG   LYS  54           HG2      LYS  54 145.201  -1.785  -6.101
 1132   2HG   LYS  54           HG1      LYS  54 143.775  -1.929  -7.123
 1133   1HD   LYS  54           HD2      LYS  54 144.217  -4.335  -7.420
 1134   2HD   LYS  54           HD1      LYS  54 145.646  -4.198  -6.394
 1135   1HE   LYS  54           HE2      LYS  54 144.254  -3.483  -4.505
 1136   2HE   LYS  54           HE1      LYS  54 142.814  -3.554  -5.522
 1137   1HZ   LYS  54           HZ2      LYS  54 143.991  -5.991  -5.850
 1138   2HZ   LYS  54           HZ1      LYS  54 144.205  -5.668  -4.195
 1139   3HZ   LYS  54           HZ3      LYS  54 142.647  -5.655  -4.865
 1140    H    ASP  55           HN       ASP  55 145.383   1.009 -10.460
 1141    HA   ASP  55           HA       ASP  55 147.083  -0.297 -12.401
 1142   1HB   ASP  55           HB2      ASP  55 145.251   1.296 -13.000
 1143   2HB   ASP  55           HB1      ASP  55 146.208   2.603 -12.320
 1144    H    GLU  56           HN       GLU  56 149.302  -0.283 -12.438
 1145    HA   GLU  56           HA       GLU  56 150.844   0.971 -10.408
 1146   1HB   GLU  56           HB2      GLU  56 151.481  -1.082 -11.657
 1147   2HB   GLU  56           HB1      GLU  56 151.811  -0.081 -13.071
 1148   1HG   GLU  56           HG2      GLU  56 153.522   1.156 -11.850
 1149   2HG   GLU  56           HG1      GLU  56 153.144   0.271 -10.371
 1150    H    ASP  57           HN       ASP  57 150.362   1.991 -13.801
 1151    HA   ASP  57           HA       ASP  57 152.329   4.105 -13.649
 1152   1HB   ASP  57           HB2      ASP  57 150.010   3.614 -15.532
 1153   2HB   ASP  57           HB1      ASP  57 151.142   4.953 -15.723
 1154    H    LEU  58           HN       LEU  58 148.851   4.006 -13.162
 1155    HA   LEU  58           HA       LEU  58 148.605   6.886 -12.806
 1156   1HB   LEU  58           HB2      LEU  58 146.776   4.717 -11.749
 1157   2HB   LEU  58           HB1      LEU  58 146.383   6.423 -11.879
 1158    HG   LEU  58           HG       LEU  58 147.046   4.597 -14.211
 1159   1HD1  LEU  58          HD12      LEU  58 144.784   4.331 -13.003
 1160   2HD1  LEU  58          HD11      LEU  58 144.406   5.942 -13.613
 1161   3HD1  LEU  58          HD13      LEU  58 144.730   4.625 -14.740
 1162   1HD2  LEU  58          HD22      LEU  58 146.520   7.559 -13.967
 1163   2HD2  LEU  58          HD21      LEU  58 147.729   6.721 -14.940
 1164   3HD2  LEU  58          HD23      LEU  58 146.040   6.710 -15.436
 1165    H    PHE  59           HN       PHE  59 149.166   4.168 -10.604
 1166    HA   PHE  59           HA       PHE  59 148.929   5.663  -8.165
 1167   1HB   PHE  59           HB2      PHE  59 148.967   3.188  -8.223
 1168   2HB   PHE  59           HB1      PHE  59 150.648   3.233  -8.752
 1169    HD1  PHE  59           HD1      PHE  59 148.440   4.552  -6.026
 1170    HD2  PHE  59           HD2      PHE  59 152.349   3.160  -7.127
 1171    HE1  PHE  59           HE1      PHE  59 149.160   4.713  -3.661
 1172    HE2  PHE  59           HE2      PHE  59 153.071   3.323  -4.761
 1173    HZ   PHE  59           HZ       PHE  59 151.476   4.100  -3.027
 1174    H    ARG  60           HN       ARG  60 151.735   4.933 -10.237
 1175    HA   ARG  60           HA       ARG  60 153.702   6.159  -8.608
 1176   1HB   ARG  60           HB2      ARG  60 153.545   5.800 -11.603
 1177   2HB   ARG  60           HB1      ARG  60 154.972   6.435 -10.787
 1178   1HG   ARG  60           HG2      ARG  60 155.223   4.395  -9.507
 1179   2HG   ARG  60           HG1      ARG  60 153.698   3.767 -10.127
 1180   1HD   ARG  60           HD2      ARG  60 154.577   3.545 -12.336
 1181   2HD   ARG  60           HD1      ARG  60 155.990   4.522 -11.948
 1182    HE   ARG  60           HE       ARG  60 156.138   2.355 -10.203
 1183   1HH1  ARG  60          HH21      ARG  60 155.825   2.833 -13.604
 1184   2HH1  ARG  60          HH22      ARG  60 156.711   1.404 -14.021
 1185   1HH2  ARG  60          HH11      ARG  60 157.310   0.495 -10.728
 1186   2HH2  ARG  60          HH12      ARG  60 157.555   0.083 -12.393
 1187    H    GLU  61           HN       GLU  61 151.743   7.626 -11.245
 1188    HA   GLU  61           HA       GLU  61 153.019  10.188 -11.029
 1189   1HB   GLU  61           HB2      GLU  61 150.298   9.359 -12.069
 1190   2HB   GLU  61           HB1      GLU  61 150.915  11.008 -12.181
 1191   1HG   GLU  61           HG2      GLU  61 152.381   8.591 -13.268
 1192   2HG   GLU  61           HG1      GLU  61 151.319   9.608 -14.243
 1193    H    TRP  62           HN       TRP  62 150.216   8.726  -9.394
 1194    HA   TRP  62           HA       TRP  62 149.281  11.093  -8.139
 1195   1HB   TRP  62           HB2      TRP  62 147.895   9.128  -8.059
 1196   2HB   TRP  62           HB1      TRP  62 149.159   8.200  -7.250
 1197    HD1  TRP  62           HD1      TRP  62 146.673  11.056  -6.624
 1198    HE1  TRP  62           HE1      TRP  62 146.419  11.388  -4.070
 1199    HE3  TRP  62           HE3      TRP  62 150.233   7.797  -4.941
 1200    HZ2  TRP  62           HZ2      TRP  62 147.556  10.380  -1.647
 1201    HZ3  TRP  62           HZ3      TRP  62 150.615   7.498  -2.514
 1202    HH2  TRP  62           HH2      TRP  62 149.283   8.786  -0.867
 1203    H    LEU  63           HN       LEU  63 151.603   8.665  -6.897
 1204    HA   LEU  63           HA       LEU  63 152.049  10.094  -4.445
 1205   1HB   LEU  63           HB2      LEU  63 152.562   7.696  -4.676
 1206   2HB   LEU  63           HB1      LEU  63 153.811   8.072  -5.861
 1207    HG   LEU  63           HG       LEU  63 155.046   9.360  -4.154
 1208   1HD1  LEU  63          HD11      LEU  63 152.642   8.662  -2.484
 1209   2HD1  LEU  63          HD13      LEU  63 154.207   8.905  -1.709
 1210   3HD1  LEU  63          HD12      LEU  63 153.475  10.208  -2.638
 1211   1HD2  LEU  63          HD21      LEU  63 155.463   6.926  -4.457
 1212   2HD2  LEU  63          HD23      LEU  63 155.772   7.453  -2.803
 1213   3HD2  LEU  63          HD22      LEU  63 154.283   6.589  -3.190
 1214    H    LYS  64           HN       LYS  64 153.885   9.951  -7.487
 1215    HA   LYS  64           HA       LYS  64 155.996  11.681  -6.667
 1216   1HB   LYS  64           HB2      LYS  64 156.122  10.306  -8.707
 1217   2HB   LYS  64           HB1      LYS  64 154.858  11.287  -9.447
 1218   1HG   LYS  64           HG2      LYS  64 156.269  13.269  -9.352
 1219   2HG   LYS  64           HG1      LYS  64 157.509  12.383  -8.464
 1220   1HD   LYS  64           HD2      LYS  64 157.783  10.862 -10.395
 1221   2HD   LYS  64           HD1      LYS  64 156.573  11.789 -11.284
 1222   1HE   LYS  64           HE2      LYS  64 157.956  13.748 -11.299
 1223   2HE   LYS  64           HE1      LYS  64 159.079  13.040 -10.138
 1224   1HZ   LYS  64           HZ3      LYS  64 158.561  11.858 -12.805
 1225   2HZ   LYS  64           HZ2      LYS  64 159.804  12.979 -12.519
 1226   3HZ   LYS  64           HZ1      LYS  64 159.812  11.478 -11.725
 1227    H    ASP  65           HN       ASP  65 153.007  12.452  -8.450
 1228    HA   ASP  65           HA       ASP  65 153.525  15.286  -8.495
 1229   1HB   ASP  65           HB2      ASP  65 150.980  13.678  -8.838
 1230   2HB   ASP  65           HB1      ASP  65 151.055  15.429  -9.041
 1231    H    THR  66           HN       THR  66 152.092  13.128  -6.150
 1232    HA   THR  66           HA       THR  66 150.797  15.260  -4.649
 1233    HB   THR  66           HB       THR  66 151.376  12.369  -3.956
 1234    HG1  THR  66           HG1      THR  66 149.064  13.775  -4.799
 1235   1HG2  THR  66          HG21      THR  66 149.834  14.525  -2.495
 1236   2HG2  THR  66          HG23      THR  66 149.601  12.804  -2.185
 1237   3HG2  THR  66          HG22      THR  66 151.169  13.551  -1.881
 1238    H    CYS  67           HN       CYS  67 153.927  13.528  -4.372
 1239    HA   CYS  67           HA       CYS  67 154.633  15.482  -2.193
 1240   1HB   CYS  67           HB2      CYS  67 155.871  13.712  -1.066
 1241   2HB   CYS  67           HB1      CYS  67 154.189  13.225  -1.276
 1242    HG   CYS  67           HG       CYS  67 156.338  12.248  -3.320
 1243    H    GLY  68           HN       GLY  68 155.728  13.670  -5.008
 1244   1HA   GLY  68           HA2      GLY  68 157.450  14.657  -6.448
 1245   2HA   GLY  68           HA1      GLY  68 158.220  15.336  -5.013
 1246    H    ALA  69           HN       ALA  69 157.027  12.139  -4.608
 1247    HA   ALA  69           HA       ALA  69 159.496  11.015  -3.893
 1248   1HB   ALA  69           HB1      ALA  69 157.238   9.964  -3.516
 1249   2HB   ALA  69           HB3      ALA  69 157.216   9.516  -5.221
 1250   3HB   ALA  69           HB2      ALA  69 158.442   8.843  -4.148
 1251    H    ASN  70           HN       ASN  70 160.966   9.604  -5.080
 1252    HA   ASN  70           HA       ASN  70 161.249  10.440  -7.899
 1253   1HB   ASN  70           HB2      ASN  70 163.155  10.371  -6.197
 1254   2HB   ASN  70           HB1      ASN  70 163.068   8.614  -6.320
 1255   1HD2  ASN  70          HD22      ASN  70 165.301   8.838  -9.042
 1256   2HD2  ASN  70          HD21      ASN  70 164.999   8.211  -7.495
 1257    H    ALA  71           HN       ALA  71 161.983   8.638  -9.438
 1258    HA   ALA  71           HA       ALA  71 159.879   6.769  -9.785
 1259   1HB   ALA  71           HB2      ALA  71 161.387   7.565 -11.599
 1260   2HB   ALA  71           HB1      ALA  71 162.688   6.597 -10.907
 1261   3HB   ALA  71           HB3      ALA  71 161.252   5.807 -11.554
 1262    H    LYS  72           HN       LYS  72 163.015   6.398  -8.139
 1263    HA   LYS  72           HA       LYS  72 162.818   3.521  -7.956
 1264   1HB   LYS  72           HB2      LYS  72 164.409   5.557  -6.374
 1265   2HB   LYS  72           HB1      LYS  72 164.564   3.814  -6.147
 1266   1HG   LYS  72           HG2      LYS  72 165.175   3.556  -8.524
 1267   2HG   LYS  72           HG1      LYS  72 165.025   5.298  -8.753
 1268   1HD   LYS  72           HD2      LYS  72 166.800   5.674  -7.080
 1269   2HD   LYS  72           HD1      LYS  72 166.954   3.932  -6.855
 1270   1HE   LYS  72           HE2      LYS  72 167.388   5.385  -9.479
 1271   2HE   LYS  72           HE1      LYS  72 168.673   4.820  -8.414
 1272   1HZ   LYS  72           HZ2      LYS  72 166.592   3.056  -9.581
 1273   2HZ   LYS  72           HZ1      LYS  72 168.135   3.280 -10.257
 1274   3HZ   LYS  72           HZ3      LYS  72 167.979   2.579  -8.721
 1275    H    GLN  73           HN       GLN  73 161.932   6.175  -5.767
 1276    HA   GLN  73           HA       GLN  73 161.168   4.492  -3.579
 1277   1HB   GLN  73           HB2      GLN  73 160.236   7.290  -4.289
 1278   2HB   GLN  73           HB1      GLN  73 159.993   6.502  -2.730
 1279   1HG   GLN  73           HG2      GLN  73 162.706   6.998  -3.988
 1280   2HG   GLN  73           HG1      GLN  73 161.976   8.026  -2.754
 1281   1HE2  GLN  73          HE22      GLN  73 164.136   5.104  -1.374
 1282   2HE2  GLN  73          HE21      GLN  73 164.395   6.026  -2.775
 1283    H    SER  74           HN       SER  74 159.380   5.735  -6.372
 1284    HA   SER  74           HA       SER  74 156.795   4.957  -5.432
 1285   1HB   SER  74           HB2      SER  74 156.041   5.463  -7.600
 1286   2HB   SER  74           HB1      SER  74 157.453   6.499  -7.416
 1287    HG   SER  74           HG       SER  74 157.237   4.019  -8.773
 1288    H    ARG  75           HN       ARG  75 159.299   3.214  -7.302
 1289    HA   ARG  75           HA       ARG  75 157.696   0.959  -7.974
 1290   1HB   ARG  75           HB2      ARG  75 160.674   1.206  -7.491
 1291   2HB   ARG  75           HB1      ARG  75 159.908  -0.269  -8.081
 1292   1HG   ARG  75           HG2      ARG  75 159.010   0.967 -10.016
 1293   2HG   ARG  75           HG1      ARG  75 159.782   2.441  -9.430
 1294   1HD   ARG  75           HD2      ARG  75 161.993   1.323  -9.566
 1295   2HD   ARG  75           HD1      ARG  75 161.208  -0.121 -10.202
 1296    HE   ARG  75           HE       ARG  75 160.399   1.871 -11.940
 1297   1HH1  ARG  75          HH21      ARG  75 163.384   0.732 -10.660
 1298   2HH1  ARG  75          HH22      ARG  75 164.301   1.138 -12.072
 1299   1HH2  ARG  75          HH11      ARG  75 161.577   2.411 -13.797
 1300   2HH2  ARG  75          HH12      ARG  75 163.277   2.090 -13.848
 1301    H    ASP  76           HN       ASP  76 159.609   1.658  -5.038
 1302    HA   ASP  76           HA       ASP  76 159.254  -0.932  -3.878
 1303   1HB   ASP  76           HB2      ASP  76 159.822   1.780  -2.662
 1304   2HB   ASP  76           HB1      ASP  76 159.809   0.286  -1.725
 1305    H    CYS  77           HN       CYS  77 157.317   2.061  -3.616
 1306    HA   CYS  77           HA       CYS  77 155.559   1.003  -1.600
 1307   1HB   CYS  77           HB2      CYS  77 155.251   3.238  -3.620
 1308   2HB   CYS  77           HB1      CYS  77 154.037   2.869  -2.395
 1309    HG   CYS  77           HG       CYS  77 156.121   4.665  -1.741
 1310    H    PHE  78           HN       PHE  78 155.401   1.039  -5.190
 1311    HA   PHE  78           HA       PHE  78 152.739   0.052  -5.355
 1312   1HB   PHE  78           HB2      PHE  78 153.891   0.904  -7.333
 1313   2HB   PHE  78           HB1      PHE  78 155.058  -0.418  -7.251
 1314    HD1  PHE  78           HD1      PHE  78 151.549   0.481  -7.972
 1315    HD2  PHE  78           HD2      PHE  78 154.446  -2.687  -7.869
 1316    HE1  PHE  78           HE1      PHE  78 150.003  -0.973  -9.258
 1317    HE2  PHE  78           HE2      PHE  78 152.904  -4.143  -9.155
 1318    HZ   PHE  78           HZ       PHE  78 150.680  -3.286  -9.849
 1319    H    GLY  79           HN       GLY  79 155.762  -1.859  -5.680
 1320   1HA   GLY  79           HA2      GLY  79 154.476  -4.385  -5.609
 1321   2HA   GLY  79           HA1      GLY  79 156.169  -4.107  -5.207
 1322    H    CYS  80           HN       CYS  80 155.541  -2.264  -2.999
 1323    HA   CYS  80           HA       CYS  80 155.278  -4.248  -0.905
 1324   1HB   CYS  80           HB2      CYS  80 156.562  -2.158  -0.590
 1325   2HB   CYS  80           HB1      CYS  80 155.072  -1.227  -0.734
 1326    HG   CYS  80           HG       CYS  80 155.517  -1.673   1.821
 1327    H    LEU  81           HN       LEU  81 153.086  -1.655  -2.092
 1328    HA   LEU  81           HA       LEU  81 150.941  -2.465  -0.329
 1329   1HB   LEU  81           HB2      LEU  81 150.910  -0.846  -2.897
 1330   2HB   LEU  81           HB1      LEU  81 149.533  -1.026  -1.811
 1331    HG   LEU  81           HG       LEU  81 152.223   0.103  -0.980
 1332   1HD1  LEU  81          HD13      LEU  81 149.661   1.440  -1.871
 1333   2HD1  LEU  81          HD12      LEU  81 150.872   2.277  -0.900
 1334   3HD1  LEU  81          HD11      LEU  81 151.290   1.679  -2.505
 1335   1HD2  LEU  81          HD21      LEU  81 149.589  -0.355   0.416
 1336   2HD2  LEU  81          HD23      LEU  81 151.227  -0.619   1.013
 1337   3HD2  LEU  81          HD22      LEU  81 150.587   1.015   0.899
 1338    H    ARG  82           HN       ARG  82 151.819  -3.209  -3.695
 1339    HA   ARG  82           HA       ARG  82 149.472  -4.688  -4.342
 1340   1HB   ARG  82           HB2      ARG  82 151.230  -3.973  -5.995
 1341   2HB   ARG  82           HB1      ARG  82 152.296  -5.207  -5.330
 1342   1HG   ARG  82           HG2      ARG  82 151.359  -6.329  -7.153
 1343   2HG   ARG  82           HG1      ARG  82 150.298  -6.843  -5.851
 1344   1HD   ARG  82           HD2      ARG  82 148.905  -4.703  -6.555
 1345   2HD   ARG  82           HD1      ARG  82 149.766  -4.888  -8.076
 1346    HE   ARG  82           HE       ARG  82 147.531  -6.444  -7.197
 1347   1HH1  ARG  82          HH21      ARG  82 150.642  -6.834  -8.645
 1348   2HH1  ARG  82          HH22      ARG  82 150.309  -8.429  -9.224
 1349   1HH2  ARG  82          HH11      ARG  82 147.086  -8.508  -7.960
 1350   2HH2  ARG  82          HH12      ARG  82 148.299  -9.373  -8.844
 1351    H    GLU  83           HN       GLU  83 152.507  -5.687  -2.771
 1352    HA   GLU  83           HA       GLU  83 151.791  -8.470  -2.634
 1353   1HB   GLU  83           HB2      GLU  83 153.842  -6.783  -1.203
 1354   2HB   GLU  83           HB1      GLU  83 153.619  -8.490  -0.817
 1355   1HG   GLU  83           HG2      GLU  83 154.020  -9.081  -3.178
 1356   2HG   GLU  83           HG1      GLU  83 154.248  -7.379  -3.571
 1357    H    TRP  84           HN       TRP  84 151.352  -5.777  -0.279
 1358    HA   TRP  84           HA       TRP  84 150.472  -7.434   1.872
 1359   1HB   TRP  84           HB2      TRP  84 150.997  -4.976   2.063
 1360   2HB   TRP  84           HB1      TRP  84 149.481  -4.638   1.227
 1361    HD1  TRP  84           HD1      TRP  84 150.889  -5.853   4.532
 1362    HE1  TRP  84           HE1      TRP  84 148.999  -5.958   6.280
 1363    HE3  TRP  84           HE3      TRP  84 146.855  -4.977   1.524
 1364    HZ2  TRP  84           HZ2      TRP  84 146.153  -5.707   6.389
 1365    HZ3  TRP  84           HZ3      TRP  84 144.567  -4.919   2.477
 1366    HH2  TRP  84           HH2      TRP  84 144.210  -5.283   4.908
 1367    H    CYS  85           HN       CYS  85 148.724  -5.890  -0.797
 1368    HA   CYS  85           HA       CYS  85 146.103  -6.745  -0.046
 1369   1HB   CYS  85           HB2      CYS  85 147.317  -6.088  -2.740
 1370   2HB   CYS  85           HB1      CYS  85 145.606  -6.458  -2.524
 1371    HG   CYS  85           HG       CYS  85 146.489  -3.778  -2.216
 1372    H    ASP  86           HN       ASP  86 148.616  -8.290  -2.011
 1373    HA   ASP  86           HA       ASP  86 147.097 -10.512  -2.919
 1374   1HB   ASP  86           HB2      ASP  86 150.049 -10.232  -2.299
 1375   2HB   ASP  86           HB1      ASP  86 149.352 -11.664  -3.056
 1376    H    ALA  87           HN       ALA  87 148.720  -9.905   0.161
 1377    HA   ALA  87           HA       ALA  87 148.207 -12.657   1.091
 1378   1HB   ALA  87           HB3      ALA  87 150.261 -11.259   1.716
 1379   2HB   ALA  87           HB2      ALA  87 149.180 -10.333   2.763
 1380   3HB   ALA  87           HB1      ALA  87 149.423 -12.055   3.048
 1381    H    PHE  88           HN       PHE  88 146.914  -9.397   1.622
 1382    HA   PHE  88           HA       PHE  88 144.885 -10.539   3.503
 1383   1HB   PHE  88           HB2      PHE  88 145.805  -7.709   2.966
 1384   2HB   PHE  88           HB1      PHE  88 144.422  -8.101   3.988
 1385    HD1  PHE  88           HD2      PHE  88 144.746  -9.541   6.024
 1386    HD2  PHE  88           HD1      PHE  88 148.052  -7.998   3.752
 1387    HE1  PHE  88           HE2      PHE  88 146.269 -10.005   7.925
 1388    HE2  PHE  88           HE1      PHE  88 149.579  -8.466   5.657
 1389    HZ   PHE  88           HZ       PHE  88 148.681  -9.461   7.743
 1390    H    LEU  89           HN       LEU  89 144.449  -7.637   1.512
 1391    HA   LEU  89           HA       LEU  89 141.832  -8.614   0.673
 1392   1HB   LEU  89           HB2      LEU  89 142.290  -6.201   1.187
 1393   2HB   LEU  89           HB1      LEU  89 143.374  -6.141  -0.199
 1394    HG   LEU  89           HG       LEU  89 141.280  -6.993  -1.551
 1395   1HD1  LEU  89          HD11      LEU  89 139.890  -7.417   0.480
 1396   2HD1  LEU  89          HD13      LEU  89 139.931  -5.689   0.831
 1397   3HD1  LEU  89          HD12      LEU  89 139.139  -6.277  -0.631
 1398   1HD2  LEU  89          HD23      LEU  89 141.403  -4.171  -0.437
 1399   2HD2  LEU  89          HD22      LEU  89 142.319  -4.773  -1.821
 1400   3HD2  LEU  89          HD21      LEU  89 140.562  -4.659  -1.911
   
  No H/Q in entry =        1400
  Start of MODEL    5
    1   1H    MET   1           HT1      MET   1 115.816  -8.803  15.458
    2   2H    MET   1           HT3      MET   1 115.787  -7.111  15.585
    3   3H    MET   1           HT2      MET   1 114.329  -7.979  15.485
    4    HA   MET   1           HA       MET   1 114.654  -8.527  13.245
    5   1HB   MET   1           HB2      MET   1 115.555  -5.694  13.838
    6   2HB   MET   1           HB1      MET   1 115.156  -6.265  12.217
    7   1HG   MET   1           HG2      MET   1 112.891  -6.835  12.933
    8   2HG   MET   1           HG1      MET   1 113.274  -6.375  14.593
    9   1HE   MET   1           HE1      MET   1 110.894  -5.472  12.967
   10   2HE   MET   1           HE3      MET   1 111.083  -4.656  14.526
   11   3HE   MET   1           HE2      MET   1 110.775  -3.717  13.067
   12    H    THR   2           HN       THR   2 116.297 -10.024  12.783
   13    HA   THR   2           HA       THR   2 119.118  -9.195  12.856
   14    HB   THR   2           HB       THR   2 119.559 -11.502  12.085
   15    HG1  THR   2           HG1      THR   2 117.798 -11.858  10.789
   16   1HG2  THR   2          HG22      THR   2 119.151 -10.963  14.506
   17   2HG2  THR   2          HG21      THR   2 117.472 -11.453  14.277
   18   3HG2  THR   2          HG23      THR   2 118.770 -12.629  14.071
   19    H    THR   3           HN       THR   3 120.509  -9.456  10.942
   20    HA   THR   3           HA       THR   3 119.288  -8.225   8.576
   21    HB   THR   3           HB       THR   3 121.609  -8.149   7.730
   22    HG1  THR   3           HG1      THR   3 122.393  -9.314  10.170
   23   1HG2  THR   3          HG23      THR   3 120.793  -6.403   9.296
   24   2HG2  THR   3          HG22      THR   3 121.409  -7.353  10.648
   25   3HG2  THR   3          HG21      THR   3 122.527  -6.682   9.461
   26    H    SER   4           HN       SER   4 119.949  -9.195   6.367
   27    HA   SER   4           HA       SER   4 118.893 -11.876   6.209
   28   1HB   SER   4           HB2      SER   4 119.373 -11.692   3.805
   29   2HB   SER   4           HB1      SER   4 118.605 -10.221   4.396
   30    HG   SER   4           HG       SER   4 120.966  -9.588   4.741
   31    H    GLN   5           HN       GLN   5 120.074 -13.639   5.056
   32    HA   GLN   5           HA       GLN   5 122.386 -14.453   6.486
   33   1HB   GLN   5           HB2      GLN   5 121.198 -15.408   3.868
   34   2HB   GLN   5           HB1      GLN   5 122.542 -16.220   4.671
   35   1HG   GLN   5           HG2      GLN   5 121.158 -16.521   6.693
   36   2HG   GLN   5           HG1      GLN   5 119.810 -15.713   5.890
   37   1HE2  GLN   5          HE22      GLN   5 120.247 -18.715   3.421
   38   2HE2  GLN   5          HE21      GLN   5 120.962 -17.180   3.303
   39    H    LYS   6           HN       LYS   6 122.119 -12.401   3.693
   40    HA   LYS   6           HA       LYS   6 124.663 -12.898   2.494
   41   1HB   LYS   6           HB2      LYS   6 122.918 -10.421   2.580
   42   2HB   LYS   6           HB1      LYS   6 124.357 -10.572   1.570
   43   1HG   LYS   6           HG2      LYS   6 123.371 -12.543   0.456
   44   2HG   LYS   6           HG1      LYS   6 121.931 -12.389   1.462
   45   1HD   LYS   6           HD2      LYS   6 121.512 -10.143   0.530
   46   2HD   LYS   6           HD1      LYS   6 122.950 -10.294  -0.480
   47   1HE   LYS   6           HE2      LYS   6 121.980 -12.208  -1.643
   48   2HE   LYS   6           HE1      LYS   6 120.574 -12.176  -0.580
   49   1HZ   LYS   6           HZ1      LYS   6 120.093  -9.929  -1.395
   50   2HZ   LYS   6           HZ3      LYS   6 121.398 -10.041  -2.473
   51   3HZ   LYS   6           HZ2      LYS   6 120.065 -11.082  -2.643
   52    H    HIS   7           HN       HIS   7 123.640 -10.765   5.143
   53    HA   HIS   7           HA       HIS   7 126.034  -9.266   5.386
   54   1HB   HIS   7           HB2      HIS   7 124.022  -8.626   6.586
   55   2HB   HIS   7           HB1      HIS   7 124.035 -10.136   7.493
   56    HD2  HIS   7           HD2      HIS   7 125.930 -10.238   9.615
   57    HE1  HIS   7           HE1      HIS   7 127.135  -6.205   9.310
   58    HE2  HIS   7           HE2      HIS   7 127.264  -8.298  10.732
   59    H    ARG   8           HN       ARG   8 125.121 -12.299   7.069
   60    HA   ARG   8           HA       ARG   8 127.649 -12.529   8.417
   61   1HB   ARG   8           HB2      ARG   8 125.452 -14.525   7.831
   62   2HB   ARG   8           HB1      ARG   8 126.885 -14.915   8.790
   63   1HG   ARG   8           HG2      ARG   8 126.345 -13.077  10.347
   64   2HG   ARG   8           HG1      ARG   8 124.910 -12.695   9.394
   65   1HD   ARG   8           HD2      ARG   8 124.015 -14.953   9.831
   66   2HD   ARG   8           HD1      ARG   8 125.448 -15.334  10.787
   67    HE   ARG   8           HE       ARG   8 124.453 -13.039  11.978
   68   1HH1  ARG   8          HH21      ARG   8 123.237 -16.138  11.091
   69   2HH1  ARG   8          HH22      ARG   8 122.073 -16.197  12.371
   70   1HH2  ARG   8          HH11      ARG   8 122.939 -13.093  13.655
   71   2HH2  ARG   8          HH12      ARG   8 121.905 -14.471  13.825
   72    H    ASP   9           HN       ASP   9 126.451 -13.586   5.298
   73    HA   ASP   9           HA       ASP   9 128.594 -15.452   4.760
   74   1HB   ASP   9           HB2      ASP   9 126.665 -13.984   2.955
   75   2HB   ASP   9           HB1      ASP   9 127.836 -15.160   2.363
   76    H    PHE  10           HN       PHE  10 128.066 -12.013   4.053
   77    HA   PHE  10           HA       PHE  10 130.391 -11.711   2.393
   78   1HB   PHE  10           HB2      PHE  10 128.433 -10.123   2.549
   79   2HB   PHE  10           HB1      PHE  10 129.081  -9.577   4.096
   80    HD1  PHE  10           HD1      PHE  10 129.587  -9.654   0.459
   81    HD2  PHE  10           HD2      PHE  10 131.174  -8.304   4.214
   82    HE1  PHE  10           HE1      PHE  10 131.134  -8.136  -0.745
   83    HE2  PHE  10           HE2      PHE  10 132.725  -6.785   3.011
   84    HZ   PHE  10           HZ       PHE  10 132.705  -6.702   0.531
   85    H    VAL  11           HN       VAL  11 129.890 -11.214   5.896
   86    HA   VAL  11           HA       VAL  11 132.716 -10.450   6.255
   87    HB   VAL  11           HB       VAL  11 132.119 -10.216   8.613
   88   1HG1  VAL  11          HG12      VAL  11 129.968  -9.185   6.737
   89   2HG1  VAL  11          HG11      VAL  11 130.246  -8.586   8.372
   90   3HG1  VAL  11          HG13      VAL  11 131.483  -8.372   7.133
   91   1HG2  VAL  11          HG22      VAL  11 129.621 -11.645   7.709
   92   2HG2  VAL  11          HG21      VAL  11 130.725 -12.108   9.002
   93   3HG2  VAL  11          HG23      VAL  11 129.666 -10.711   9.203
   94    H    ALA  12           HN       ALA  12 131.603 -13.278   5.429
   95    HA   ALA  12           HA       ALA  12 133.071 -14.861   7.519
   96   1HB   ALA  12           HB2      ALA  12 130.811 -15.595   5.652
   97   2HB   ALA  12           HB1      ALA  12 131.757 -16.803   6.521
   98   3HB   ALA  12           HB3      ALA  12 130.809 -15.614   7.415
   99    H    GLU  13           HN       GLU  13 133.282 -13.729   4.310
  100    HA   GLU  13           HA       GLU  13 135.580 -15.514   3.837
  101   1HB   GLU  13           HB2      GLU  13 134.736 -16.305   1.666
  102   2HB   GLU  13           HB1      GLU  13 133.633 -16.778   2.958
  103   1HG   GLU  13           HG2      GLU  13 132.374 -14.581   2.431
  104   2HG   GLU  13           HG1      GLU  13 133.305 -14.562   0.933
  105    HA   PRO  14           HA       PRO  14 137.418 -11.942   1.877
  106   1HB   PRO  14           HB2      PRO  14 137.750 -13.748  -0.512
  107   2HB   PRO  14           HB1      PRO  14 138.929 -12.652   0.239
  108   1HG   PRO  14           HG2      PRO  14 139.014 -15.282   0.675
  109   2HG   PRO  14           HG1      PRO  14 139.402 -14.117   1.956
  110   1HD   PRO  14           HD2      PRO  14 137.000 -15.852   1.673
  111   2HD   PRO  14           HD1      PRO  14 137.710 -15.136   3.136
  112    H    MET  15           HN       MET  15 136.939 -10.402   0.089
  113    HA   MET  15           HA       MET  15 134.134 -10.661  -0.824
  114   1HB   MET  15           HB2      MET  15 134.600  -8.307  -1.715
  115   2HB   MET  15           HB1      MET  15 134.674  -8.505   0.036
  116   1HG   MET  15           HG2      MET  15 137.037  -8.472   0.057
  117   2HG   MET  15           HG1      MET  15 137.146  -8.785  -1.673
  118   1HE   MET  15           HE1      MET  15 135.675  -6.635   0.977
  119   2HE   MET  15           HE3      MET  15 137.256  -5.848   0.997
  120   3HE   MET  15           HE2      MET  15 135.835  -4.964   0.446
  121    H    GLY  16           HN       GLY  16 137.332 -11.070  -2.048
  122   1HA   GLY  16           HA2      GLY  16 138.149 -11.512  -4.203
  123   2HA   GLY  16           HA1      GLY  16 136.609 -12.338  -4.424
  124    H    GLU  17           HN       GLU  17 136.203 -11.690  -6.526
  125    HA   GLU  17           HA       GLU  17 136.192  -8.775  -7.149
  126   1HB   GLU  17           HB2      GLU  17 136.091 -11.260  -8.880
  127   2HB   GLU  17           HB1      GLU  17 135.943  -9.623  -9.516
  128   1HG   GLU  17           HG2      GLU  17 138.140  -9.044  -8.557
  129   2HG   GLU  17           HG1      GLU  17 138.294 -10.681  -7.919
  130    H    LYS  18           HN       LYS  18 134.058 -10.146  -5.550
  131    HA   LYS  18           HA       LYS  18 131.728 -10.545  -7.153
  132   1HB   LYS  18           HB2      LYS  18 132.033  -9.638  -4.273
  133   2HB   LYS  18           HB1      LYS  18 130.478 -10.029  -5.004
  134   1HG   LYS  18           HG2      LYS  18 131.363 -12.297  -5.572
  135   2HG   LYS  18           HG1      LYS  18 132.847 -11.897  -4.708
  136   1HD   LYS  18           HD2      LYS  18 131.412 -11.414  -2.674
  137   2HD   LYS  18           HD1      LYS  18 130.054 -12.109  -3.561
  138   1HE   LYS  18           HE2      LYS  18 132.665 -13.567  -3.072
  139   2HE   LYS  18           HE1      LYS  18 131.237 -13.748  -2.055
  140   1HZ   LYS  18           HZ3      LYS  18 130.013 -14.333  -4.147
  141   2HZ   LYS  18           HZ2      LYS  18 131.521 -14.429  -4.924
  142   3HZ   LYS  18           HZ1      LYS  18 131.159 -15.473  -3.635
  143    HA   PRO  19           HA       PRO  19 130.859  -6.391  -8.450
  144   1HB   PRO  19           HB2      PRO  19 128.105  -6.432  -8.624
  145   2HB   PRO  19           HB1      PRO  19 129.175  -7.227  -9.797
  146   1HG   PRO  19           HG2      PRO  19 127.718  -8.412  -7.469
  147   2HG   PRO  19           HG1      PRO  19 127.900  -9.039  -9.120
  148   1HD   PRO  19           HD2      PRO  19 129.411  -9.973  -7.076
  149   2HD   PRO  19           HD1      PRO  19 130.060  -9.832  -8.725
  150    H    VAL  20           HN       VAL  20 129.902  -4.361  -7.776
  151    HA   VAL  20           HA       VAL  20 130.079  -3.805  -5.026
  152    HB   VAL  20           HB       VAL  20 130.290  -2.049  -6.681
  153   1HG1  VAL  20          HG12      VAL  20 128.535  -3.106  -8.226
  154   2HG1  VAL  20          HG11      VAL  20 127.326  -2.296  -7.232
  155   3HG1  VAL  20          HG13      VAL  20 128.520  -1.348  -8.116
  156   1HG2  VAL  20          HG21      VAL  20 129.308  -1.563  -4.361
  157   2HG2  VAL  20          HG23      VAL  20 129.023  -0.341  -5.601
  158   3HG2  VAL  20          HG22      VAL  20 127.740  -1.468  -5.162
  159    H    GLY  21           HN       GLY  21 127.144  -4.300  -6.977
  160   1HA   GLY  21           HA2      GLY  21 125.217  -3.775  -4.999
  161   2HA   GLY  21           HA1      GLY  21 124.965  -4.893  -6.335
  162    H    SER  22           HN       SER  22 127.586  -6.129  -4.771
  163    HA   SER  22           HA       SER  22 125.943  -8.186  -3.485
  164   1HB   SER  22           HB2      SER  22 128.954  -7.828  -3.542
  165   2HB   SER  22           HB1      SER  22 128.101  -9.261  -2.975
  166    HG   SER  22           HG       SER  22 128.897  -8.977  -5.335
  167    H    LEU  23           HN       LEU  23 127.479  -5.252  -2.521
  168    HA   LEU  23           HA       LEU  23 128.002  -5.885   0.225
  169   1HB   LEU  23           HB2      LEU  23 127.365  -3.262  -1.147
  170   2HB   LEU  23           HB1      LEU  23 127.826  -3.378   0.550
  171    HG   LEU  23           HG       LEU  23 129.499  -4.428  -1.754
  172   1HD1  LEU  23          HD11      LEU  23 129.595  -1.827  -0.212
  173   2HD1  LEU  23          HD13      LEU  23 130.971  -2.438  -1.130
  174   3HD1  LEU  23          HD12      LEU  23 129.462  -2.047  -1.956
  175   1HD2  LEU  23          HD21      LEU  23 129.804  -4.387   1.240
  176   2HD2  LEU  23          HD23      LEU  23 130.292  -5.622   0.080
  177   3HD2  LEU  23          HD22      LEU  23 131.252  -4.160   0.262
  178    H    ALA  24           HN       ALA  24 126.689  -5.933   1.979
  179    HA   ALA  24           HA       ALA  24 123.848  -6.191   1.604
  180   1HB   ALA  24           HB3      ALA  24 125.347  -7.166   3.484
  181   2HB   ALA  24           HB2      ALA  24 125.124  -5.605   4.272
  182   3HB   ALA  24           HB1      ALA  24 123.727  -6.619   3.918
  183    H    GLY  25           HN       GLY  25 122.209  -4.756   1.922
  184   1HA   GLY  25           HA2      GLY  25 121.212  -2.709   2.782
  185   2HA   GLY  25           HA1      GLY  25 122.826  -2.017   2.946
  186    H    ILE  26           HN       ILE  26 123.295  -3.301   0.125
  187    HA   ILE  26           HA       ILE  26 122.303  -0.917  -1.376
  188    HB   ILE  26           HB       ILE  26 124.246  -3.076  -2.264
  189   1HG1  ILE  26          HG12      ILE  26 125.215  -1.977  -0.337
  190   2HG1  ILE  26          HG11      ILE  26 126.000  -1.332  -1.776
  191   1HG2  ILE  26          HG22      ILE  26 123.112  -1.710  -4.037
  192   2HG2  ILE  26          HG21      ILE  26 123.800  -0.263  -3.301
  193   3HG2  ILE  26          HG23      ILE  26 124.860  -1.489  -3.994
  194   1HD1  ILE  26          HD13      ILE  26 124.151   0.520  -1.654
  195   2HD1  ILE  26          HD12      ILE  26 123.969  -0.016   0.015
  196   3HD1  ILE  26          HD11      ILE  26 125.520   0.607  -0.546
  197    H    GLY  27           HN       GLY  27 120.398  -1.234  -2.478
  198   1HA   GLY  27           HA2      GLY  27 119.475  -3.975  -3.027
  199   2HA   GLY  27           HA1      GLY  27 118.551  -2.493  -3.283
  200    H    GLU  28           HN       GLU  28 118.539  -4.353  -5.288
  201    HA   GLU  28           HA       GLU  28 120.584  -4.214  -7.222
  202   1HB   GLU  28           HB2      GLU  28 117.590  -4.546  -7.534
  203   2HB   GLU  28           HB1      GLU  28 118.727  -4.735  -8.869
  204   1HG   GLU  28           HG2      GLU  28 119.892  -6.520  -7.662
  205   2HG   GLU  28           HG1      GLU  28 118.817  -6.308  -6.278
  206    H    VAL  29           HN       VAL  29 117.817  -2.020  -6.719
  207    HA   VAL  29           HA       VAL  29 118.375  -0.426  -9.060
  208    HB   VAL  29           HB       VAL  29 116.877   0.251  -6.510
  209   1HG1  VAL  29          HG12      VAL  29 117.130   1.692  -9.160
  210   2HG1  VAL  29          HG11      VAL  29 115.821   2.007  -8.021
  211   3HG1  VAL  29          HG13      VAL  29 117.491   2.319  -7.552
  212   1HG2  VAL  29          HG23      VAL  29 116.058  -1.664  -8.007
  213   2HG2  VAL  29          HG22      VAL  29 114.902  -0.368  -7.703
  214   3HG2  VAL  29          HG21      VAL  29 115.764  -0.437  -9.240
  215    H    LEU  30           HN       LEU  30 119.260  -0.121  -5.636
  216    HA   LEU  30           HA       LEU  30 120.642   2.384  -5.904
  217   1HB   LEU  30           HB2      LEU  30 121.063   0.156  -3.887
  218   2HB   LEU  30           HB1      LEU  30 121.674   1.802  -3.734
  219    HG   LEU  30           HG       LEU  30 118.743   1.043  -3.932
  220   1HD1  LEU  30          HD11      LEU  30 119.895   0.365  -1.805
  221   2HD1  LEU  30          HD13      LEU  30 120.328   2.056  -1.553
  222   3HD1  LEU  30          HD12      LEU  30 118.632   1.572  -1.563
  223   1HD2  LEU  30          HD22      LEU  30 120.233   3.661  -3.770
  224   2HD2  LEU  30          HD21      LEU  30 118.830   3.237  -4.750
  225   3HD2  LEU  30          HD23      LEU  30 118.641   3.530  -3.024
  226    H    GLY  31           HN       GLY  31 121.680  -0.989  -6.162
  227   1HA   GLY  31           HA2      GLY  31 124.480  -0.510  -6.306
  228   2HA   GLY  31           HA1      GLY  31 123.664  -1.897  -7.029
  229    H    LYS  32           HN       LYS  32 121.975  -0.468  -8.826
  230    HA   LYS  32           HA       LYS  32 123.730  -0.164 -11.051
  231   1HB   LYS  32           HB2      LYS  32 120.872   0.722 -10.610
  232   2HB   LYS  32           HB1      LYS  32 121.705   0.867 -12.160
  233   1HG   LYS  32           HG2      LYS  32 122.069  -1.532 -12.254
  234   2HG   LYS  32           HG1      LYS  32 121.422  -1.732 -10.628
  235   1HD   LYS  32           HD2      LYS  32 119.666  -2.342 -12.152
  236   2HD   LYS  32           HD1      LYS  32 119.238  -0.773 -11.476
  237   1HE   LYS  32           HE2      LYS  32 119.858   0.374 -13.464
  238   2HE   LYS  32           HE1      LYS  32 120.739  -1.020 -14.089
  239   1HZ   LYS  32           HZ1      LYS  32 118.378  -2.114 -13.844
  240   2HZ   LYS  32           HZ3      LYS  32 117.864  -0.508 -14.023
  241   3HZ   LYS  32           HZ2      LYS  32 118.809  -1.236 -15.232
  242    H    LYS  33           HN       LYS  33 122.295   2.297  -8.884
  243    HA   LYS  33           HA       LYS  33 123.177   4.546 -10.435
  244   1HB   LYS  33           HB2      LYS  33 122.639   4.277  -7.464
  245   2HB   LYS  33           HB1      LYS  33 122.925   5.814  -8.279
  246   1HG   LYS  33           HG2      LYS  33 120.985   5.401  -9.746
  247   2HG   LYS  33           HG1      LYS  33 120.693   3.865  -8.929
  248   1HD   LYS  33           HD2      LYS  33 120.372   5.062  -6.791
  249   2HD   LYS  33           HD1      LYS  33 120.656   6.598  -7.611
  250   1HE   LYS  33           HE2      LYS  33 118.493   4.707  -8.542
  251   2HE   LYS  33           HE1      LYS  33 118.199   5.875  -7.255
  252   1HZ   LYS  33           HZ3      LYS  33 119.489   6.901  -9.649
  253   2HZ   LYS  33           HZ2      LYS  33 117.867   6.428  -9.822
  254   3HZ   LYS  33           HZ1      LYS  33 118.294   7.603  -8.672
  255    H    LEU  34           HN       LEU  34 124.727   2.778  -7.744
  256    HA   LEU  34           HA       LEU  34 127.026   4.467  -7.538
  257   1HB   LEU  34           HB2      LEU  34 126.666   1.522  -6.923
  258   2HB   LEU  34           HB1      LEU  34 128.113   2.432  -6.518
  259    HG   LEU  34           HG       LEU  34 125.348   3.247  -5.592
  260   1HD1  LEU  34          HD11      LEU  34 125.973   0.991  -4.738
  261   2HD1  LEU  34          HD13      LEU  34 127.459   1.676  -4.081
  262   3HD1  LEU  34          HD12      LEU  34 125.896   2.195  -3.452
  263   1HD2  LEU  34          HD21      LEU  34 128.179   4.127  -4.970
  264   2HD2  LEU  34          HD23      LEU  34 126.775   5.118  -5.363
  265   3HD2  LEU  34          HD22      LEU  34 126.896   4.353  -3.785
  266    H    GLU  35           HN       GLU  35 126.326   1.659  -9.560
  267    HA   GLU  35           HA       GLU  35 128.941   1.333 -10.659
  268   1HB   GLU  35           HB2      GLU  35 126.223   0.809 -11.903
  269   2HB   GLU  35           HB1      GLU  35 127.752   0.313 -12.631
  270   1HG   GLU  35           HG2      GLU  35 128.267  -1.115 -10.764
  271   2HG   GLU  35           HG1      GLU  35 126.903  -0.496  -9.843
  272    H    GLU  36           HN       GLU  36 126.266   3.437 -11.636
  273    HA   GLU  36           HA       GLU  36 127.588   4.487 -13.981
  274   1HB   GLU  36           HB2      GLU  36 125.317   5.538 -12.270
  275   2HB   GLU  36           HB1      GLU  36 125.867   6.335 -13.744
  276   1HG   GLU  36           HG2      GLU  36 125.419   4.275 -15.029
  277   2HG   GLU  36           HG1      GLU  36 124.865   3.478 -13.557
  278    H    ARG  37           HN       ARG  37 127.895   5.047 -10.606
  279    HA   ARG  37           HA       ARG  37 129.079   7.733 -10.930
  280   1HB   ARG  37           HB2      ARG  37 128.717   5.925  -8.529
  281   2HB   ARG  37           HB1      ARG  37 129.435   7.530  -8.441
  282   1HG   ARG  37           HG2      ARG  37 126.712   7.107  -9.674
  283   2HG   ARG  37           HG1      ARG  37 126.896   7.279  -7.931
  284   1HD   ARG  37           HD2      ARG  37 128.121   9.453  -8.362
  285   2HD   ARG  37           HD1      ARG  37 127.660   9.301 -10.058
  286    HE   ARG  37           HE       ARG  37 125.265   9.029  -8.706
  287   1HH1  ARG  37          HH21      ARG  37 127.859  11.305  -8.749
  288   2HH1  ARG  37          HH22      ARG  37 126.848  12.659  -8.369
  289   1HH2  ARG  37          HH11      ARG  37 123.937  10.782  -8.212
  290   2HH2  ARG  37          HH12      ARG  37 124.627  12.363  -8.062
  291    H    GLY  38           HN       GLY  38 130.219   4.634 -11.420
  292   1HA   GLY  38           HA2      GLY  38 132.541   4.383 -12.169
  293   2HA   GLY  38           HA1      GLY  38 133.038   5.570 -10.971
  294    H    PHE  39           HN       PHE  39 130.822   3.537  -9.487
  295    HA   PHE  39           HA       PHE  39 133.050   1.925  -8.289
  296   1HB   PHE  39           HB2      PHE  39 130.233   2.467  -7.320
  297   2HB   PHE  39           HB1      PHE  39 131.413   1.476  -6.469
  298    HD1  PHE  39           HD2      PHE  39 133.426   2.500  -5.469
  299    HD2  PHE  39           HD1      PHE  39 130.421   4.866  -7.402
  300    HE1  PHE  39           HE2      PHE  39 134.385   4.545  -4.449
  301    HE2  PHE  39           HE1      PHE  39 131.371   6.914  -6.388
  302    HZ   PHE  39           HZ       PHE  39 133.362   6.758  -4.907
  303    H    ASP  40           HN       ASP  40 132.943   0.632 -10.352
  304    HA   ASP  40           HA       ASP  40 130.561  -0.942 -10.874
  305   1HB   ASP  40           HB2      ASP  40 131.910  -2.013 -12.594
  306   2HB   ASP  40           HB1      ASP  40 132.197  -0.273 -12.636
  307    H    LYS  41           HN       LYS  41 133.153  -1.275  -8.640
  308    HA   LYS  41           HA       LYS  41 132.281  -4.081  -8.106
  309   1HB   LYS  41           HB2      LYS  41 135.143  -3.157  -8.460
  310   2HB   LYS  41           HB1      LYS  41 134.694  -4.693  -7.711
  311   1HG   LYS  41           HG2      LYS  41 133.430  -5.308  -9.758
  312   2HG   LYS  41           HG1      LYS  41 133.911  -3.790 -10.501
  313   1HD   LYS  41           HD2      LYS  41 135.483  -5.280 -11.373
  314   2HD   LYS  41           HD1      LYS  41 136.345  -4.587 -10.006
  315   1HE   LYS  41           HE2      LYS  41 136.576  -7.058 -10.088
  316   2HE   LYS  41           HE1      LYS  41 135.750  -6.537  -8.623
  317   1HZ   LYS  41           HZ3      LYS  41 134.409  -7.486 -11.097
  318   2HZ   LYS  41           HZ2      LYS  41 134.639  -8.413  -9.694
  319   3HZ   LYS  41           HZ1      LYS  41 133.639  -7.045  -9.654
  320    H    ALA  42           HN       ALA  42 132.814  -4.808  -5.941
  321    HA   ALA  42           HA       ALA  42 132.103  -2.874  -3.975
  322   1HB   ALA  42           HB3      ALA  42 131.566  -5.243  -3.756
  323   2HB   ALA  42           HB2      ALA  42 133.280  -5.635  -3.614
  324   3HB   ALA  42           HB1      ALA  42 132.483  -4.691  -2.354
  325    H    TYR  43           HN       TYR  43 135.340  -4.342  -4.587
  326    HA   TYR  43           HA       TYR  43 136.552  -3.239  -2.288
  327   1HB   TYR  43           HB2      TYR  43 138.715  -3.508  -3.349
  328   2HB   TYR  43           HB1      TYR  43 137.699  -4.904  -3.676
  329    HD1  TYR  43           HD1      TYR  43 138.833  -1.648  -5.159
  330    HD2  TYR  43           HD2      TYR  43 137.332  -5.609  -5.884
  331    HE1  TYR  43           HE1      TYR  43 139.242  -1.355  -7.585
  332    HE2  TYR  43           HE2      TYR  43 137.739  -5.317  -8.307
  333    HH   TYR  43           HH       TYR  43 139.655  -3.385  -9.631
  334    H    VAL  44           HN       VAL  44 135.454  -1.516  -5.067
  335    HA   VAL  44           HA       VAL  44 137.271   0.759  -4.630
  336    HB   VAL  44           HB       VAL  44 134.685   0.681  -6.222
  337   1HG1  VAL  44          HG13      VAL  44 135.786   2.924  -5.569
  338   2HG1  VAL  44          HG12      VAL  44 137.104   2.451  -6.638
  339   3HG1  VAL  44          HG11      VAL  44 135.475   2.657  -7.282
  340   1HG2  VAL  44          HG23      VAL  44 136.275  -1.053  -6.988
  341   2HG2  VAL  44          HG22      VAL  44 136.119   0.240  -8.176
  342   3HG2  VAL  44          HG21      VAL  44 137.536   0.171  -7.128
  343    H    VAL  45           HN       VAL  45 134.068  -0.264  -3.733
  344    HA   VAL  45           HA       VAL  45 133.272   2.276  -2.523
  345    HB   VAL  45           HB       VAL  45 132.122  -0.507  -2.126
  346   1HG1  VAL  45          HG11      VAL  45 131.020   2.257  -1.538
  347   2HG1  VAL  45          HG13      VAL  45 130.089   0.762  -1.430
  348   3HG1  VAL  45          HG12      VAL  45 131.456   1.031  -0.348
  349   1HG2  VAL  45          HG22      VAL  45 131.543   1.703  -4.108
  350   2HG2  VAL  45          HG21      VAL  45 131.934   0.017  -4.444
  351   3HG2  VAL  45          HG23      VAL  45 130.370   0.437  -3.745
  352    H    LEU  46           HN       LEU  46 134.592  -0.818  -1.356
  353    HA   LEU  46           HA       LEU  46 134.499  -0.200   1.431
  354   1HB   LEU  46           HB2      LEU  46 135.043  -2.471   0.606
  355   2HB   LEU  46           HB1      LEU  46 136.545  -1.862  -0.085
  356    HG   LEU  46           HG       LEU  46 137.282  -1.181   2.200
  357   1HD1  LEU  46          HD12      LEU  46 134.588  -2.299   2.915
  358   2HD1  LEU  46          HD11      LEU  46 135.903  -2.389   4.084
  359   3HD1  LEU  46          HD13      LEU  46 135.367  -0.823   3.484
  360   1HD2  LEU  46          HD22      LEU  46 137.598  -3.564   1.106
  361   2HD2  LEU  46          HD21      LEU  46 138.079  -3.269   2.771
  362   3HD2  LEU  46          HD23      LEU  46 136.552  -4.076   2.433
  363    H    GLY  47           HN       GLY  47 136.791   0.546  -1.127
  364   1HA   GLY  47           HA2      GLY  47 138.896   1.635   0.430
  365   2HA   GLY  47           HA1      GLY  47 138.524   2.138  -1.222
  366    H    GLN  48           HN       GLN  48 135.913   3.162  -0.795
  367    HA   GLN  48           HA       GLN  48 136.492   5.812   0.087
  368   1HB   GLN  48           HB2      GLN  48 134.588   5.191  -1.407
  369   2HB   GLN  48           HB1      GLN  48 133.787   4.435  -0.031
  370   1HG   GLN  48           HG2      GLN  48 132.889   6.676  -0.321
  371   2HG   GLN  48           HG1      GLN  48 133.853   6.647   1.153
  372   1HE2  GLN  48          HE22      GLN  48 135.516   9.503  -0.114
  373   2HE2  GLN  48          HE21      GLN  48 134.530   8.866   1.112
  374    H    PHE  49           HN       PHE  49 134.946   3.072   1.751
  375    HA   PHE  49           HA       PHE  49 134.295   4.412   4.180
  376   1HB   PHE  49           HB2      PHE  49 133.501   2.135   3.530
  377   2HB   PHE  49           HB1      PHE  49 135.132   1.519   3.778
  378    HD1  PHE  49           HD1      PHE  49 132.635   3.646   5.620
  379    HD2  PHE  49           HD2      PHE  49 135.529   0.474   5.833
  380    HE1  PHE  49           HE1      PHE  49 132.121   3.336   8.022
  381    HE2  PHE  49           HE2      PHE  49 135.011   0.168   8.239
  382    HZ   PHE  49           HZ       PHE  49 133.308   1.601   9.331
  383    H    LEU  50           HN       LEU  50 137.236   2.788   3.105
  384    HA   LEU  50           HA       LEU  50 138.652   3.114   5.617
  385   1HB   LEU  50           HB2      LEU  50 139.760   2.773   2.809
  386   2HB   LEU  50           HB1      LEU  50 140.674   2.563   4.303
  387    HG   LEU  50           HG       LEU  50 138.235   0.941   3.501
  388   1HD1  LEU  50          HD12      LEU  50 140.509   0.607   2.258
  389   2HD1  LEU  50          HD11      LEU  50 141.048  -0.120   3.770
  390   3HD1  LEU  50          HD13      LEU  50 139.681  -0.813   2.895
  391   1HD2  LEU  50          HD22      LEU  50 139.958   1.037   5.971
  392   2HD2  LEU  50          HD21      LEU  50 138.209   0.857   5.836
  393   3HD2  LEU  50          HD23      LEU  50 139.263  -0.506   5.471
  394    H    VAL  51           HN       VAL  51 138.433   5.046   2.660
  395    HA   VAL  51           HA       VAL  51 140.402   6.994   3.399
  396    HB   VAL  51           HB       VAL  51 138.039   7.107   1.509
  397   1HG1  VAL  51          HG12      VAL  51 140.197   9.144   2.098
  398   2HG1  VAL  51          HG11      VAL  51 139.326   9.115   0.564
  399   3HG1  VAL  51          HG13      VAL  51 138.450   9.389   2.070
  400   1HG2  VAL  51          HG22      VAL  51 139.948   5.550   1.011
  401   2HG2  VAL  51          HG21      VAL  51 139.736   6.813  -0.201
  402   3HG2  VAL  51          HG23      VAL  51 141.024   6.947   0.997
  403    H    LEU  52           HN       LEU  52 137.096   6.552   4.390
  404    HA   LEU  52           HA       LEU  52 136.845   9.340   5.356
  405   1HB   LEU  52           HB2      LEU  52 134.988   6.956   5.504
  406   2HB   LEU  52           HB1      LEU  52 134.589   8.559   6.118
  407    HG   LEU  52           HG       LEU  52 135.415   8.016   3.251
  408   1HD1  LEU  52          HD13      LEU  52 132.661   8.282   4.479
  409   2HD1  LEU  52          HD12      LEU  52 132.982   8.285   2.745
  410   3HD1  LEU  52          HD11      LEU  52 133.330   6.846   3.705
  411   1HD2  LEU  52          HD23      LEU  52 134.483  10.439   4.783
  412   2HD2  LEU  52          HD22      LEU  52 135.752  10.305   3.567
  413   3HD2  LEU  52          HD21      LEU  52 134.063  10.295   3.076
  414    H    LYS  53           HN       LYS  53 138.671   7.024   6.565
  415    HA   LYS  53           HA       LYS  53 139.305   6.359   8.733
  416   1HB   LYS  53           HB2      LYS  53 138.216   9.129   9.329
  417   2HB   LYS  53           HB1      LYS  53 139.302   8.207  10.370
  418   1HG   LYS  53           HG2      LYS  53 141.008   8.194   8.586
  419   2HG   LYS  53           HG1      LYS  53 139.924   9.119   7.545
  420   1HD   LYS  53           HD2      LYS  53 139.902  10.956   9.196
  421   2HD   LYS  53           HD1      LYS  53 140.995  10.037  10.230
  422   1HE   LYS  53           HE2      LYS  53 142.369  11.560   8.992
  423   2HE   LYS  53           HE1      LYS  53 142.609   9.972   8.261
  424   1HZ   LYS  53           HZ2      LYS  53 140.414  11.515   7.174
  425   2HZ   LYS  53           HZ1      LYS  53 141.955  12.166   6.887
  426   3HZ   LYS  53           HZ3      LYS  53 141.595  10.590   6.376
  427    H    LYS  54           HN       LYS  54 136.687   5.461   8.006
  428    HA   LYS  54           HA       LYS  54 134.784   4.494   8.982
  429   1HB   LYS  54           HB2      LYS  54 136.078   5.093  11.649
  430   2HB   LYS  54           HB1      LYS  54 134.975   3.781  11.247
  431   1HG   LYS  54           HG2      LYS  54 137.784   4.097  10.137
  432   2HG   LYS  54           HG1      LYS  54 137.319   2.989  11.424
  433   1HD   LYS  54           HD2      LYS  54 135.682   1.936   9.816
  434   2HD   LYS  54           HD1      LYS  54 136.392   2.929   8.542
  435   1HE   LYS  54           HE2      LYS  54 138.630   1.960   9.099
  436   2HE   LYS  54           HE1      LYS  54 137.831   0.873  10.236
  437   1HZ   LYS  54           HZ3      LYS  54 136.771   0.988   7.520
  438   2HZ   LYS  54           HZ2      LYS  54 138.268   0.211   7.732
  439   3HZ   LYS  54           HZ1      LYS  54 136.898  -0.330   8.580
  440    H    ASP  55           HN       ASP  55 135.091   7.618   8.796
  441    HA   ASP  55           HA       ASP  55 133.511   8.643  10.990
  442   1HB   ASP  55           HB2      ASP  55 134.108   9.650   8.202
  443   2HB   ASP  55           HB1      ASP  55 133.000  10.516   9.267
  444    H    GLU  56           HN       GLU  56 131.549   7.706  11.380
  445    HA   GLU  56           HA       GLU  56 129.919   6.396   9.457
  446   1HB   GLU  56           HB2      GLU  56 129.779   5.975  11.874
  447   2HB   GLU  56           HB1      GLU  56 129.138   7.598  12.123
  448   1HG   GLU  56           HG2      GLU  56 127.158   7.079  10.809
  449   2HG   GLU  56           HG1      GLU  56 127.819   5.501  10.375
  450    H    ASP  57           HN       ASP  57 129.709   9.731  10.704
  451    HA   ASP  57           HA       ASP  57 127.210  10.307   9.381
  452   1HB   ASP  57           HB2      ASP  57 129.410  12.090  10.454
  453   2HB   ASP  57           HB1      ASP  57 127.897  12.713   9.795
  454    H    LEU  58           HN       LEU  58 130.581  10.753   8.493
  455    HA   LEU  58           HA       LEU  58 129.957  12.170   6.033
  456   1HB   LEU  58           HB2      LEU  58 132.441  10.675   6.909
  457   2HB   LEU  58           HB1      LEU  58 132.329  11.543   5.379
  458    HG   LEU  58           HG       LEU  58 131.856  12.805   8.101
  459   1HD1  LEU  58          HD13      LEU  58 134.221  11.997   7.661
  460   2HD1  LEU  58          HD12      LEU  58 134.272  13.119   6.302
  461   3HD1  LEU  58          HD11      LEU  58 134.067  13.731   7.943
  462   1HD2  LEU  58          HD23      LEU  58 131.796  13.806   5.261
  463   2HD2  LEU  58          HD22      LEU  58 130.761  14.237   6.622
  464   3HD2  LEU  58          HD21      LEU  58 132.390  14.892   6.517
  465    H    PHE  59           HN       PHE  59 130.501   8.772   6.854
  466    HA   PHE  59           HA       PHE  59 130.421   7.783   4.162
  467   1HB   PHE  59           HB2      PHE  59 131.231   6.373   5.979
  468   2HB   PHE  59           HB1      PHE  59 129.661   6.452   6.780
  469    HD1  PHE  59           HD1      PHE  59 131.303   5.397   3.586
  470    HD2  PHE  59           HD2      PHE  59 127.980   4.877   6.261
  471    HE1  PHE  59           HE1      PHE  59 130.532   3.452   2.252
  472    HE2  PHE  59           HE2      PHE  59 127.210   2.933   4.927
  473    HZ   PHE  59           HZ       PHE  59 128.486   2.221   2.922
  474    H    ARG  60           HN       ARG  60 127.853   8.057   6.635
  475    HA   ARG  60           HA       ARG  60 125.764   7.044   4.997
  476   1HB   ARG  60           HB2      ARG  60 125.702   8.987   7.316
  477   2HB   ARG  60           HB1      ARG  60 124.251   8.312   6.571
  478   1HG   ARG  60           HG2      ARG  60 125.103   6.025   7.054
  479   2HG   ARG  60           HG1      ARG  60 126.490   6.731   7.869
  480   1HD   ARG  60           HD2      ARG  60 123.586   7.107   8.646
  481   2HD   ARG  60           HD1      ARG  60 124.780   6.143   9.517
  482    HE   ARG  60           HE       ARG  60 125.933   8.647   9.430
  483   1HH1  ARG  60          HH21      ARG  60 122.885   7.341  10.366
  484   2HH1  ARG  60          HH22      ARG  60 122.587   8.546  11.574
  485   1HH2  ARG  60          HH11      ARG  60 125.561  10.233  11.000
  486   2HH2  ARG  60          HH12      ARG  60 124.103  10.182  11.933
  487    H    GLU  61           HN       GLU  61 126.811  10.439   5.507
  488    HA   GLU  61           HA       GLU  61 124.788  11.595   3.848
  489   1HB   GLU  61           HB2      GLU  61 126.182  12.918   5.407
  490   2HB   GLU  61           HB1      GLU  61 127.604  12.578   4.423
  491   1HG   GLU  61           HG2      GLU  61 126.556  13.730   2.504
  492   2HG   GLU  61           HG1      GLU  61 125.132  14.071   3.490
  493    H    TRP  62           HN       TRP  62 127.984  10.238   3.154
  494    HA   TRP  62           HA       TRP  62 128.150  11.087   0.433
  495   1HB   TRP  62           HB2      TRP  62 130.125  10.252   1.511
  496   2HB   TRP  62           HB1      TRP  62 129.334   8.729   1.912
  497    HD1  TRP  62           HD1      TRP  62 130.758  10.664  -1.083
  498    HE1  TRP  62           HE1      TRP  62 131.216   8.991  -2.993
  499    HE3  TRP  62           HE3      TRP  62 128.702   6.437   0.929
  500    HZ2  TRP  62           HZ2      TRP  62 130.767   6.223  -3.588
  501    HZ3  TRP  62           HZ3      TRP  62 128.738   4.303  -0.328
  502    HH2  TRP  62           HH2      TRP  62 129.765   4.191  -2.581
  503    H    LEU  63           HN       LEU  63 126.896   8.064   1.847
  504    HA   LEU  63           HA       LEU  63 126.237   6.889  -0.686
  505   1HB   LEU  63           HB2      LEU  63 126.566   5.561   1.353
  506   2HB   LEU  63           HB1      LEU  63 125.157   6.321   2.086
  507    HG   LEU  63           HG       LEU  63 123.726   5.370   0.310
  508   1HD1  LEU  63          HD12      LEU  63 126.384   4.382  -0.707
  509   2HD1  LEU  63          HD11      LEU  63 124.918   3.458  -1.041
  510   3HD1  LEU  63          HD13      LEU  63 125.056   5.121  -1.604
  511   1HD2  LEU  63          HD23      LEU  63 125.504   3.364   1.725
  512   2HD2  LEU  63          HD22      LEU  63 124.051   4.113   2.387
  513   3HD2  LEU  63          HD21      LEU  63 123.927   2.998   1.026
  514    H    LYS  64           HN       LYS  64 124.215   8.547   1.736
  515    HA   LYS  64           HA       LYS  64 121.765   8.281   0.299
  516   1HB   LYS  64           HB2      LYS  64 121.898   8.959   2.687
  517   2HB   LYS  64           HB1      LYS  64 122.549  10.520   2.184
  518   1HG   LYS  64           HG2      LYS  64 120.498  10.966   0.885
  519   2HG   LYS  64           HG1      LYS  64 119.846   9.403   1.375
  520   1HD   LYS  64           HD2      LYS  64 119.921  10.088   3.728
  521   2HD   LYS  64           HD1      LYS  64 120.611  11.644   3.265
  522   1HE   LYS  64           HE2      LYS  64 117.965  10.673   2.172
  523   2HE   LYS  64           HE1      LYS  64 118.078  11.603   3.666
  524   1HZ   LYS  64           HZ2      LYS  64 119.642  12.942   1.842
  525   2HZ   LYS  64           HZ1      LYS  64 118.246  12.504   0.978
  526   3HZ   LYS  64           HZ3      LYS  64 118.110  13.409   2.406
  527    H    ASP  65           HN       ASP  65 124.072  11.000   0.353
  528    HA   ASP  65           HA       ASP  65 122.601  12.531  -1.597
  529   1HB   ASP  65           HB2      ASP  65 125.472  12.670  -0.647
  530   2HB   ASP  65           HB1      ASP  65 124.776  13.817  -1.792
  531    H    THR  66           HN       THR  66 124.978   9.969  -1.832
  532    HA   THR  66           HA       THR  66 125.619  10.534  -4.615
  533    HB   THR  66           HB       THR  66 126.186   8.136  -2.854
  534    HG1  THR  66           HG1      THR  66 128.192   9.070  -2.717
  535   1HG2  THR  66          HG23      THR  66 127.088   8.807  -5.666
  536   2HG2  THR  66          HG22      THR  66 127.880   7.604  -4.649
  537   3HG2  THR  66          HG21      THR  66 126.204   7.373  -5.144
  538    H    CYS  67           HN       CYS  67 123.350   8.337  -2.940
  539    HA   CYS  67           HA       CYS  67 122.272   7.605  -5.655
  540   1HB   CYS  67           HB2      CYS  67 121.868   5.352  -4.846
  541   2HB   CYS  67           HB1      CYS  67 123.571   5.748  -4.620
  542    HG   CYS  67           HG       CYS  67 123.020   4.963  -2.294
  543    H    GLY  68           HN       GLY  68 121.546   8.213  -2.243
  544   1HA   GLY  68           HA2      GLY  68 119.461   9.400  -1.687
  545   2HA   GLY  68           HA1      GLY  68 118.659   8.529  -2.993
  546    H    ALA  69           HN       ALA  69 120.875   6.652  -1.140
  547    HA   ALA  69           HA       ALA  69 119.015   4.700  -0.370
  548   1HB   ALA  69           HB2      ALA  69 121.481   4.403  -0.255
  549   2HB   ALA  69           HB1      ALA  69 121.531   5.493   1.131
  550   3HB   ALA  69           HB3      ALA  69 120.693   3.945   1.256
  551    H    ASN  70           HN       ASN  70 117.947   4.273   1.673
  552    HA   ASN  70           HA       ASN  70 117.137   6.761   3.057
  553   1HB   ASN  70           HB2      ASN  70 116.085   3.923   3.096
  554   2HB   ASN  70           HB1      ASN  70 115.452   5.204   4.132
  555   1HD2  ASN  70          HD22      ASN  70 113.510   5.085   0.884
  556   2HD2  ASN  70          HD21      ASN  70 113.882   3.904   2.046
  557    H    ALA  71           HN       ALA  71 116.769   6.471   5.501
  558    HA   ALA  71           HA       ALA  71 119.276   6.138   6.780
  559   1HB   ALA  71           HB1      ALA  71 117.257   7.447   7.615
  560   2HB   ALA  71           HB3      ALA  71 116.600   5.906   8.165
  561   3HB   ALA  71           HB2      ALA  71 118.117   6.506   8.833
  562    H    LYS  72           HN       LYS  72 116.596   3.810   6.387
  563    HA   LYS  72           HA       LYS  72 117.724   1.903   8.242
  564   1HB   LYS  72           HB2      LYS  72 115.738   1.610   5.972
  565   2HB   LYS  72           HB1      LYS  72 116.186   0.283   7.044
  566   1HG   LYS  72           HG2      LYS  72 115.404   1.531   8.991
  567   2HG   LYS  72           HG1      LYS  72 115.072   2.941   7.988
  568   1HD   LYS  72           HD2      LYS  72 112.949   1.963   8.180
  569   2HD   LYS  72           HD1      LYS  72 113.517   1.315   6.643
  570   1HE   LYS  72           HE2      LYS  72 112.537  -0.466   8.038
  571   2HE   LYS  72           HE1      LYS  72 114.258  -0.750   7.792
  572   1HZ   LYS  72           HZ1      LYS  72 113.171   0.664  10.158
  573   2HZ   LYS  72           HZ3      LYS  72 113.450  -1.009  10.128
  574   3HZ   LYS  72           HZ2      LYS  72 114.748   0.070   9.937
  575    H    GLN  73           HN       GLN  73 117.951   2.308   4.721
  576    HA   GLN  73           HA       GLN  73 119.457  -0.083   4.255
  577   1HB   GLN  73           HB2      GLN  73 119.213   2.499   2.692
  578   2HB   GLN  73           HB1      GLN  73 120.108   1.095   2.107
  579   1HG   GLN  73           HG2      GLN  73 118.123  -0.276   2.139
  580   2HG   GLN  73           HG1      GLN  73 117.202   0.988   2.955
  581   1HE2  GLN  73          HE22      GLN  73 116.717   1.038  -0.851
  582   2HE2  GLN  73          HE21      GLN  73 116.728  -0.264   0.238
  583    H    SER  74           HN       SER  74 120.441   3.267   4.941
  584    HA   SER  74           HA       SER  74 123.221   2.863   4.517
  585   1HB   SER  74           HB2      SER  74 121.790   4.813   6.337
  586   2HB   SER  74           HB1      SER  74 123.484   4.909   5.879
  587    HG   SER  74           HG       SER  74 122.605   6.081   4.328
  588    H    ARG  75           HN       ARG  75 121.203   2.423   7.447
  589    HA   ARG  75           HA       ARG  75 123.351   2.011   9.269
  590   1HB   ARG  75           HB2      ARG  75 120.542   0.873   9.218
  591   2HB   ARG  75           HB1      ARG  75 121.658   0.628  10.561
  592   1HG   ARG  75           HG2      ARG  75 121.798   3.033  10.937
  593   2HG   ARG  75           HG1      ARG  75 120.786   3.342   9.526
  594   1HD   ARG  75           HD2      ARG  75 119.450   3.434  11.607
  595   2HD   ARG  75           HD1      ARG  75 118.928   2.106  10.578
  596    HE   ARG  75           HE       ARG  75 120.873   1.027  12.298
  597   1HH1  ARG  75          HH21      ARG  75 117.821   2.621  12.504
  598   2HH1  ARG  75          HH22      ARG  75 117.396   1.892  14.017
  599   1HH2  ARG  75          HH11      ARG  75 120.334   0.070  14.271
  600   2HH2  ARG  75          HH12      ARG  75 118.817   0.450  15.018
  601    H    ASP  76           HN       ASP  76 121.706  -0.260   7.067
  602    HA   ASP  76           HA       ASP  76 123.018  -2.597   8.063
  603   1HB   ASP  76           HB2      ASP  76 121.768  -1.952   5.385
  604   2HB   ASP  76           HB1      ASP  76 122.381  -3.552   5.805
  605    H    CYS  77           HN       CYS  77 123.938  -0.287   5.493
  606    HA   CYS  77           HA       CYS  77 126.156  -1.843   4.551
  607   1HB   CYS  77           HB2      CYS  77 125.520   1.109   4.401
  608   2HB   CYS  77           HB1      CYS  77 126.937   0.392   3.635
  609    HG   CYS  77           HG       CYS  77 125.434  -0.223   1.772
  610    H    PHE  78           HN       PHE  78 125.902   0.706   7.072
  611    HA   PHE  78           HA       PHE  78 128.692   1.000   7.478
  612   1HB   PHE  78           HB2      PHE  78 127.031   2.494   8.524
  613   2HB   PHE  78           HB1      PHE  78 126.492   1.169   9.557
  614    HD1  PHE  78           HD1      PHE  78 129.221   3.535   8.843
  615    HD2  PHE  78           HD2      PHE  78 127.894   0.333  11.381
  616    HE1  PHE  78           HE1      PHE  78 131.040   4.053  10.447
  617    HE2  PHE  78           HE2      PHE  78 129.714   0.851  12.985
  618    HZ   PHE  78           HZ       PHE  78 131.287   2.709  12.517
  619    H    GLY  79           HN       GLY  79 126.474  -1.020   9.445
  620   1HA   GLY  79           HA2      GLY  79 128.533  -2.371  10.857
  621   2HA   GLY  79           HA1      GLY  79 126.902  -2.998  10.627
  622    H    CYS  80           HN       CYS  80 127.142  -2.967   7.689
  623    HA   CYS  80           HA       CYS  80 128.266  -5.620   7.368
  624   1HB   CYS  80           HB2      CYS  80 126.376  -4.704   6.005
  625   2HB   CYS  80           HB1      CYS  80 127.523  -3.627   5.212
  626    HG   CYS  80           HG       CYS  80 128.189  -6.648   5.085
  627    H    LEU  81           HN       LEU  81 129.331  -2.378   6.172
  628    HA   LEU  81           HA       LEU  81 131.801  -3.457   5.106
  629   1HB   LEU  81           HB2      LEU  81 131.059  -0.618   5.877
  630   2HB   LEU  81           HB1      LEU  81 132.461  -1.079   4.915
  631    HG   LEU  81           HG       LEU  81 129.577  -1.628   4.145
  632   1HD1  LEU  81          HD11      LEU  81 131.549   0.461   3.168
  633   2HD1  LEU  81          HD13      LEU  81 129.975   0.143   2.441
  634   3HD1  LEU  81          HD12      LEU  81 130.076   0.769   4.087
  635   1HD2  LEU  81          HD21      LEU  81 132.253  -2.226   2.885
  636   2HD2  LEU  81          HD23      LEU  81 130.830  -3.257   3.013
  637   3HD2  LEU  81          HD22      LEU  81 130.855  -1.936   1.852
  638    H    ARG  82           HN       ARG  82 130.878  -1.812   8.117
  639    HA   ARG  82           HA       ARG  82 133.488  -1.551   9.195
  640   1HB   ARG  82           HB2      ARG  82 131.610  -0.347  10.150
  641   2HB   ARG  82           HB1      ARG  82 130.812  -1.856  10.580
  642   1HG   ARG  82           HG2      ARG  82 131.932  -0.792  12.529
  643   2HG   ARG  82           HG1      ARG  82 132.592  -2.384  12.179
  644   1HD   ARG  82           HD2      ARG  82 134.559  -1.472  11.207
  645   2HD   ARG  82           HD1      ARG  82 133.838   0.131  11.060
  646    HE   ARG  82           HE       ARG  82 133.827  -0.380  13.789
  647   1HH1  ARG  82          HH21      ARG  82 136.129  -0.390  11.225
  648   2HH1  ARG  82          HH22      ARG  82 137.465   0.038  12.242
  649   1HH2  ARG  82          HH11      ARG  82 135.558   0.177  15.135
  650   2HH2  ARG  82          HH12      ARG  82 137.141   0.357  14.455
  651    H    GLU  83           HN       GLU  83 131.161  -4.218   9.433
  652    HA   GLU  83           HA       GLU  83 132.780  -5.759  11.255
  653   1HB   GLU  83           HB2      GLU  83 130.488  -6.505   9.432
  654   2HB   GLU  83           HB1      GLU  83 131.284  -7.669  10.492
  655   1HG   GLU  83           HG2      GLU  83 130.124  -5.054  11.490
  656   2HG   GLU  83           HG1      GLU  83 129.219  -6.569  11.483
  657    H    TRP  84           HN       TRP  84 132.573  -5.656   7.687
  658    HA   TRP  84           HA       TRP  84 134.177  -7.970   7.205
  659   1HB   TRP  84           HB2      TRP  84 132.879  -6.645   5.458
  660   2HB   TRP  84           HB1      TRP  84 134.166  -5.441   5.527
  661    HD1  TRP  84           HD1      TRP  84 133.447  -9.018   4.428
  662    HE1  TRP  84           HE1      TRP  84 135.389  -9.846   2.935
  663    HE3  TRP  84           HE3      TRP  84 136.725  -5.126   4.958
  664    HZ2  TRP  84           HZ2      TRP  84 137.968  -8.994   2.100
  665    HZ3  TRP  84           HZ3      TRP  84 138.917  -5.169   3.798
  666    HH2  TRP  84           HH2      TRP  84 139.538  -7.095   2.365
  667    H    CYS  85           HN       CYS  85 135.020  -4.542   7.632
  668    HA   CYS  85           HA       CYS  85 137.824  -4.790   7.275
  669   1HB   CYS  85           HB2      CYS  85 136.163  -2.873   8.927
  670   2HB   CYS  85           HB1      CYS  85 137.901  -2.690   8.705
  671    HG   CYS  85           HG       CYS  85 136.161  -1.510   6.816
  672    H    ASP  86           HN       ASP  86 135.828  -5.177  10.188
  673    HA   ASP  86           HA       ASP  86 137.952  -5.427  12.059
  674   1HB   ASP  86           HB2      ASP  86 135.173  -6.630  12.017
  675   2HB   ASP  86           HB1      ASP  86 136.265  -6.763  13.397
  676    H    ALA  87           HN       ALA  87 136.600  -7.741   9.772
  677    HA   ALA  87           HA       ALA  87 138.164  -9.962  10.960
  678   1HB   ALA  87           HB1      ALA  87 135.880 -10.400  10.123
  679   2HB   ALA  87           HB3      ALA  87 136.381  -9.898   8.507
  680   3HB   ALA  87           HB2      ALA  87 137.081 -11.342   9.238
  681    H    PHE  88           HN       PHE  88 138.211  -7.871   8.107
  682    HA   PHE  88           HA       PHE  88 140.669  -9.287   7.133
  683   1HB   PHE  88           HB2      PHE  88 138.679  -7.523   5.706
  684   2HB   PHE  88           HB1      PHE  88 140.142  -8.173   4.964
  685    HD1  PHE  88           HD2      PHE  88 140.451 -10.691   4.860
  686    HD2  PHE  88           HD1      PHE  88 136.721  -8.859   5.943
  687    HE1  PHE  88           HE2      PHE  88 139.263 -12.814   4.374
  688    HE2  PHE  88           HE1      PHE  88 135.533 -10.979   5.457
  689    HZ   PHE  88           HZ       PHE  88 136.805 -12.954   4.666
  690    H    LEU  89           HN       LEU  89 139.976  -6.599   8.935
  691    HA   LEU  89           HA       LEU  89 142.465  -5.228   7.990
  692   1HB   LEU  89           HB2      LEU  89 140.256  -4.153   7.114
  693   2HB   LEU  89           HB1      LEU  89 140.005  -3.656   8.784
  694    HG   LEU  89           HG       LEU  89 142.474  -2.739   8.586
  695   1HD1  LEU  89          HD12      LEU  89 142.538  -3.817   6.170
  696   2HD1  LEU  89          HD11      LEU  89 141.712  -2.335   5.700
  697   3HD1  LEU  89          HD13      LEU  89 143.301  -2.256   6.460
  698   1HD2  LEU  89          HD22      LEU  89 139.956  -1.500   7.475
  699   2HD2  LEU  89          HD21      LEU  89 140.763  -1.174   9.008
  700   3HD2  LEU  89          HD23      LEU  89 141.470  -0.595   7.498
  701   1H    MET   1           HT1      MET   1 168.874  -7.761  -6.027
  702   2H    MET   1           HT3      MET   1 168.393  -6.732  -7.286
  703   3H    MET   1           HT2      MET   1 170.022  -6.779  -6.806
  704    HA   MET   1           HA       MET   1 169.596  -5.696  -4.788
  705   1HB   MET   1           HB2      MET   1 167.946  -4.528  -7.047
  706   2HB   MET   1           HB1      MET   1 168.289  -3.661  -5.550
  707   1HG   MET   1           HG2      MET   1 170.692  -3.826  -5.961
  708   2HG   MET   1           HG1      MET   1 170.403  -4.787  -7.411
  709   1HE   MET   1           HE1      MET   1 172.155  -2.339  -7.182
  710   2HE   MET   1           HE3      MET   1 171.924  -2.936  -8.831
  711   3HE   MET   1           HE2      MET   1 171.736  -1.221  -8.477
  712    H    THR   2           HN       THR   2 168.456  -6.868  -3.215
  713    HA   THR   2           HA       THR   2 165.551  -7.251  -3.475
  714    HB   THR   2           HB       THR   2 165.753  -8.368  -1.278
  715    HG1  THR   2           HG1      THR   2 167.355  -7.163  -0.336
  716   1HG2  THR   2          HG22      THR   2 166.280  -9.556  -3.430
  717   2HG2  THR   2          HG21      THR   2 167.984  -9.199  -3.146
  718   3HG2  THR   2          HG23      THR   2 167.101 -10.231  -2.021
  719    H    THR   3           HN       THR   3 164.075  -6.535  -1.749
  720    HA   THR   3           HA       THR   3 164.539  -3.720  -1.066
  721    HB   THR   3           HB       THR   3 162.220  -3.805  -0.216
  722    HG1  THR   3           HG1      THR   3 162.157  -6.493  -1.052
  723   1HG2  THR   3          HG23      THR   3 162.649  -3.488  -2.641
  724   2HG2  THR   3          HG22      THR   3 162.537  -5.233  -2.871
  725   3HG2  THR   3          HG21      THR   3 161.123  -4.319  -2.341
  726    H    SER   4           HN       SER   4 163.932  -3.039   1.262
  727    HA   SER   4           HA       SER   4 165.739  -4.359   3.085
  728   1HB   SER   4           HB2      SER   4 164.921  -2.730   4.735
  729   2HB   SER   4           HB1      SER   4 165.263  -1.937   3.200
  730    HG   SER   4           HG       SER   4 162.888  -2.492   2.826
  731    H    GLN   5           HN       GLN   5 165.027  -5.086   5.275
  732    HA   GLN   5           HA       GLN   5 163.284  -7.322   5.115
  733   1HB   GLN   5           HB2      GLN   5 164.364  -5.777   7.487
  734   2HB   GLN   5           HB1      GLN   5 163.453  -7.278   7.647
  735   1HG   GLN   5           HG2      GLN   5 165.110  -8.439   6.233
  736   2HG   GLN   5           HG1      GLN   5 166.026  -6.939   6.074
  737   1HE2  GLN   5          HE22      GLN   5 166.229  -7.342   9.959
  738   2HE2  GLN   5          HE21      GLN   5 165.063  -6.476   9.080
  739    H    LYS   6           HN       LYS   6 162.539  -3.970   5.658
  740    HA   LYS   6           HA       LYS   6 160.143  -4.259   7.185
  741   1HB   LYS   6           HB2      LYS   6 161.027  -2.153   5.193
  742   2HB   LYS   6           HB1      LYS   6 159.591  -2.004   6.206
  743   1HG   LYS   6           HG2      LYS   6 160.989  -2.223   8.228
  744   2HG   LYS   6           HG1      LYS   6 162.427  -2.368   7.217
  745   1HD   LYS   6           HD2      LYS   6 162.002  -0.124   6.283
  746   2HD   LYS   6           HD1      LYS   6 160.566   0.026   7.296
  747   1HE   LYS   6           HE2      LYS   6 161.925  -0.124   9.317
  748   2HE   LYS   6           HE1      LYS   6 163.375  -0.402   8.352
  749   1HZ   LYS   6           HZ1      LYS   6 163.029   1.781   7.325
  750   2HZ   LYS   6           HZ3      LYS   6 161.696   2.047   8.340
  751   3HZ   LYS   6           HZ2      LYS   6 163.251   1.896   9.005
  752    H    HIS   7           HN       HIS   7 160.788  -4.370   3.696
  753    HA   HIS   7           HA       HIS   7 158.096  -4.296   2.801
  754   1HB   HIS   7           HB2      HIS   7 159.948  -4.079   1.242
  755   2HB   HIS   7           HB1      HIS   7 160.520  -5.697   1.637
  756    HD2  HIS   7           HD2      HIS   7 159.041  -7.814   0.439
  757    HE1  HIS   7           HE1      HIS   7 156.616  -5.333  -1.966
  758    HE2  HIS   7           HE2      HIS   7 157.326  -7.724  -1.523
  759    H    ARG   8           HN       ARG   8 160.116  -7.160   3.568
  760    HA   ARG   8           HA       ARG   8 157.979  -9.021   3.093
  761   1HB   ARG   8           HB2      ARG   8 160.591  -9.247   4.600
  762   2HB   ARG   8           HB1      ARG   8 159.486 -10.606   4.371
  763   1HG   ARG   8           HG2      ARG   8 159.625 -10.306   1.923
  764   2HG   ARG   8           HG1      ARG   8 160.736  -8.955   2.156
  765   1HD   ARG   8           HD2      ARG   8 162.333 -10.458   3.282
  766   2HD   ARG   8           HD1      ARG   8 161.226 -11.811   3.046
  767    HE   ARG   8           HE       ARG   8 161.606 -10.816   0.489
  768   1HH1  ARG   8          HH21      ARG   8 163.598 -11.862   3.099
  769   2HH1  ARG   8          HH22      ARG   8 164.877 -12.422   2.076
  770   1HH2  ARG   8          HH11      ARG   8 163.264 -11.539  -0.865
  771   2HH2  ARG   8          HH12      ARG   8 164.687 -12.242  -0.171
  772    H    ASP   9           HN       ASP   9 159.035  -7.194   5.891
  773    HA   ASP   9           HA       ASP   9 157.526  -8.711   7.838
  774   1HB   ASP   9           HB2      ASP   9 158.655  -5.907   7.865
  775   2HB   ASP   9           HB1      ASP   9 157.842  -6.634   9.250
  776    H    PHE  10           HN       PHE  10 156.864  -5.806   5.908
  777    HA   PHE  10           HA       PHE  10 154.366  -5.187   7.182
  778   1HB   PHE  10           HB2      PHE  10 155.738  -3.646   5.723
  779   2HB   PHE  10           HB1      PHE  10 155.156  -4.555   4.329
  780    HD1  PHE  10           HD1      PHE  10 154.236  -2.256   7.043
  781    HD2  PHE  10           HD2      PHE  10 152.804  -4.450   3.639
  782    HE1  PHE  10           HE1      PHE  10 152.154  -0.910   7.054
  783    HE2  PHE  10           HE2      PHE  10 150.719  -3.105   3.651
  784    HZ   PHE  10           HZ       PHE  10 150.394  -1.335   5.359
  785    H    VAL  11           HN       VAL  11 155.134  -7.116   4.275
  786    HA   VAL  11           HA       VAL  11 152.282  -7.742   3.859
  787    HB   VAL  11           HB       VAL  11 153.075  -9.026   1.937
  788   1HG1  VAL  11          HG12      VAL  11 154.540  -6.392   2.289
  789   2HG1  VAL  11          HG11      VAL  11 154.302  -7.210   0.746
  790   3HG1  VAL  11          HG13      VAL  11 152.912  -6.600   1.644
  791   1HG2  VAL  11          HG22      VAL  11 155.756  -8.565   3.243
  792   2HG2  VAL  11          HG21      VAL  11 155.025 -10.101   2.784
  793   3HG2  VAL  11          HG23      VAL  11 155.615  -8.998   1.540
  794    H    ALA  12           HN       ALA  12 154.101  -8.681   6.253
  795    HA   ALA  12           HA       ALA  12 153.479 -11.614   6.042
  796   1HB   ALA  12           HB2      ALA  12 155.595 -10.105   7.586
  797   2HB   ALA  12           HB1      ALA  12 155.191 -11.789   7.920
  798   3HB   ALA  12           HB3      ALA  12 155.829 -11.333   6.342
  799    H    GLU  13           HN       GLU  13 152.519  -8.726   7.582
  800    HA   GLU  13           HA       GLU  13 150.845 -10.282   9.446
  801   1HB   GLU  13           HB2      GLU  13 151.608  -9.042  11.428
  802   2HB   GLU  13           HB1      GLU  13 152.958  -9.901  10.691
  803   1HG   GLU  13           HG2      GLU  13 153.394  -7.708   9.389
  804   2HG   GLU  13           HG1      GLU  13 152.320  -6.951  10.566
  805    HA   PRO  14           HA       PRO  14 147.755  -7.162   8.616
  806   1HB   PRO  14           HB2      PRO  14 147.695  -6.798  11.607
  807   2HB   PRO  14           HB1      PRO  14 146.340  -6.963  10.469
  808   1HG   PRO  14           HG2      PRO  14 147.131  -9.012  11.983
  809   2HG   PRO  14           HG1      PRO  14 146.571  -9.253  10.317
  810   1HD   PRO  14           HD2      PRO  14 149.334  -9.451  11.403
  811   2HD   PRO  14           HD1      PRO  14 148.631 -10.211   9.959
  812    H    MET  15           HN       MET  15 147.494  -4.771   8.778
  813    HA   MET  15           HA       MET  15 150.101  -3.443   9.238
  814   1HB   MET  15           HB2      MET  15 148.818  -1.431   8.315
  815   2HB   MET  15           HB1      MET  15 149.034  -2.789   7.211
  816   1HG   MET  15           HG2      MET  15 146.801  -3.514   7.481
  817   2HG   MET  15           HG1      MET  15 146.573  -2.560   8.944
  818   1HE   MET  15           HE1      MET  15 147.635  -2.520   5.381
  819   2HE   MET  15           HE3      MET  15 145.905  -2.511   5.028
  820   3HE   MET  15           HE2      MET  15 146.896  -1.109   4.630
  821    H    GLY  16           HN       GLY  16 147.060  -3.860  10.808
  822   1HA   GLY  16           HA2      GLY  16 146.148  -2.917  12.756
  823   2HA   GLY  16           HA1      GLY  16 147.827  -2.830  13.283
  824    H    GLU  17           HN       GLU  17 147.738  -0.830  14.285
  825    HA   GLU  17           HA       GLU  17 146.764   1.513  12.720
  826   1HB   GLU  17           HB2      GLU  17 147.408   1.107  15.651
  827   2HB   GLU  17           HB1      GLU  17 146.958   2.665  14.960
  828   1HG   GLU  17           HG2      GLU  17 144.833   1.702  14.161
  829   2HG   GLU  17           HG1      GLU  17 145.277   0.142  14.854
  830    H    LYS  18           HN       LYS  18 149.407   0.173  12.248
  831    HA   LYS  18           HA       LYS  18 151.519   1.739  13.363
  832   1HB   LYS  18           HB2      LYS  18 151.320   0.256  10.723
  833   2HB   LYS  18           HB1      LYS  18 152.813   0.985  11.313
  834   1HG   LYS  18           HG2      LYS  18 152.609  -0.386  13.395
  835   2HG   LYS  18           HG1      LYS  18 151.197  -1.178  12.695
  836   1HD   LYS  18           HD2      LYS  18 152.662  -1.817  10.724
  837   2HD   LYS  18           HD1      LYS  18 154.042  -1.242  11.660
  838   1HE   LYS  18           HE2      LYS  18 152.098  -3.343  12.655
  839   2HE   LYS  18           HE1      LYS  18 153.631  -3.720  11.868
  840   1HZ   LYS  18           HZ3      LYS  18 154.696  -2.283  13.605
  841   2HZ   LYS  18           HZ2      LYS  18 153.206  -2.276  14.421
  842   3HZ   LYS  18           HZ1      LYS  18 154.037  -3.738  14.174
  843    HA   PRO  19           HA       PRO  19 150.881   5.624  11.316
  844   1HB   PRO  19           HB2      PRO  19 153.465   6.571  11.112
  845   2HB   PRO  19           HB1      PRO  19 152.554   6.526  12.635
  846   1HG   PRO  19           HG2      PRO  19 154.593   4.599  11.601
  847   2HG   PRO  19           HG1      PRO  19 154.405   5.268  13.233
  848   1HD   PRO  19           HD2      PRO  19 153.534   2.779  12.614
  849   2HD   PRO  19           HD1      PRO  19 152.667   3.805  13.779
  850    H    VAL  20           HN       VAL  20 151.238   6.787   9.314
  851    HA   VAL  20           HA       VAL  20 151.254   5.202   6.991
  852    HB   VAL  20           HB       VAL  20 150.297   7.429   6.990
  853   1HG1  VAL  20          HG12      VAL  20 152.081   8.344   8.593
  854   2HG1  VAL  20          HG11      VAL  20 153.096   8.563   7.169
  855   3HG1  VAL  20          HG13      VAL  20 151.565   9.424   7.300
  856   1HG2  VAL  20          HG21      VAL  20 151.369   6.452   4.874
  857   2HG2  VAL  20          HG23      VAL  20 151.101   8.195   4.879
  858   3HG2  VAL  20          HG22      VAL  20 152.715   7.551   5.176
  859    H    GLY  21           HN       GLY  21 153.922   7.130   8.345
  860   1HA   GLY  21           HA2      GLY  21 155.828   6.711   6.321
  861   2HA   GLY  21           HA1      GLY  21 156.241   6.976   8.013
  862    H    SER  22           HN       SER  22 154.356   4.276   8.086
  863    HA   SER  22           HA       SER  22 156.707   2.552   8.373
  864   1HB   SER  22           HB2      SER  22 153.753   1.894   8.556
  865   2HB   SER  22           HB1      SER  22 155.073   0.827   9.026
  866    HG   SER  22           HG       SER  22 153.933   2.390  10.619
  867    H    LEU  23           HN       LEU  23 154.472   3.334   5.864
  868    HA   LEU  23           HA       LEU  23 154.532   0.866   4.407
  869   1HB   LEU  23           HB2      LEU  23 154.141   3.728   3.498
  870   2HB   LEU  23           HB1      LEU  23 153.961   2.340   2.427
  871    HG   LEU  23           HG       LEU  23 152.414   2.719   5.011
  872   1HD1  LEU  23          HD11      LEU  23 151.714   3.331   2.132
  873   2HD1  LEU  23          HD13      LEU  23 150.491   3.136   3.387
  874   3HD1  LEU  23          HD12      LEU  23 151.683   4.430   3.511
  875   1HD2  LEU  23          HD21      LEU  23 152.501   0.590   2.887
  876   2HD2  LEU  23          HD23      LEU  23 152.275   0.428   4.627
  877   3HD2  LEU  23          HD22      LEU  23 150.940   0.964   3.614
  878    H    ALA  24           HN       ALA  24 156.009   0.034   3.022
  879    HA   ALA  24           HA       ALA  24 158.716   1.004   3.097
  880   1HB   ALA  24           HB3      ALA  24 157.850  -1.395   2.623
  881   2HB   ALA  24           HB2      ALA  24 157.676  -0.846   0.957
  882   3HB   ALA  24           HB1      ALA  24 159.261  -0.832   1.728
  883    H    GLY  25           HN       GLY  25 159.854   2.233   1.671
  884   1HA   GLY  25           HA2      GLY  25 160.270   3.290  -0.482
  885   2HA   GLY  25           HA1      GLY  25 158.555   3.130  -0.867
  886    H    ILE  26           HN       ILE  26 158.151   4.086   2.090
  887    HA   ILE  26           HA       ILE  26 158.152   6.991   1.392
  888    HB   ILE  26           HB       ILE  26 156.877   5.588   3.765
  889   1HG1  ILE  26          HG12      ILE  26 155.873   4.678   1.758
  890   2HG1  ILE  26          HG11      ILE  26 154.747   5.848   2.442
  891   1HG2  ILE  26          HG22      ILE  26 157.292   8.054   3.941
  892   2HG2  ILE  26          HG21      ILE  26 156.291   8.282   2.508
  893   3HG2  ILE  26          HG23      ILE  26 155.582   7.627   3.984
  894   1HD1  ILE  26          HD13      ILE  26 155.929   7.551   0.840
  895   2HD1  ILE  26          HD12      ILE  26 156.482   6.107  -0.005
  896   3HD1  ILE  26          HD11      ILE  26 154.756   6.421   0.167
  897    H    GLY  27           HN       GLY  27 159.902   8.133   2.151
  898   1HA   GLY  27           HA2      GLY  27 161.552   7.001   4.308
  899   2HA   GLY  27           HA1      GLY  27 161.929   8.435   3.352
  900    H    GLU  28           HN       GLU  28 162.261   8.600   6.062
  901    HA   GLU  28           HA       GLU  28 160.042   9.391   7.611
  902   1HB   GLU  28           HB2      GLU  28 162.926  10.315   7.674
  903   2HB   GLU  28           HB1      GLU  28 161.741  10.757   8.905
  904   1HG   GLU  28           HG2      GLU  28 161.354   8.396   9.422
  905   2HG   GLU  28           HG1      GLU  28 162.478   7.914   8.150
  906    H    VAL  29           HN       VAL  29 162.032  11.338   5.381
  907    HA   VAL  29           HA       VAL  29 160.712  13.822   6.027
  908    HB   VAL  29           HB       VAL  29 162.241  12.975   3.548
  909   1HG1  VAL  29          HG12      VAL  29 161.215  15.665   4.479
  910   2HG1  VAL  29          HG11      VAL  29 162.497  15.493   3.280
  911   3HG1  VAL  29          HG13      VAL  29 160.886  14.858   2.946
  912   1HG2  VAL  29          HG23      VAL  29 163.414  13.004   5.828
  913   2HG2  VAL  29          HG22      VAL  29 164.138  14.003   4.569
  914   3HG2  VAL  29          HG21      VAL  29 163.150  14.748   5.825
  915    H    LEU  30           HN       LEU  30 160.223  11.390   3.489
  916    HA   LEU  30           HA       LEU  30 158.110  12.787   2.134
  917   1HB   LEU  30           HB2      LEU  30 158.664   9.809   2.284
  918   2HB   LEU  30           HB1      LEU  30 157.598  10.590   1.119
  919    HG   LEU  30           HG       LEU  30 160.569  11.139   1.405
  920   1HD1  LEU  30          HD11      LEU  30 159.967   8.873   0.503
  921   2HD1  LEU  30          HD13      LEU  30 159.068   9.673  -0.786
  922   3HD1  LEU  30          HD12      LEU  30 160.814   9.889  -0.664
  923   1HD2  LEU  30          HD22      LEU  30 158.373  12.281  -0.321
  924   2HD2  LEU  30          HD21      LEU  30 159.700  13.114   0.488
  925   3HD2  LEU  30          HD23      LEU  30 160.009  12.175  -0.970
  926    H    GLY  31           HN       GLY  31 158.146  10.433   4.775
  927   1HA   GLY  31           HA2      GLY  31 155.340   9.977   4.910
  928   2HA   GLY  31           HA1      GLY  31 156.447   9.821   6.276
  929    H    LYS  32           HN       LYS  32 157.363  12.517   6.356
  930    HA   LYS  32           HA       LYS  32 155.330  13.705   7.960
  931   1HB   LYS  32           HB2      LYS  32 157.803  14.870   6.665
  932   2HB   LYS  32           HB1      LYS  32 156.774  15.773   7.779
  933   1HG   LYS  32           HG2      LYS  32 157.163  14.153   9.545
  934   2HG   LYS  32           HG1      LYS  32 158.043  13.102   8.439
  935   1HD   LYS  32           HD2      LYS  32 159.692  14.296   9.718
  936   2HD   LYS  32           HD1      LYS  32 159.693  14.993   8.100
  937   1HE   LYS  32           HE2      LYS  32 158.498  16.921   8.813
  938   2HE   LYS  32           HE1      LYS  32 158.022  16.163  10.331
  939   1HZ   LYS  32           HZ1      LYS  32 160.617  16.010  10.604
  940   2HZ   LYS  32           HZ3      LYS  32 160.580  17.345   9.558
  941   3HZ   LYS  32           HZ2      LYS  32 159.759  17.408  11.045
  942    H    LYS  33           HN       LYS  33 156.196  14.272   4.535
  943    HA   LYS  33           HA       LYS  33 154.469  16.541   4.205
  944   1HB   LYS  33           HB2      LYS  33 155.441  14.484   2.202
  945   2HB   LYS  33           HB1      LYS  33 154.589  15.964   1.763
  946   1HG   LYS  33           HG2      LYS  33 156.356  17.306   2.840
  947   2HG   LYS  33           HG1      LYS  33 157.213  15.828   3.279
  948   1HD   LYS  33           HD2      LYS  33 157.419  15.238   0.888
  949   2HD   LYS  33           HD1      LYS  33 156.570  16.720   0.452
  950   1HE   LYS  33           HE2      LYS  33 159.073  16.791   2.137
  951   2HE   LYS  33           HE1      LYS  33 159.154  16.763   0.377
  952   1HZ   LYS  33           HZ3      LYS  33 157.312  18.683   1.547
  953   2HZ   LYS  33           HZ2      LYS  33 158.965  18.996   1.786
  954   3HZ   LYS  33           HZ1      LYS  33 158.346  18.841   0.211
  955    H    LEU  34           HN       LEU  34 153.905  13.049   3.702
  956    HA   LEU  34           HA       LEU  34 151.242  13.302   2.691
  957   1HB   LEU  34           HB2      LEU  34 152.573  11.059   4.233
  958   2HB   LEU  34           HB1      LEU  34 150.978  10.928   3.506
  959    HG   LEU  34           HG       LEU  34 153.449  11.680   1.924
  960   1HD1  LEU  34          HD11      LEU  34 153.671   9.419   2.951
  961   2HD1  LEU  34          HD13      LEU  34 152.142   8.955   2.204
  962   3HD1  LEU  34          HD12      LEU  34 153.534   9.347   1.194
  963   1HD2  LEU  34          HD21      LEU  34 150.589  10.952   1.243
  964   2HD2  LEU  34          HD23      LEU  34 151.553  12.306   0.658
  965   3HD2  LEU  34          HD22      LEU  34 151.881  10.681   0.075
  966    H    GLU  35           HN       GLU  35 152.512  13.069   5.976
  967    HA   GLU  35           HA       GLU  35 150.008  12.801   7.324
  968   1HB   GLU  35           HB2      GLU  35 152.571  14.157   8.221
  969   2HB   GLU  35           HB1      GLU  35 151.191  13.860   9.280
  970   1HG   GLU  35           HG2      GLU  35 151.388  11.479   9.000
  971   2HG   GLU  35           HG1      GLU  35 152.598  11.670   7.739
  972    H    GLU  36           HN       GLU  36 151.749  15.685   6.226
  973    HA   GLU  36           HA       GLU  36 149.875  17.576   7.346
  974   1HB   GLU  36           HB2      GLU  36 151.908  17.790   5.108
  975   2HB   GLU  36           HB1      GLU  36 150.954  19.158   5.682
  976   1HG   GLU  36           HG2      GLU  36 151.848  18.833   7.960
  977   2HG   GLU  36           HG1      GLU  36 152.807  17.467   7.387
  978    H    ARG  37           HN       ARG  37 149.847  15.524   4.593
  979    HA   ARG  37           HA       ARG  37 147.856  17.140   3.126
  980   1HB   ARG  37           HB2      ARG  37 149.069  14.413   2.612
  981   2HB   ARG  37           HB1      ARG  37 147.906  15.181   1.537
  982   1HG   ARG  37           HG2      ARG  37 150.442  16.600   2.356
  983   2HG   ARG  37           HG1      ARG  37 150.440  15.455   1.018
  984   1HD   ARG  37           HD2      ARG  37 148.555  16.796  -0.013
  985   2HD   ARG  37           HD1      ARG  37 148.819  18.008   1.242
  986    HE   ARG  37           HE       ARG  37 151.334  17.640   0.153
  987   1HH1  ARG  37          HH21      ARG  37 148.180  18.357  -1.047
  988   2HH1  ARG  37          HH22      ARG  37 148.760  19.296  -2.381
  989   1HH2  ARG  37          HH11      ARG  37 152.104  18.859  -1.578
  990   2HH2  ARG  37          HH12      ARG  37 150.982  19.580  -2.683
  991    H    GLY  38           HN       GLY  38 147.681  15.092   5.759
  992   1HA   GLY  38           HA2      GLY  38 145.476  14.724   6.767
  993   2HA   GLY  38           HA1      GLY  38 144.794  14.524   5.160
  994    H    PHE  39           HN       PHE  39 147.702  12.857   5.214
  995    HA   PHE  39           HA       PHE  39 146.258  10.285   5.757
  996   1HB   PHE  39           HB2      PHE  39 148.867  10.849   4.329
  997   2HB   PHE  39           HB1      PHE  39 148.176   9.245   4.556
  998    HD1  PHE  39           HD2      PHE  39 146.088   8.602   3.399
  999    HD2  PHE  39           HD1      PHE  39 147.935  12.415   2.760
 1000    HE1  PHE  39           HE2      PHE  39 144.682   8.943   1.386
 1001    HE2  PHE  39           HE1      PHE  39 146.535  12.764   0.748
 1002    HZ   PHE  39           HZ       PHE  39 144.900  11.025   0.057
 1003    H    ASP  40           HN       ASP  40 146.493  10.891   8.106
 1004    HA   ASP  40           HA       ASP  40 149.158  10.956   9.254
 1005   1HB   ASP  40           HB2      ASP  40 147.999  11.022  11.394
 1006   2HB   ASP  40           HB1      ASP  40 147.186  12.104  10.262
 1007    H    LYS  41           HN       LYS  41 147.107   8.396   8.225
 1008    HA   LYS  41           HA       LYS  41 148.868   6.461   9.664
 1009   1HB   LYS  41           HB2      LYS  41 145.841   6.421   9.650
 1010   2HB   LYS  41           HB1      LYS  41 146.837   5.039  10.116
 1011   1HG   LYS  41           HG2      LYS  41 147.955   6.438  11.835
 1012   2HG   LYS  41           HG1      LYS  41 146.935   7.795  11.382
 1013   1HD   LYS  41           HD2      LYS  41 145.805   6.931  13.234
 1014   2HD   LYS  41           HD1      LYS  41 144.953   6.175  11.893
 1015   1HE   LYS  41           HE2      LYS  41 145.493   4.542  13.683
 1016   2HE   LYS  41           HE1      LYS  41 146.300   4.130  12.172
 1017   1HZ   LYS  41           HZ3      LYS  41 147.537   5.632  14.417
 1018   2HZ   LYS  41           HZ2      LYS  41 147.789   3.986  14.086
 1019   3HZ   LYS  41           HZ1      LYS  41 148.312   5.164  12.985
 1020    H    ALA  42           HN       ALA  42 148.872   4.327   8.688
 1021    HA   ALA  42           HA       ALA  42 149.196   4.460   5.861
 1022   1HB   ALA  42           HB3      ALA  42 150.462   2.923   7.267
 1023   2HB   ALA  42           HB2      ALA  42 148.988   2.038   7.658
 1024   3HB   ALA  42           HB1      ALA  42 149.608   2.035   6.006
 1025    H    TYR  43           HN       TYR  43 146.522   2.916   7.728
 1026    HA   TYR  43           HA       TYR  43 145.332   1.679   5.486
 1027   1HB   TYR  43           HB2      TYR  43 143.244   1.564   6.709
 1028   2HB   TYR  43           HB1      TYR  43 144.592   1.189   7.772
 1029    HD1  TYR  43           HD1      TYR  43 142.324   3.992   6.734
 1030    HD2  TYR  43           HD2      TYR  43 144.872   2.361   9.786
 1031    HE1  TYR  43           HE1      TYR  43 141.537   5.730   8.316
 1032    HE2  TYR  43           HE2      TYR  43 144.087   4.096  11.366
 1033    HH   TYR  43           HH       TYR  43 141.512   5.683  11.227
 1034    H    VAL  44           HN       VAL  44 145.476   5.064   6.139
 1035    HA   VAL  44           HA       VAL  44 143.116   5.691   4.495
 1036    HB   VAL  44           HB       VAL  44 145.369   7.537   5.351
 1037   1HG1  VAL  44          HG13      VAL  44 143.722   8.215   3.482
 1038   2HG1  VAL  44          HG12      VAL  44 142.489   8.234   4.741
 1039   3HG1  VAL  44          HG11      VAL  44 143.876   9.318   4.847
 1040   1HG2  VAL  44          HG23      VAL  44 144.310   6.437   7.297
 1041   2HG2  VAL  44          HG22      VAL  44 143.904   8.152   7.233
 1042   3HG2  VAL  44          HG21      VAL  44 142.725   6.945   6.715
 1043    H    VAL  45           HN       VAL  45 146.565   5.396   4.146
 1044    HA   VAL  45           HA       VAL  45 146.683   6.474   1.431
 1045    HB   VAL  45           HB       VAL  45 148.679   4.732   2.915
 1046   1HG1  VAL  45          HG11      VAL  45 148.934   6.481   0.449
 1047   2HG1  VAL  45          HG13      VAL  45 150.289   5.718   1.281
 1048   3HG1  VAL  45          HG12      VAL  45 149.059   4.723   0.502
 1049   1HG2  VAL  45          HG22      VAL  45 148.286   7.727   2.731
 1050   2HG2  VAL  45          HG21      VAL  45 148.393   6.732   4.183
 1051   3HG2  VAL  45          HG23      VAL  45 149.828   7.008   3.196
 1052    H    LEU  46           HN       LEU  46 146.547   3.234   2.900
 1053    HA   LEU  46           HA       LEU  46 146.802   1.748   0.475
 1054   1HB   LEU  46           HB2      LEU  46 146.888   0.660   2.698
 1055   2HB   LEU  46           HB1      LEU  46 145.195   1.070   2.965
 1056    HG   LEU  46           HG       LEU  46 144.583  -0.290   0.961
 1057   1HD1  LEU  46          HD12      LEU  46 147.561  -0.679   0.873
 1058   2HD1  LEU  46          HD11      LEU  46 146.499  -1.950   0.270
 1059   3HD1  LEU  46          HD13      LEU  46 146.443  -0.343  -0.448
 1060   1HD2  LEU  46          HD22      LEU  46 144.887  -1.193   3.425
 1061   2HD2  LEU  46          HD21      LEU  46 144.556  -2.297   2.096
 1062   3HD2  LEU  46          HD23      LEU  46 146.202  -2.119   2.694
 1063    H    GLY  47           HN       GLY  47 144.082   3.289   2.082
 1064   1HA   GLY  47           HA2      GLY  47 141.963   2.278   0.493
 1065   2HA   GLY  47           HA1      GLY  47 141.945   3.860   1.276
 1066    H    GLN  48           HN       GLN  48 144.141   5.047  -0.071
 1067    HA   GLN  48           HA       GLN  48 142.887   5.997  -2.451
 1068   1HB   GLN  48           HB2      GLN  48 144.683   7.208  -1.201
 1069   2HB   GLN  48           HB1      GLN  48 145.846   6.012  -1.768
 1070   1HG   GLN  48           HG2      GLN  48 145.961   7.961  -3.218
 1071   2HG   GLN  48           HG1      GLN  48 145.253   6.627  -4.126
 1072   1HE2  GLN  48          HE22      GLN  48 142.635   8.855  -4.975
 1073   2HE2  GLN  48          HE21      GLN  48 143.920   7.899  -5.538
 1074    H    PHE  49           HN       PHE  49 145.407   3.532  -1.948
 1075    HA   PHE  49           HA       PHE  49 145.917   2.938  -4.688
 1076   1HB   PHE  49           HB2      PHE  49 147.288   2.141  -2.760
 1077   2HB   PHE  49           HB1      PHE  49 145.976   1.061  -2.302
 1078    HD1  PHE  49           HD1      PHE  49 147.904   1.960  -5.403
 1079    HD2  PHE  49           HD2      PHE  49 146.188  -1.164  -2.999
 1080    HE1  PHE  49           HE1      PHE  49 148.794   0.263  -6.971
 1081    HE2  PHE  49           HE2      PHE  49 147.081  -2.859  -4.572
 1082    HZ   PHE  49           HZ       PHE  49 148.382  -2.144  -6.557
 1083    H    LEU  50           HN       LEU  50 143.512   1.704  -2.424
 1084    HA   LEU  50           HA       LEU  50 142.402  -0.251  -4.257
 1085   1HB   LEU  50           HB2      LEU  50 141.102   1.116  -1.876
 1086   2HB   LEU  50           HB1      LEU  50 140.499  -0.334  -2.679
 1087    HG   LEU  50           HG       LEU  50 143.195  -0.086  -1.305
 1088   1HD1  LEU  50          HD12      LEU  50 140.999  -0.156   0.107
 1089   2HD1  LEU  50          HD11      LEU  50 140.910  -1.840  -0.403
 1090   3HD1  LEU  50          HD13      LEU  50 142.300  -1.270   0.523
 1091   1HD2  LEU  50          HD22      LEU  50 141.863  -2.259  -2.913
 1092   2HD2  LEU  50          HD21      LEU  50 143.550  -1.743  -2.913
 1093   3HD2  LEU  50          HD23      LEU  50 142.927  -2.713  -1.582
 1094    H    VAL  51           HN       VAL  51 141.627   3.118  -3.505
 1095    HA   VAL  51           HA       VAL  51 139.263   3.276  -5.120
 1096    HB   VAL  51           HB       VAL  51 141.212   5.384  -4.156
 1097   1HG1  VAL  51          HG12      VAL  51 138.622   5.647  -5.698
 1098   2HG1  VAL  51          HG11      VAL  51 139.255   6.953  -4.696
 1099   3HG1  VAL  51          HG13      VAL  51 140.189   6.367  -6.073
 1100   1HG2  VAL  51          HG22      VAL  51 139.832   4.117  -2.480
 1101   2HG2  VAL  51          HG21      VAL  51 139.485   5.846  -2.514
 1102   3HG2  VAL  51          HG23      VAL  51 138.384   4.709  -3.293
 1103    H    LEU  52           HN       LEU  52 142.641   3.329  -5.951
 1104    HA   LEU  52           HA       LEU  52 142.136   4.569  -8.593
 1105   1HB   LEU  52           HB2      LEU  52 144.644   3.478  -7.298
 1106   2HB   LEU  52           HB1      LEU  52 144.601   4.231  -8.891
 1107    HG   LEU  52           HG       LEU  52 143.623   5.593  -6.365
 1108   1HD1  LEU  52          HD13      LEU  52 146.293   5.774  -7.781
 1109   2HD1  LEU  52          HD12      LEU  52 145.766   6.871  -6.504
 1110   3HD1  LEU  52          HD11      LEU  52 146.008   5.159  -6.153
 1111   1HD2  LEU  52          HD23      LEU  52 143.953   6.417  -9.246
 1112   2HD2  LEU  52          HD22      LEU  52 142.638   6.772  -8.127
 1113   3HD2  LEU  52          HD21      LEU  52 144.168   7.628  -7.982
 1114    H    LYS  53           HN       LYS  53 141.290   1.648  -7.623
 1115    HA   LYS  53           HA       LYS  53 141.178  -0.475  -8.633
 1116   1HB   LYS  53           HB2      LYS  53 141.423   1.270 -11.104
 1117   2HB   LYS  53           HB1      LYS  53 140.820  -0.388 -11.073
 1118   1HG   LYS  53           HG2      LYS  53 138.988   0.302  -9.571
 1119   2HG   LYS  53           HG1      LYS  53 139.587   1.961  -9.602
 1120   1HD   LYS  53           HD2      LYS  53 139.251   2.036 -12.049
 1121   2HD   LYS  53           HD1      LYS  53 138.638   0.383 -12.013
 1122   1HE   LYS  53           HE2      LYS  53 136.713   1.808 -12.000
 1123   2HE   LYS  53           HE1      LYS  53 136.885   1.197 -10.354
 1124   1HZ   LYS  53           HZ2      LYS  53 138.337   3.635 -10.925
 1125   2HZ   LYS  53           HZ1      LYS  53 136.645   3.784 -10.971
 1126   3HZ   LYS  53           HZ3      LYS  53 137.407   3.215  -9.566
 1127    H    LYS  54           HN       LYS  54 143.830   0.250  -7.833
 1128    HA   LYS  54           HA       LYS  54 146.048  -0.465  -8.109
 1129   1HB   LYS  54           HB2      LYS  54 144.987  -2.312 -10.257
 1130   2HB   LYS  54           HB1      LYS  54 146.382  -2.553  -9.209
 1131   1HG   LYS  54           HG2      LYS  54 143.497  -2.454  -8.273
 1132   2HG   LYS  54           HG1      LYS  54 144.444  -3.921  -8.488
 1133   1HD   LYS  54           HD2      LYS  54 146.104  -2.994  -6.826
 1134   2HD   LYS  54           HD1      LYS  54 144.963  -1.687  -6.509
 1135   1HE   LYS  54           HE2      LYS  54 143.228  -3.398  -5.950
 1136   2HE   LYS  54           HE1      LYS  54 144.463  -4.647  -6.116
 1137   1HZ   LYS  54           HZ3      LYS  54 145.076  -2.374  -4.392
 1138   2HZ   LYS  54           HZ2      LYS  54 143.935  -3.494  -3.817
 1139   3HZ   LYS  54           HZ1      LYS  54 145.502  -4.007  -4.225
 1140    H    ASP  55           HN       ASP  55 144.766   1.614 -10.089
 1141    HA   ASP  55           HA       ASP  55 146.219   1.265 -12.563
 1142   1HB   ASP  55           HB2      ASP  55 144.986   3.660 -11.191
 1143   2HB   ASP  55           HB1      ASP  55 145.898   3.839 -12.691
 1144    H    GLU  56           HN       GLU  56 148.409   0.990 -12.450
 1145    HA   GLU  56           HA       GLU  56 150.103   1.961 -10.386
 1146   1HB   GLU  56           HB2      GLU  56 150.678   0.065 -11.837
 1147   2HB   GLU  56           HB1      GLU  56 150.806   1.153 -13.218
 1148   1HG   GLU  56           HG2      GLU  56 152.665   2.334 -12.184
 1149   2HG   GLU  56           HG1      GLU  56 152.478   1.397 -10.700
 1150    H    ASP  57           HN       ASP  57 149.426   3.353 -13.601
 1151    HA   ASP  57           HA       ASP  57 151.431   5.417 -13.378
 1152   1HB   ASP  57           HB2      ASP  57 148.943   5.162 -15.087
 1153   2HB   ASP  57           HB1      ASP  57 150.088   6.495 -15.241
 1154    H    LEU  58           HN       LEU  58 148.003   5.275 -12.615
 1155    HA   LEU  58           HA       LEU  58 147.834   8.092 -11.917
 1156   1HB   LEU  58           HB2      LEU  58 146.070   5.740 -11.189
 1157   2HB   LEU  58           HB1      LEU  58 145.711   7.396 -10.713
 1158    HG   LEU  58           HG       LEU  58 146.115   6.496 -13.583
 1159   1HD1  LEU  58          HD13      LEU  58 144.081   5.535 -12.407
 1160   2HD1  LEU  58          HD12      LEU  58 143.510   7.191 -12.203
 1161   3HD1  LEU  58          HD11      LEU  58 143.724   6.524 -13.822
 1162   1HD2  LEU  58          HD23      LEU  58 145.495   9.127 -12.253
 1163   2HD2  LEU  58          HD22      LEU  58 146.509   8.792 -13.657
 1164   3HD2  LEU  58          HD21      LEU  58 144.759   8.789 -13.820
 1165    H    PHE  59           HN       PHE  59 148.482   5.131 -10.091
 1166    HA   PHE  59           HA       PHE  59 148.518   6.361  -7.501
 1167   1HB   PHE  59           HB2      PHE  59 148.427   3.935  -7.721
 1168   2HB   PHE  59           HB1      PHE  59 149.983   3.923  -8.549
 1169    HD1  PHE  59           HD1      PHE  59 148.354   4.921  -5.332
 1170    HD2  PHE  59           HD2      PHE  59 151.990   3.770  -7.312
 1171    HE1  PHE  59           HE1      PHE  59 149.511   4.804  -3.140
 1172    HE2  PHE  59           HE2      PHE  59 153.147   3.653  -5.121
 1173    HZ   PHE  59           HZ       PHE  59 151.907   4.171  -3.035
 1174    H    ARG  60           HN       ARG  60 151.171   5.634  -9.785
 1175    HA   ARG  60           HA       ARG  60 153.241   6.746  -8.189
 1176   1HB   ARG  60           HB2      ARG  60 152.996   6.442 -11.190
 1177   2HB   ARG  60           HB1      ARG  60 154.476   6.961 -10.380
 1178   1HG   ARG  60           HG2      ARG  60 154.445   4.865  -9.042
 1179   2HG   ARG  60           HG1      ARG  60 153.024   4.339  -9.929
 1180   1HD   ARG  60           HD2      ARG  60 155.742   4.949 -11.120
 1181   2HD   ARG  60           HD1      ARG  60 155.028   3.347 -10.922
 1182    HE   ARG  60           HE       ARG  60 153.154   4.690 -12.435
 1183   1HH1  ARG  60          HH21      ARG  60 156.551   4.135 -12.597
 1184   2HH1  ARG  60          HH22      ARG  60 156.613   4.185 -14.328
 1185   1HH2  ARG  60          HH11      ARG  60 153.215   4.765 -14.695
 1186   2HH2  ARG  60          HH12      ARG  60 154.725   4.542 -15.515
 1187    H    GLU  61           HN       GLU  61 151.267   8.294 -10.757
 1188    HA   GLU  61           HA       GLU  61 152.601  10.822 -10.630
 1189   1HB   GLU  61           HB2      GLU  61 151.078  10.183 -12.474
 1190   2HB   GLU  61           HB1      GLU  61 149.717  10.197 -11.353
 1191   1HG   GLU  61           HG2      GLU  61 150.102  12.600 -10.912
 1192   2HG   GLU  61           HG1      GLU  61 151.462  12.584 -12.035
 1193    H    TRP  62           HN       TRP  62 149.922   9.419  -8.787
 1194    HA   TRP  62           HA       TRP  62 149.152  11.800  -7.409
 1195   1HB   TRP  62           HB2      TRP  62 147.691   9.898  -7.346
 1196   2HB   TRP  62           HB1      TRP  62 148.960   8.868  -6.688
 1197    HD1  TRP  62           HD1      TRP  62 146.633  11.759  -5.698
 1198    HE1  TRP  62           HE1      TRP  62 146.475  11.836  -3.124
 1199    HE3  TRP  62           HE3      TRP  62 150.139   8.239  -4.488
 1200    HZ2  TRP  62           HZ2      TRP  62 147.679  10.570  -0.851
 1201    HZ3  TRP  62           HZ3      TRP  62 150.606   7.696  -2.117
 1202    HH2  TRP  62           HH2      TRP  62 149.383   8.856  -0.300
 1203    H    LEU  63           HN       LEU  63 151.454   9.234  -6.499
 1204    HA   LEU  63           HA       LEU  63 152.114  10.413  -3.967
 1205   1HB   LEU  63           HB2      LEU  63 152.477   8.036  -4.466
 1206   2HB   LEU  63           HB1      LEU  63 153.665   8.466  -5.694
 1207    HG   LEU  63           HG       LEU  63 155.077   9.509  -3.955
 1208   1HD1  LEU  63          HD12      LEU  63 152.748   8.740  -2.208
 1209   2HD1  LEU  63          HD11      LEU  63 154.371   8.815  -1.521
 1210   3HD1  LEU  63          HD13      LEU  63 153.655  10.252  -2.247
 1211   1HD2  LEU  63          HD23      LEU  63 154.206   6.668  -3.354
 1212   2HD2  LEU  63          HD22      LEU  63 155.427   7.153  -4.531
 1213   3HD2  LEU  63          HD21      LEU  63 155.715   7.400  -2.809
 1214    H    LYS  64           HN       LYS  64 153.816  10.457  -7.099
 1215    HA   LYS  64           HA       LYS  64 156.020  12.033  -6.208
 1216   1HB   LYS  64           HB2      LYS  64 155.991  10.790  -8.362
 1217   2HB   LYS  64           HB1      LYS  64 154.829  11.957  -8.993
 1218   1HG   LYS  64           HG2      LYS  64 156.457  13.781  -8.640
 1219   2HG   LYS  64           HG1      LYS  64 157.618  12.620  -7.996
 1220   1HD   LYS  64           HD2      LYS  64 157.639  11.426 -10.137
 1221   2HD   LYS  64           HD1      LYS  64 156.446  12.550 -10.789
 1222   1HE   LYS  64           HE2      LYS  64 159.098  13.489  -9.682
 1223   2HE   LYS  64           HE1      LYS  64 158.896  13.033 -11.374
 1224   1HZ   LYS  64           HZ2      LYS  64 156.772  14.680 -10.792
 1225   2HZ   LYS  64           HZ1      LYS  64 158.111  15.422 -10.056
 1226   3HZ   LYS  64           HZ3      LYS  64 158.142  15.075 -11.716
 1227    H    ASP  65           HN       ASP  65 153.011  13.060  -7.822
 1228    HA   ASP  65           HA       ASP  65 153.669  15.864  -7.674
 1229   1HB   ASP  65           HB2      ASP  65 151.044  14.410  -8.074
 1230   2HB   ASP  65           HB1      ASP  65 151.197  16.166  -8.138
 1231    H    THR  66           HN       THR  66 152.196  13.609  -5.434
 1232    HA   THR  66           HA       THR  66 151.057  15.700  -3.755
 1233    HB   THR  66           HB       THR  66 151.496  12.739  -3.286
 1234    HG1  THR  66           HG1      THR  66 149.334  12.633  -3.766
 1235   1HG2  THR  66          HG23      THR  66 150.077  14.837  -1.625
 1236   2HG2  THR  66          HG22      THR  66 149.833  13.103  -1.420
 1237   3HG2  THR  66          HG21      THR  66 151.420  13.810  -1.124
 1238    H    CYS  67           HN       CYS  67 154.093  13.807  -3.728
 1239    HA   CYS  67           HA       CYS  67 154.986  15.532  -1.428
 1240   1HB   CYS  67           HB2      CYS  67 156.171  13.624  -0.506
 1241   2HB   CYS  67           HB1      CYS  67 154.473  13.200  -0.719
 1242    HG   CYS  67           HG       CYS  67 155.532  11.253  -1.910
 1243    H    GLY  68           HN       GLY  68 155.922  13.804  -4.375
 1244   1HA   GLY  68           HA2      GLY  68 157.587  14.848  -5.858
 1245   2HA   GLY  68           HA1      GLY  68 158.446  15.425  -4.430
 1246    H    ALA  69           HN       ALA  69 157.178  12.232  -4.174
 1247    HA   ALA  69           HA       ALA  69 159.634  10.998  -3.619
 1248   1HB   ALA  69           HB2      ALA  69 157.420   9.961  -3.179
 1249   2HB   ALA  69           HB1      ALA  69 157.212   9.704  -4.912
 1250   3HB   ALA  69           HB3      ALA  69 158.496   8.864  -4.043
 1251    H    ASN  70           HN       ASN  70 161.036   9.641  -4.922
 1252    HA   ASN  70           HA       ASN  70 161.205  10.570  -7.728
 1253   1HB   ASN  70           HB2      ASN  70 163.082   9.008  -5.939
 1254   2HB   ASN  70           HB1      ASN  70 163.414   9.333  -7.641
 1255   1HD2  ASN  70          HD22      ASN  70 164.863  12.092  -5.492
 1256   2HD2  ASN  70          HD21      ASN  70 165.027  10.403  -5.459
 1257    H    ALA  71           HN       ALA  71 161.955   8.808  -9.319
 1258    HA   ALA  71           HA       ALA  71 159.862   6.933  -9.678
 1259   1HB   ALA  71           HB1      ALA  71 161.466   7.842 -11.438
 1260   2HB   ALA  71           HB3      ALA  71 162.634   6.656 -10.852
 1261   3HB   ALA  71           HB2      ALA  71 161.104   6.119 -11.546
 1262    H    LYS  72           HN       LYS  72 163.059   6.511  -8.142
 1263    HA   LYS  72           HA       LYS  72 162.827   3.634  -8.004
 1264   1HB   LYS  72           HB2      LYS  72 164.497   5.620  -6.441
 1265   2HB   LYS  72           HB1      LYS  72 164.624   3.874  -6.234
 1266   1HG   LYS  72           HG2      LYS  72 165.223   3.593  -8.584
 1267   2HG   LYS  72           HG1      LYS  72 164.970   5.311  -8.881
 1268   1HD   LYS  72           HD2      LYS  72 167.298   5.195  -8.620
 1269   2HD   LYS  72           HD1      LYS  72 166.767   5.654  -7.004
 1270   1HE   LYS  72           HE2      LYS  72 168.420   3.829  -6.899
 1271   2HE   LYS  72           HE1      LYS  72 166.856   3.279  -6.306
 1272   1HZ   LYS  72           HZ1      LYS  72 167.746   2.912  -9.107
 1273   2HZ   LYS  72           HZ3      LYS  72 167.998   1.750  -7.899
 1274   3HZ   LYS  72           HZ2      LYS  72 166.416   2.187  -8.338
 1275    H    GLN  73           HN       GLN  73 162.034   6.254  -5.743
 1276    HA   GLN  73           HA       GLN  73 161.296   4.541  -3.569
 1277   1HB   GLN  73           HB2      GLN  73 160.527   7.385  -4.263
 1278   2HB   GLN  73           HB1      GLN  73 160.042   6.593  -2.764
 1279   1HG   GLN  73           HG2      GLN  73 162.342   6.286  -2.098
 1280   2HG   GLN  73           HG1      GLN  73 162.922   6.836  -3.670
 1281   1HE2  GLN  73          HE22      GLN  73 162.874   9.641  -1.053
 1282   2HE2  GLN  73          HE21      GLN  73 163.407   8.033  -0.932
 1283    H    SER  74           HN       SER  74 159.420   5.959  -6.238
 1284    HA   SER  74           HA       SER  74 156.872   5.125  -5.297
 1285   1HB   SER  74           HB2      SER  74 157.850   5.594  -8.123
 1286   2HB   SER  74           HB1      SER  74 156.164   5.447  -7.644
 1287    HG   SER  74           HG       SER  74 156.429   7.555  -7.457
 1288    H    ARG  75           HN       ARG  75 159.286   3.441  -7.348
 1289    HA   ARG  75           HA       ARG  75 157.624   1.252  -8.084
 1290   1HB   ARG  75           HB2      ARG  75 160.616   1.410  -7.628
 1291   2HB   ARG  75           HB1      ARG  75 159.813  -0.020  -8.274
 1292   1HG   ARG  75           HG2      ARG  75 158.985   1.255 -10.180
 1293   2HG   ARG  75           HG1      ARG  75 159.660   2.741  -9.516
 1294   1HD   ARG  75           HD2      ARG  75 161.159   1.784 -11.236
 1295   2HD   ARG  75           HD1      ARG  75 161.930   1.783  -9.654
 1296    HE   ARG  75           HE       ARG  75 160.653  -0.712  -9.889
 1297   1HH1  ARG  75          HH21      ARG  75 163.058   1.137 -11.529
 1298   2HH1  ARG  75          HH22      ARG  75 163.882  -0.250 -12.159
 1299   1HH2  ARG  75          HH11      ARG  75 161.713  -2.530 -10.706
 1300   2HH2  ARG  75          HH12      ARG  75 163.121  -2.325 -11.694
 1301    H    ASP  76           HN       ASP  76 159.596   1.792  -5.163
 1302    HA   ASP  76           HA       ASP  76 159.213  -0.833  -4.094
 1303   1HB   ASP  76           HB2      ASP  76 159.845   1.821  -2.789
 1304   2HB   ASP  76           HB1      ASP  76 159.819   0.294  -1.907
 1305    H    CYS  77           HN       CYS  77 157.300   2.167  -3.732
 1306    HA   CYS  77           HA       CYS  77 155.573   1.107  -1.700
 1307   1HB   CYS  77           HB2      CYS  77 155.237   3.340  -3.710
 1308   2HB   CYS  77           HB1      CYS  77 154.025   2.961  -2.487
 1309    HG   CYS  77           HG       CYS  77 155.391   4.308  -0.928
 1310    H    PHE  78           HN       PHE  78 155.345   1.119  -5.287
 1311    HA   PHE  78           HA       PHE  78 152.677   0.168  -5.420
 1312   1HB   PHE  78           HB2      PHE  78 153.914   0.942  -7.408
 1313   2HB   PHE  78           HB1      PHE  78 154.966  -0.472  -7.303
 1314    HD1  PHE  78           HD1      PHE  78 151.570   0.725  -8.070
 1315    HD2  PHE  78           HD2      PHE  78 154.139  -2.710  -7.848
 1316    HE1  PHE  78           HE1      PHE  78 149.901  -0.604  -9.334
 1317    HE2  PHE  78           HE2      PHE  78 152.469  -4.041  -9.112
 1318    HZ   PHE  78           HZ       PHE  78 150.349  -2.987  -9.854
 1319    H    GLY  79           HN       GLY  79 155.646  -1.822  -5.719
 1320   1HA   GLY  79           HA2      GLY  79 154.308  -4.318  -5.531
 1321   2HA   GLY  79           HA1      GLY  79 156.008  -4.066  -5.146
 1322    H    CYS  80           HN       CYS  80 155.395  -2.096  -3.039
 1323    HA   CYS  80           HA       CYS  80 155.118  -3.964  -0.838
 1324   1HB   CYS  80           HB2      CYS  80 156.440  -1.839  -0.740
 1325   2HB   CYS  80           HB1      CYS  80 154.923  -0.941  -0.766
 1326    HG   CYS  80           HG       CYS  80 155.217  -3.044   1.489
 1327    H    LEU  81           HN       LEU  81 152.955  -1.344  -2.077
 1328    HA   LEU  81           HA       LEU  81 150.826  -2.084  -0.254
 1329   1HB   LEU  81           HB2      LEU  81 150.742  -0.522  -2.856
 1330   2HB   LEU  81           HB1      LEU  81 149.443  -0.598  -1.669
 1331    HG   LEU  81           HG       LEU  81 152.229   0.466  -1.117
 1332   1HD1  LEU  81          HD11      LEU  81 149.600   1.900  -1.604
 1333   2HD1  LEU  81          HD13      LEU  81 151.088   2.679  -1.068
 1334   3HD1  LEU  81          HD12      LEU  81 151.012   1.925  -2.661
 1335   1HD2  LEU  81          HD21      LEU  81 149.733   0.113   0.541
 1336   2HD2  LEU  81          HD23      LEU  81 151.410  -0.210   0.975
 1337   3HD2  LEU  81          HD22      LEU  81 150.827   1.449   0.896
 1338    H    ARG  82           HN       ARG  82 151.573  -2.792  -3.656
 1339    HA   ARG  82           HA       ARG  82 149.172  -4.173  -4.268
 1340   1HB   ARG  82           HB2      ARG  82 150.694  -3.460  -6.020
 1341   2HB   ARG  82           HB1      ARG  82 151.967  -4.500  -5.389
 1342   1HG   ARG  82           HG2      ARG  82 150.831  -5.489  -7.370
 1343   2HG   ARG  82           HG1      ARG  82 150.659  -6.497  -5.938
 1344   1HD   ARG  82           HD2      ARG  82 148.398  -5.839  -5.618
 1345   2HD   ARG  82           HD1      ARG  82 148.560  -4.464  -6.709
 1346    HE   ARG  82           HE       ARG  82 149.081  -6.676  -8.306
 1347   1HH1  ARG  82          HH21      ARG  82 146.587  -5.629  -6.173
 1348   2HH1  ARG  82          HH22      ARG  82 145.327  -6.463  -7.019
 1349   1HH2  ARG  82          HH11      ARG  82 147.451  -7.775  -9.426
 1350   2HH2  ARG  82          HH12      ARG  82 145.817  -7.679  -8.861
 1351    H    GLU  83           HN       GLU  83 152.222  -5.363  -2.899
 1352    HA   GLU  83           HA       GLU  83 151.410  -8.129  -2.928
 1353   1HB   GLU  83           HB2      GLU  83 153.565  -6.651  -1.414
 1354   2HB   GLU  83           HB1      GLU  83 153.315  -8.390  -1.262
 1355   1HG   GLU  83           HG2      GLU  83 153.721  -7.008  -3.927
 1356   2HG   GLU  83           HG1      GLU  83 155.044  -7.713  -2.996
 1357    H    TRP  84           HN       TRP  84 151.115  -5.541  -0.481
 1358    HA   TRP  84           HA       TRP  84 150.259  -7.222   1.664
 1359   1HB   TRP  84           HB2      TRP  84 150.846  -4.748   1.828
 1360   2HB   TRP  84           HB1      TRP  84 149.267  -4.407   1.117
 1361    HD1  TRP  84           HD1      TRP  84 150.915  -5.769   4.271
 1362    HE1  TRP  84           HE1      TRP  84 149.152  -5.887   6.158
 1363    HE3  TRP  84           HE3      TRP  84 146.687  -4.601   1.636
 1364    HZ2  TRP  84           HZ2      TRP  84 146.350  -5.555   6.501
 1365    HZ3  TRP  84           HZ3      TRP  84 144.488  -4.512   2.780
 1366    HH2  TRP  84           HH2      TRP  84 144.317  -4.981   5.208
 1367    H    CYS  85           HN       CYS  85 148.456  -5.530  -0.891
 1368    HA   CYS  85           HA       CYS  85 145.846  -6.318  -0.105
 1369   1HB   CYS  85           HB2      CYS  85 147.031  -5.683  -2.817
 1370   2HB   CYS  85           HB1      CYS  85 145.310  -5.952  -2.564
 1371    HG   CYS  85           HG       CYS  85 146.335  -3.336  -2.248
 1372    H    ASP  86           HN       ASP  86 148.221  -7.960  -2.173
 1373    HA   ASP  86           HA       ASP  86 146.540 -10.070  -3.062
 1374   1HB   ASP  86           HB2      ASP  86 149.524  -9.968  -2.563
 1375   2HB   ASP  86           HB1      ASP  86 148.716 -11.344  -3.314
 1376    H    ALA  87           HN       ALA  87 148.238  -9.592  -0.011
 1377    HA   ALA  87           HA       ALA  87 147.605 -12.350   0.873
 1378   1HB   ALA  87           HB1      ALA  87 149.784 -11.353   1.477
 1379   2HB   ALA  87           HB3      ALA  87 148.948 -10.067   2.349
 1380   3HB   ALA  87           HB2      ALA  87 148.832 -11.734   2.912
 1381    H    PHE  88           HN       PHE  88 146.545  -9.030   1.474
 1382    HA   PHE  88           HA       PHE  88 144.542 -10.049   3.462
 1383   1HB   PHE  88           HB2      PHE  88 145.685  -7.293   3.007
 1384   2HB   PHE  88           HB1      PHE  88 144.415  -7.661   4.173
 1385    HD1  PHE  88           HD2      PHE  88 144.892  -9.334   6.022
 1386    HD2  PHE  88           HD1      PHE  88 147.977  -7.726   3.504
 1387    HE1  PHE  88           HE2      PHE  88 146.607 -10.022   7.677
 1388    HE2  PHE  88           HE1      PHE  88 149.691  -8.412   5.157
 1389    HZ   PHE  88           HZ       PHE  88 149.004  -9.553   7.246
 1390    H    LEU  89           HN       LEU  89 144.596  -9.318   0.236
 1391    HA   LEU  89           HA       LEU  89 141.705  -8.546   0.283
 1392   1HB   LEU  89           HB2      LEU  89 143.328  -6.542  -0.095
 1393   2HB   LEU  89           HB1      LEU  89 143.639  -7.278  -1.663
 1394    HG   LEU  89           HG       LEU  89 140.994  -7.324  -1.839
 1395   1HD1  LEU  89          HD12      LEU  89 140.957  -6.372   0.627
 1396   2HD1  LEU  89          HD11      LEU  89 141.235  -4.824  -0.168
 1397   3HD1  LEU  89          HD13      LEU  89 139.801  -5.774  -0.560
 1398   1HD2  LEU  89          HD22      LEU  89 142.842  -4.966  -2.239
 1399   2HD2  LEU  89          HD21      LEU  89 142.177  -6.064  -3.448
 1400   3HD2  LEU  89          HD23      LEU  89 141.137  -4.861  -2.685
   
  No H/Q in entry =        1400
  Start of MODEL    6
    1   1H    MET   1           HT1      MET   1 115.819  -7.273  12.553
    2   2H    MET   1           HT3      MET   1 114.943  -6.686  13.881
    3   3H    MET   1           HT2      MET   1 116.143  -5.721  13.161
    4    HA   MET   1           HA       MET   1 117.562  -6.487  14.662
    5   1HB   MET   1           HB2      MET   1 116.931  -8.243  16.251
    6   2HB   MET   1           HB1      MET   1 115.589  -7.118  16.041
    7   1HG   MET   1           HG2      MET   1 114.664  -8.700  14.293
    8   2HG   MET   1           HG1      MET   1 115.898  -9.857  14.786
    9   1HE   MET   1           HE3      MET   1 116.114 -11.020  16.799
   10   2HE   MET   1           HE2      MET   1 116.156  -9.673  17.934
   11   3HE   MET   1           HE1      MET   1 115.051 -11.016  18.211
   12    H    THR   2           HN       THR   2 116.237  -8.630  12.281
   13    HA   THR   2           HA       THR   2 118.670 -10.374  12.388
   14    HB   THR   2           HB       THR   2 116.501 -11.543  12.447
   15    HG1  THR   2           HG1      THR   2 116.932 -12.897  10.690
   16   1HG2  THR   2          HG22      THR   2 115.397  -9.635  11.035
   17   2HG2  THR   2          HG21      THR   2 115.949 -10.580   9.651
   18   3HG2  THR   2          HG23      THR   2 114.837 -11.293  10.818
   19    H    THR   3           HN       THR   3 120.252  -9.863  10.971
   20    HA   THR   3           HA       THR   3 119.735  -8.033   8.742
   21    HB   THR   3           HB       THR   3 122.155  -8.207   8.341
   22    HG1  THR   3           HG1      THR   3 121.877 -10.313  10.192
   23   1HG2  THR   3          HG23      THR   3 121.315  -6.719  10.145
   24   2HG2  THR   3          HG22      THR   3 121.522  -8.037  11.299
   25   3HG2  THR   3          HG21      THR   3 122.927  -7.342  10.491
   26    H    SER   4           HN       SER   4 120.355  -8.586   6.504
   27    HA   SER   4           HA       SER   4 119.234 -11.118   5.667
   28   1HB   SER   4           HB2      SER   4 119.773 -10.398   3.420
   29   2HB   SER   4           HB1      SER   4 119.190  -8.994   4.307
   30    HG   SER   4           HG       SER   4 121.028  -8.267   3.450
   31    H    GLN   5           HN       GLN   5 120.425 -12.730   4.398
   32    HA   GLN   5           HA       GLN   5 122.698 -13.743   5.753
   33   1HB   GLN   5           HB2      GLN   5 121.147 -15.112   4.364
   34   2HB   GLN   5           HB1      GLN   5 121.822 -14.363   2.917
   35   1HG   GLN   5           HG2      GLN   5 124.060 -15.228   3.511
   36   2HG   GLN   5           HG1      GLN   5 123.384 -15.979   4.956
   37   1HE2  GLN   5          HE22      GLN   5 121.251 -17.916   2.356
   38   2HE2  GLN   5          HE21      GLN   5 120.833 -16.522   3.230
   39    H    LYS   6           HN       LYS   6 122.488 -11.428   3.117
   40    HA   LYS   6           HA       LYS   6 125.080 -11.743   2.013
   41   1HB   LYS   6           HB2      LYS   6 123.286  -9.323   2.309
   42   2HB   LYS   6           HB1      LYS   6 124.789  -9.308   1.385
   43   1HG   LYS   6           HG2      LYS   6 123.951 -11.141  -0.028
   44   2HG   LYS   6           HG1      LYS   6 122.443 -11.161   0.891
   45   1HD   LYS   6           HD2      LYS   6 122.004  -8.824   0.225
   46   2HD   LYS   6           HD1      LYS   6 123.507  -8.807  -0.699
   47   1HE   LYS   6           HE2      LYS   6 122.691 -10.345  -2.289
   48   2HE   LYS   6           HE1      LYS   6 121.395 -10.897  -1.226
   49   1HZ   LYS   6           HZ3      LYS   6 120.665  -8.424  -1.384
   50   2HZ   LYS   6           HZ2      LYS   6 121.574  -8.438  -2.819
   51   3HZ   LYS   6           HZ1      LYS   6 120.268  -9.508  -2.627
   52    H    HIS   7           HN       HIS   7 123.934  -9.886   4.821
   53    HA   HIS   7           HA       HIS   7 126.326  -8.455   5.315
   54   1HB   HIS   7           HB2      HIS   7 124.289  -7.913   6.523
   55   2HB   HIS   7           HB1      HIS   7 124.240  -9.519   7.244
   56    HD2  HIS   7           HD2      HIS   7 125.866  -9.850   9.509
   57    HE1  HIS   7           HE1      HIS   7 127.542  -5.975   9.512
   58    HE2  HIS   7           HE2      HIS   7 127.328  -8.135  10.819
   59    H    ARG   8           HN       ARG   8 125.328 -11.635   6.638
   60    HA   ARG   8           HA       ARG   8 127.819 -12.055   8.009
   61   1HB   ARG   8           HB2      ARG   8 125.601 -13.931   7.162
   62   2HB   ARG   8           HB1      ARG   8 127.000 -14.451   8.103
   63   1HG   ARG   8           HG2      ARG   8 126.452 -12.790   9.844
   64   2HG   ARG   8           HG1      ARG   8 125.051 -12.271   8.907
   65   1HD   ARG   8           HD2      ARG   8 125.499 -15.063  10.002
   66   2HD   ARG   8           HD1      ARG   8 124.387 -13.866  10.668
   67    HE   ARG   8           HE       ARG   8 123.597 -14.098   8.023
   68   1HH1  ARG   8          HH21      ARG   8 124.163 -16.234  10.667
   69   2HH1  ARG   8          HH22      ARG   8 122.986 -17.396  10.155
   70   1HH2  ARG   8          HH11      ARG   8 122.052 -15.600   7.339
   71   2HH2  ARG   8          HH12      ARG   8 121.789 -17.036   8.269
   72    H    ASP   9           HN       ASP   9 126.657 -12.810   4.766
   73    HA   ASP   9           HA       ASP   9 128.715 -14.677   4.055
   74   1HB   ASP   9           HB2      ASP   9 127.137 -12.715   2.377
   75   2HB   ASP   9           HB1      ASP   9 128.227 -13.915   1.696
   76    H    PHE  10           HN       PHE  10 128.467 -11.167   3.901
   77    HA   PHE  10           HA       PHE  10 130.898 -10.676   2.501
   78   1HB   PHE  10           HB2      PHE  10 128.991  -9.059   3.121
   79   2HB   PHE  10           HB1      PHE  10 129.794  -8.899   4.682
   80    HD1  PHE  10           HD1      PHE  10 130.626  -8.863   1.026
   81    HD2  PHE  10           HD2      PHE  10 131.378  -7.186   4.911
   82    HE1  PHE  10           HE1      PHE  10 132.197  -7.229   0.019
   83    HE2  PHE  10           HE2      PHE  10 132.947  -5.552   3.903
   84    HZ   PHE  10           HZ       PHE  10 133.355  -5.574   1.456
   85    H    VAL  11           HN       VAL  11 130.308 -10.658   6.043
   86    HA   VAL  11           HA       VAL  11 133.211 -10.580   6.568
   87    HB   VAL  11           HB       VAL  11 132.503 -10.516   8.949
   88   1HG1  VAL  11          HG12      VAL  11 132.418  -8.480   7.156
   89   2HG1  VAL  11          HG11      VAL  11 130.725  -8.493   7.636
   90   3HG1  VAL  11          HG13      VAL  11 131.984  -8.269   8.846
   91   1HG2  VAL  11          HG22      VAL  11 130.463 -11.913   8.685
   92   2HG2  VAL  11          HG21      VAL  11 130.099 -10.380   9.472
   93   3HG2  VAL  11          HG23      VAL  11 129.709 -10.611   7.770
   94    H    ALA  12           HN       ALA  12 131.326 -13.085   5.688
   95    HA   ALA  12           HA       ALA  12 132.429 -14.994   7.728
   96   1HB   ALA  12           HB3      ALA  12 130.298 -15.342   5.613
   97   2HB   ALA  12           HB2      ALA  12 130.931 -16.663   6.594
   98   3HB   ALA  12           HB1      ALA  12 130.074 -15.325   7.359
   99    H    GLU  13           HN       GLU  13 132.774 -13.898   4.487
  100    HA   GLU  13           HA       GLU  13 135.032 -15.761   4.105
  101   1HB   GLU  13           HB2      GLU  13 134.158 -16.227   1.735
  102   2HB   GLU  13           HB1      GLU  13 133.318 -17.051   3.049
  103   1HG   GLU  13           HG2      GLU  13 131.526 -15.430   3.012
  104   2HG   GLU  13           HG1      GLU  13 132.403 -14.414   1.866
  105    HA   PRO  14           HA       PRO  14 137.103 -12.214   2.409
  106   1HB   PRO  14           HB2      PRO  14 137.419 -13.866  -0.091
  107   2HB   PRO  14           HB1      PRO  14 138.632 -12.906   0.782
  108   1HG   PRO  14           HG2      PRO  14 138.509 -15.578   1.008
  109   2HG   PRO  14           HG1      PRO  14 138.985 -14.539   2.364
  110   1HD   PRO  14           HD2      PRO  14 136.478 -16.085   1.997
  111   2HD   PRO  14           HD1      PRO  14 137.206 -15.452   3.490
  112    H    MET  15           HN       MET  15 136.725 -10.526   0.738
  113    HA   MET  15           HA       MET  15 133.945 -10.615  -0.263
  114   1HB   MET  15           HB2      MET  15 134.582  -8.228  -1.039
  115   2HB   MET  15           HB1      MET  15 134.479  -8.522   0.695
  116   1HG   MET  15           HG2      MET  15 136.830  -8.593   0.942
  117   2HG   MET  15           HG1      MET  15 137.091  -8.825  -0.787
  118   1HE   MET  15           HE3      MET  15 135.514  -6.787   1.851
  119   2HE   MET  15           HE2      MET  15 137.042  -5.928   2.017
  120   3HE   MET  15           HE1      MET  15 135.632  -5.088   1.379
  121    H    GLY  16           HN       GLY  16 137.190 -10.974  -1.428
  122   1HA   GLY  16           HA2      GLY  16 138.050 -11.341  -3.577
  123   2HA   GLY  16           HA1      GLY  16 136.525 -12.182  -3.851
  124    H    GLU  17           HN       GLU  17 136.117 -11.482  -5.922
  125    HA   GLU  17           HA       GLU  17 136.082  -8.549  -6.466
  126   1HB   GLU  17           HB2      GLU  17 135.993 -10.957  -8.306
  127   2HB   GLU  17           HB1      GLU  17 135.946  -9.279  -8.848
  128   1HG   GLU  17           HG2      GLU  17 138.128  -8.866  -7.768
  129   2HG   GLU  17           HG1      GLU  17 138.178 -10.545  -7.230
  130    H    LYS  18           HN       LYS  18 133.943  -9.964  -4.936
  131    HA   LYS  18           HA       LYS  18 131.657 -10.403  -6.575
  132   1HB   LYS  18           HB2      LYS  18 131.895  -9.449  -3.704
  133   2HB   LYS  18           HB1      LYS  18 130.345  -9.812  -4.461
  134   1HG   LYS  18           HG2      LYS  18 131.350 -12.109  -5.045
  135   2HG   LYS  18           HG1      LYS  18 132.637 -11.706  -3.910
  136   1HD   LYS  18           HD2      LYS  18 129.672 -11.796  -3.272
  137   2HD   LYS  18           HD1      LYS  18 130.870 -12.996  -2.786
  138   1HE   LYS  18           HE2      LYS  18 132.115 -11.034  -1.666
  139   2HE   LYS  18           HE1      LYS  18 130.614 -10.132  -1.865
  140   1HZ   LYS  18           HZ1      LYS  18 129.497 -12.051  -0.730
  141   2HZ   LYS  18           HZ3      LYS  18 131.040 -12.632  -0.335
  142   3HZ   LYS  18           HZ2      LYS  18 130.526 -11.123   0.252
  143    HA   PRO  19           HA       PRO  19 130.807  -6.327  -8.050
  144   1HB   PRO  19           HB2      PRO  19 128.057  -6.388  -8.305
  145   2HB   PRO  19           HB1      PRO  19 129.173  -7.204  -9.417
  146   1HG   PRO  19           HG2      PRO  19 127.626  -8.338  -7.128
  147   2HG   PRO  19           HG1      PRO  19 127.918  -9.020  -8.739
  148   1HD   PRO  19           HD2      PRO  19 129.318  -9.834  -6.554
  149   2HD   PRO  19           HD1      PRO  19 130.042  -9.792  -8.176
  150    H    VAL  20           HN       VAL  20 130.013  -4.272  -7.490
  151    HA   VAL  20           HA       VAL  20 130.024  -3.540  -4.799
  152    HB   VAL  20           HB       VAL  20 130.316  -1.872  -6.506
  153   1HG1  VAL  20          HG13      VAL  20 127.475  -2.529  -7.342
  154   2HG1  VAL  20          HG12      VAL  20 128.467  -1.243  -8.027
  155   3HG1  VAL  20          HG11      VAL  20 128.938  -2.928  -8.243
  156   1HG2  VAL  20          HG21      VAL  20 129.092  -1.236  -4.342
  157   2HG2  VAL  20          HG23      VAL  20 128.904  -0.124  -5.699
  158   3HG2  VAL  20          HG22      VAL  20 127.611  -1.255  -5.298
  159    H    GLY  21           HN       GLY  21 127.312  -4.614  -6.748
  160   1HA   GLY  21           HA2      GLY  21 125.235  -3.838  -4.908
  161   2HA   GLY  21           HA1      GLY  21 125.056  -5.008  -6.214
  162    H    SER  22           HN       SER  22 127.644  -6.154  -4.561
  163    HA   SER  22           HA       SER  22 125.992  -8.160  -3.189
  164   1HB   SER  22           HB2      SER  22 129.010  -7.870  -3.257
  165   2HB   SER  22           HB1      SER  22 128.103  -9.295  -2.758
  166    HG   SER  22           HG       SER  22 127.545  -8.225  -5.268
  167    H    LEU  23           HN       LEU  23 127.626  -5.223  -2.399
  168    HA   LEU  23           HA       LEU  23 128.230  -5.723   0.352
  169   1HB   LEU  23           HB2      LEU  23 127.494  -3.145  -1.064
  170   2HB   LEU  23           HB1      LEU  23 128.118  -3.225   0.580
  171    HG   LEU  23           HG       LEU  23 129.569  -4.354  -1.832
  172   1HD1  LEU  23          HD13      LEU  23 129.814  -1.679  -0.434
  173   2HD1  LEU  23          HD12      LEU  23 131.054  -2.329  -1.507
  174   3HD1  LEU  23          HD11      LEU  23 129.445  -1.973  -2.134
  175   1HD2  LEU  23          HD23      LEU  23 130.215  -4.051   1.102
  176   2HD2  LEU  23          HD22      LEU  23 130.479  -5.431   0.040
  177   3HD2  LEU  23          HD21      LEU  23 131.519  -4.021  -0.086
  178    H    ALA  24           HN       ALA  24 126.965  -5.774   2.135
  179    HA   ALA  24           HA       ALA  24 124.128  -6.002   1.898
  180   1HB   ALA  24           HB3      ALA  24 126.056  -5.731   4.190
  181   2HB   ALA  24           HB2      ALA  24 124.319  -5.668   4.501
  182   3HB   ALA  24           HB1      ALA  24 125.033  -7.100   3.760
  183    H    GLY  25           HN       GLY  25 122.547  -4.517   2.019
  184   1HA   GLY  25           HA2      GLY  25 121.544  -2.443   2.837
  185   2HA   GLY  25           HA1      GLY  25 123.160  -1.756   2.998
  186    H    ILE  26           HN       ILE  26 123.737  -3.061   0.242
  187    HA   ILE  26           HA       ILE  26 122.682  -0.763  -1.355
  188    HB   ILE  26           HB       ILE  26 124.778  -2.812  -2.133
  189   1HG1  ILE  26          HG12      ILE  26 125.584  -1.674  -0.149
  190   2HG1  ILE  26          HG11      ILE  26 126.418  -0.998  -1.546
  191   1HG2  ILE  26          HG21      ILE  26 123.717  -1.557  -3.980
  192   2HG2  ILE  26          HG23      ILE  26 124.137  -0.041  -3.184
  193   3HG2  ILE  26          HG22      ILE  26 125.410  -1.102  -3.785
  194   1HD1  ILE  26          HD11      ILE  26 124.487   0.775  -1.529
  195   2HD1  ILE  26          HD13      ILE  26 124.241   0.231   0.131
  196   3HD1  ILE  26          HD12      ILE  26 125.790   0.921  -0.353
  197    H    GLY  27           HN       GLY  27 120.851  -1.219  -2.571
  198   1HA   GLY  27           HA2      GLY  27 120.210  -4.045  -3.168
  199   2HA   GLY  27           HA1      GLY  27 119.134  -2.665  -3.394
  200    H    GLU  28           HN       GLU  28 119.202  -4.312  -5.486
  201    HA   GLU  28           HA       GLU  28 121.274  -4.050  -7.382
  202   1HB   GLU  28           HB2      GLU  28 118.298  -4.435  -7.763
  203   2HB   GLU  28           HB1      GLU  28 119.461  -4.532  -9.084
  204   1HG   GLU  28           HG2      GLU  28 120.661  -6.333  -7.919
  205   2HG   GLU  28           HG1      GLU  28 119.526  -6.228  -6.571
  206    H    VAL  29           HN       VAL  29 118.462  -1.896  -6.866
  207    HA   VAL  29           HA       VAL  29 119.037  -0.256  -9.168
  208    HB   VAL  29           HB       VAL  29 117.477   0.291  -6.627
  209   1HG1  VAL  29          HG13      VAL  29 117.871   1.987  -9.103
  210   2HG1  VAL  29          HG12      VAL  29 116.510   2.207  -8.003
  211   3HG1  VAL  29          HG11      VAL  29 118.160   2.446  -7.425
  212   1HG2  VAL  29          HG23      VAL  29 116.699  -0.398  -9.475
  213   2HG2  VAL  29          HG22      VAL  29 116.465  -1.397  -8.042
  214   3HG2  VAL  29          HG21      VAL  29 115.550   0.097  -8.233
  215    H    LEU  30           HN       LEU  30 119.921  -0.027  -5.749
  216    HA   LEU  30           HA       LEU  30 121.276   2.496  -5.956
  217   1HB   LEU  30           HB2      LEU  30 121.727   0.227  -3.990
  218   2HB   LEU  30           HB1      LEU  30 122.286   1.886  -3.787
  219    HG   LEU  30           HG       LEU  30 119.388   1.011  -4.008
  220   1HD1  LEU  30          HD11      LEU  30 121.055   1.993  -1.673
  221   2HD1  LEU  30          HD13      LEU  30 119.303   1.794  -1.630
  222   3HD1  LEU  30          HD12      LEU  30 120.344   0.390  -1.862
  223   1HD2  LEU  30          HD23      LEU  30 120.734   3.707  -3.901
  224   2HD2  LEU  30          HD22      LEU  30 119.358   3.187  -4.872
  225   3HD2  LEU  30          HD21      LEU  30 119.149   3.506  -3.154
  226    H    GLY  31           HN       GLY  31 122.340  -0.851  -6.351
  227   1HA   GLY  31           HA2      GLY  31 125.140  -0.358  -6.483
  228   2HA   GLY  31           HA1      GLY  31 124.322  -1.709  -7.267
  229    H    LYS  32           HN       LYS  32 122.626  -0.204  -8.992
  230    HA   LYS  32           HA       LYS  32 124.382   0.216 -11.202
  231   1HB   LYS  32           HB2      LYS  32 121.992  -0.370 -11.452
  232   2HB   LYS  32           HB1      LYS  32 121.545   1.222 -10.841
  233   1HG   LYS  32           HG2      LYS  32 122.738   2.285 -12.730
  234   2HG   LYS  32           HG1      LYS  32 123.185   0.692 -13.339
  235   1HD   LYS  32           HD2      LYS  32 120.799   0.123 -13.600
  236   2HD   LYS  32           HD1      LYS  32 120.352   1.717 -12.989
  237   1HE   LYS  32           HE2      LYS  32 121.459   2.801 -14.865
  238   2HE   LYS  32           HE1      LYS  32 122.071   1.251 -15.443
  239   1HZ   LYS  32           HZ3      LYS  32 119.724   0.529 -15.660
  240   2HZ   LYS  32           HZ2      LYS  32 119.236   2.114 -15.292
  241   3HZ   LYS  32           HZ1      LYS  32 120.141   1.806 -16.696
  242    H    LYS  33           HN       LYS  33 122.881   2.575  -8.958
  243    HA   LYS  33           HA       LYS  33 123.784   4.865 -10.446
  244   1HB   LYS  33           HB2      LYS  33 123.015   4.516  -7.539
  245   2HB   LYS  33           HB1      LYS  33 123.406   6.081  -8.255
  246   1HG   LYS  33           HG2      LYS  33 121.622   5.766  -9.929
  247   2HG   LYS  33           HG1      LYS  33 121.226   4.203  -9.214
  248   1HD   LYS  33           HD2      LYS  33 120.683   5.317  -7.078
  249   2HD   LYS  33           HD1      LYS  33 121.071   6.881  -7.797
  250   1HE   LYS  33           HE2      LYS  33 119.311   6.472  -9.527
  251   2HE   LYS  33           HE1      LYS  33 118.872   4.990  -8.678
  252   1HZ   LYS  33           HZ2      LYS  33 119.024   7.302  -6.973
  253   2HZ   LYS  33           HZ1      LYS  33 117.836   7.431  -8.180
  254   3HZ   LYS  33           HZ3      LYS  33 117.807   6.123  -7.100
  255    H    LEU  34           HN       LEU  34 125.228   3.097  -7.687
  256    HA   LEU  34           HA       LEU  34 127.492   4.828  -7.393
  257   1HB   LEU  34           HB2      LEU  34 127.234   1.855  -6.835
  258   2HB   LEU  34           HB1      LEU  34 128.579   2.858  -6.304
  259    HG   LEU  34           HG       LEU  34 125.689   3.400  -5.578
  260   1HD1  LEU  34          HD11      LEU  34 126.555   1.232  -4.667
  261   2HD1  LEU  34          HD13      LEU  34 127.858   2.127  -3.884
  262   3HD1  LEU  34          HD12      LEU  34 126.183   2.416  -3.412
  263   1HD2  LEU  34          HD21      LEU  34 128.347   4.641  -4.848
  264   2HD2  LEU  34          HD23      LEU  34 126.828   5.430  -5.272
  265   3HD2  LEU  34          HD22      LEU  34 127.019   4.686  -3.691
  266    H    GLU  35           HN       GLU  35 126.853   2.033  -9.438
  267    HA   GLU  35           HA       GLU  35 129.474   1.746 -10.531
  268   1HB   GLU  35           HB2      GLU  35 127.695   0.077 -10.876
  269   2HB   GLU  35           HB1      GLU  35 126.803   1.226 -11.874
  270   1HG   GLU  35           HG2      GLU  35 128.663   1.289 -13.485
  271   2HG   GLU  35           HG1      GLU  35 129.585   0.173 -12.476
  272    H    GLU  36           HN       GLU  36 126.762   3.814 -11.526
  273    HA   GLU  36           HA       GLU  36 128.076   4.888 -13.855
  274   1HB   GLU  36           HB2      GLU  36 125.620   5.038 -13.464
  275   2HB   GLU  36           HB1      GLU  36 125.922   6.155 -12.132
  276   1HG   GLU  36           HG2      GLU  36 126.918   7.774 -13.631
  277   2HG   GLU  36           HG1      GLU  36 126.844   6.636 -14.977
  278    H    ARG  37           HN       ARG  37 128.408   5.403 -10.480
  279    HA   ARG  37           HA       ARG  37 129.714   8.042 -10.802
  280   1HB   ARG  37           HB2      ARG  37 129.119   6.305  -8.396
  281   2HB   ARG  37           HB1      ARG  37 130.039   7.800  -8.285
  282   1HG   ARG  37           HG2      ARG  37 127.314   7.743  -9.586
  283   2HG   ARG  37           HG1      ARG  37 127.476   7.887  -7.837
  284   1HD   ARG  37           HD2      ARG  37 129.009   9.874  -8.242
  285   2HD   ARG  37           HD1      ARG  37 128.549   9.793  -9.940
  286    HE   ARG  37           HE       ARG  37 126.125   9.874  -8.609
  287   1HH1  ARG  37          HH21      ARG  37 129.036  11.726  -8.647
  288   2HH1  ARG  37          HH22      ARG  37 128.248  13.220  -8.263
  289   1HH2  ARG  37          HH11      ARG  37 125.081  11.818  -8.103
  290   2HH2  ARG  37          HH12      ARG  37 126.011  13.272  -7.957
  291    H    GLY  38           HN       GLY  38 130.686   4.945 -11.358
  292   1HA   GLY  38           HA2      GLY  38 132.957   4.424 -11.952
  293   2HA   GLY  38           HA1      GLY  38 133.523   5.690 -10.869
  294    H    PHE  39           HN       PHE  39 131.225   3.067 -10.094
  295    HA   PHE  39           HA       PHE  39 133.287   1.853  -8.291
  296   1HB   PHE  39           HB2      PHE  39 130.419   2.571  -7.639
  297   2HB   PHE  39           HB1      PHE  39 131.417   1.525  -6.629
  298    HD1  PHE  39           HD1      PHE  39 130.931   4.951  -7.888
  299    HD2  PHE  39           HD2      PHE  39 133.292   2.423  -5.354
  300    HE1  PHE  39           HE1      PHE  39 131.946   6.957  -6.842
  301    HE2  PHE  39           HE2      PHE  39 134.312   4.428  -4.304
  302    HZ   PHE  39           HZ       PHE  39 133.642   6.694  -5.050
  303    H    ASP  40           HN       ASP  40 133.272   0.456 -10.367
  304    HA   ASP  40           HA       ASP  40 130.908  -1.211 -10.781
  305   1HB   ASP  40           HB2      ASP  40 132.318  -2.367 -12.445
  306   2HB   ASP  40           HB1      ASP  40 132.394  -0.618 -12.657
  307    H    LYS  41           HN       LYS  41 133.581  -1.312  -8.634
  308    HA   LYS  41           HA       LYS  41 132.960  -4.178  -7.986
  309   1HB   LYS  41           HB2      LYS  41 135.683  -2.842  -7.923
  310   2HB   LYS  41           HB1      LYS  41 135.342  -4.497  -7.432
  311   1HG   LYS  41           HG2      LYS  41 134.768  -3.448 -10.214
  312   2HG   LYS  41           HG1      LYS  41 136.282  -4.237  -9.780
  313   1HD   LYS  41           HD2      LYS  41 134.857  -6.202  -8.960
  314   2HD   LYS  41           HD1      LYS  41 133.501  -5.433  -9.783
  315   1HE   LYS  41           HE2      LYS  41 134.753  -5.458 -11.900
  316   2HE   LYS  41           HE1      LYS  41 136.114  -6.231 -11.088
  317   1HZ   LYS  41           HZ3      LYS  41 133.456  -7.456 -10.880
  318   2HZ   LYS  41           HZ2      LYS  41 134.332  -7.648 -12.324
  319   3HZ   LYS  41           HZ1      LYS  41 134.986  -8.189 -10.852
  320    H    ALA  42           HN       ALA  42 133.088  -4.721  -5.791
  321    HA   ALA  42           HA       ALA  42 132.232  -2.690  -3.969
  322   1HB   ALA  42           HB1      ALA  42 131.716  -5.144  -3.803
  323   2HB   ALA  42           HB3      ALA  42 133.374  -5.397  -3.255
  324   3HB   ALA  42           HB2      ALA  42 132.267  -4.419  -2.292
  325    H    TYR  43           HN       TYR  43 135.434  -4.232  -4.403
  326    HA   TYR  43           HA       TYR  43 136.622  -3.137  -2.082
  327   1HB   TYR  43           HB2      TYR  43 138.783  -3.541  -3.093
  328   2HB   TYR  43           HB1      TYR  43 137.705  -4.878  -3.476
  329    HD1  TYR  43           HD1      TYR  43 139.094  -1.688  -4.829
  330    HD2  TYR  43           HD2      TYR  43 137.272  -5.472  -5.718
  331    HE1  TYR  43           HE1      TYR  43 139.528  -1.323  -7.243
  332    HE2  TYR  43           HE2      TYR  43 137.704  -5.112  -8.135
  333    HH   TYR  43           HH       TYR  43 139.824  -2.822  -9.296
  334    H    VAL  44           HN       VAL  44 135.644  -1.478  -4.953
  335    HA   VAL  44           HA       VAL  44 137.484   0.780  -4.535
  336    HB   VAL  44           HB       VAL  44 134.935   0.611  -6.191
  337   1HG1  VAL  44          HG12      VAL  44 135.565   2.928  -5.580
  338   2HG1  VAL  44          HG11      VAL  44 137.191   2.644  -6.195
  339   3HG1  VAL  44          HG13      VAL  44 135.815   2.634  -7.298
  340   1HG2  VAL  44          HG22      VAL  44 137.865   0.330  -6.932
  341   2HG2  VAL  44          HG21      VAL  44 136.636  -0.930  -7.012
  342   3HG2  VAL  44          HG23      VAL  44 136.545   0.453  -8.098
  343    H    VAL  45           HN       VAL  45 134.299  -0.233  -3.658
  344    HA   VAL  45           HA       VAL  45 133.459   2.284  -2.429
  345    HB   VAL  45           HB       VAL  45 132.393  -0.551  -2.220
  346   1HG1  VAL  45          HG11      VAL  45 131.421   2.049  -1.024
  347   2HG1  VAL  45          HG13      VAL  45 130.342   0.681  -1.290
  348   3HG1  VAL  45          HG12      VAL  45 131.720   0.518  -0.204
  349   1HG2  VAL  45          HG21      VAL  45 131.580   1.909  -3.782
  350   2HG2  VAL  45          HG23      VAL  45 132.029   0.328  -4.415
  351   3HG2  VAL  45          HG22      VAL  45 130.503   0.532  -3.554
  352    H    LEU  46           HN       LEU  46 134.936  -0.748  -1.402
  353    HA   LEU  46           HA       LEU  46 134.857  -0.343   1.427
  354   1HB   LEU  46           HB2      LEU  46 135.549  -2.486   0.328
  355   2HB   LEU  46           HB1      LEU  46 137.005  -1.690  -0.255
  356    HG   LEU  46           HG       LEU  46 137.522  -1.165   2.209
  357   1HD1  LEU  46          HD12      LEU  46 135.223  -3.086   2.518
  358   2HD1  LEU  46          HD11      LEU  46 136.480  -2.961   3.745
  359   3HD1  LEU  46          HD13      LEU  46 135.498  -1.554   3.342
  360   1HD2  LEU  46          HD23      LEU  46 137.585  -3.905   0.976
  361   2HD2  LEU  46          HD22      LEU  46 138.904  -2.766   1.209
  362   3HD2  LEU  46          HD21      LEU  46 138.243  -3.638   2.591
  363    H    GLY  47           HN       GLY  47 137.019   0.733  -1.127
  364   1HA   GLY  47           HA2      GLY  47 139.075   1.883   0.467
  365   2HA   GLY  47           HA1      GLY  47 138.680   2.386  -1.176
  366    H    GLN  48           HN       GLN  48 136.016   3.316  -0.751
  367    HA   GLN  48           HA       GLN  48 136.509   5.965   0.196
  368   1HB   GLN  48           HB2      GLN  48 134.628   5.318  -1.324
  369   2HB   GLN  48           HB1      GLN  48 133.845   4.515   0.035
  370   1HG   GLN  48           HG2      GLN  48 132.889   6.737  -0.210
  371   2HG   GLN  48           HG1      GLN  48 133.854   6.705   1.264
  372   1HE2  GLN  48          HE22      GLN  48 135.783   9.426   0.163
  373   2HE2  GLN  48          HE21      GLN  48 135.066   8.590   1.454
  374    H    PHE  49           HN       PHE  49 135.021   3.142   1.764
  375    HA   PHE  49           HA       PHE  49 134.332   4.370   4.242
  376   1HB   PHE  49           HB2      PHE  49 133.553   2.136   3.542
  377   2HB   PHE  49           HB1      PHE  49 135.199   1.520   3.657
  378    HD1  PHE  49           HD1      PHE  49 132.530   3.197   5.685
  379    HD2  PHE  49           HD2      PHE  49 135.986   0.645   5.687
  380    HE1  PHE  49           HE1      PHE  49 132.168   2.704   8.089
  381    HE2  PHE  49           HE2      PHE  49 135.624   0.154   8.085
  382    HZ   PHE  49           HZ       PHE  49 133.715   1.183   9.290
  383    H    LEU  50           HN       LEU  50 137.311   2.847   3.117
  384    HA   LEU  50           HA       LEU  50 138.710   3.110   5.645
  385   1HB   LEU  50           HB2      LEU  50 139.777   2.899   2.812
  386   2HB   LEU  50           HB1      LEU  50 140.777   2.795   4.258
  387    HG   LEU  50           HG       LEU  50 138.442   0.950   3.656
  388   1HD1  LEU  50          HD13      LEU  50 140.465   0.788   2.106
  389   2HD1  LEU  50          HD12      LEU  50 141.390   0.283   3.516
  390   3HD1  LEU  50          HD11      LEU  50 140.032  -0.693   2.958
  391   1HD2  LEU  50          HD22      LEU  50 140.436   1.180   5.907
  392   2HD2  LEU  50          HD21      LEU  50 138.709   0.832   5.978
  393   3HD2  LEU  50          HD23      LEU  50 139.836  -0.415   5.457
  394    H    VAL  51           HN       VAL  51 138.377   5.155   2.786
  395    HA   VAL  51           HA       VAL  51 140.247   7.168   3.609
  396    HB   VAL  51           HB       VAL  51 137.886   7.242   1.716
  397   1HG1  VAL  51          HG12      VAL  51 139.916   9.363   2.440
  398   2HG1  VAL  51          HG11      VAL  51 139.103   9.357   0.874
  399   3HG1  VAL  51          HG13      VAL  51 138.161   9.515   2.357
  400   1HG2  VAL  51          HG23      VAL  51 139.945   5.821   1.222
  401   2HG2  VAL  51          HG22      VAL  51 139.552   7.035   0.005
  402   3HG2  VAL  51          HG21      VAL  51 140.860   7.327   1.151
  403    H    LEU  52           HN       LEU  52 136.859   6.609   4.397
  404    HA   LEU  52           HA       LEU  52 136.538   9.289   5.569
  405   1HB   LEU  52           HB2      LEU  52 134.757   6.838   5.576
  406   2HB   LEU  52           HB1      LEU  52 134.299   8.398   6.252
  407    HG   LEU  52           HG       LEU  52 135.158   8.004   3.370
  408   1HD1  LEU  52          HD13      LEU  52 132.423   7.993   4.655
  409   2HD1  LEU  52          HD12      LEU  52 132.660   8.314   2.938
  410   3HD1  LEU  52          HD11      LEU  52 133.137   6.759   3.618
  411   1HD2  LEU  52          HD23      LEU  52 134.093  10.318   4.990
  412   2HD2  LEU  52          HD22      LEU  52 135.415  10.292   3.823
  413   3HD2  LEU  52          HD21      LEU  52 133.749  10.236   3.261
  414    H    LYS  53           HN       LYS  53 138.391   6.907   6.638
  415    HA   LYS  53           HA       LYS  53 139.002   6.102   8.763
  416   1HB   LYS  53           HB2      LYS  53 137.996   8.890   9.399
  417   2HB   LYS  53           HB1      LYS  53 138.925   7.892  10.519
  418   1HG   LYS  53           HG2      LYS  53 140.772   7.774   8.889
  419   2HG   LYS  53           HG1      LYS  53 139.848   8.775   7.768
  420   1HD   LYS  53           HD2      LYS  53 139.816  10.604   9.423
  421   2HD   LYS  53           HD1      LYS  53 140.744   9.607  10.543
  422   1HE   LYS  53           HE2      LYS  53 142.183  11.202   9.278
  423   2HE   LYS  53           HE1      LYS  53 142.614   9.519   8.972
  424   1HZ   LYS  53           HZ2      LYS  53 140.604  10.364   7.170
  425   2HZ   LYS  53           HZ1      LYS  53 141.920  11.438   7.108
  426   3HZ   LYS  53           HZ3      LYS  53 142.164   9.782   6.833
  427    H    LYS  54           HN       LYS  54 136.383   5.303   7.958
  428    HA   LYS  54           HA       LYS  54 134.467   4.288   8.823
  429   1HB   LYS  54           HB2      LYS  54 135.897   4.613  11.481
  430   2HB   LYS  54           HB1      LYS  54 134.564   3.516  11.136
  431   1HG   LYS  54           HG2      LYS  54 135.946   2.346   9.465
  432   2HG   LYS  54           HG1      LYS  54 137.283   3.443   9.798
  433   1HD   LYS  54           HD2      LYS  54 137.325   2.678  12.146
  434   2HD   LYS  54           HD1      LYS  54 135.998   1.569  11.803
  435   1HE   LYS  54           HE2      LYS  54 138.678   1.518  10.390
  436   2HE   LYS  54           HE1      LYS  54 138.232   0.452  11.723
  437   1HZ   LYS  54           HZ1      LYS  54 136.197  -0.046  10.220
  438   2HZ   LYS  54           HZ3      LYS  54 137.194   0.528   8.973
  439   3HZ   LYS  54           HZ2      LYS  54 137.683  -0.807   9.905
  440    H    ASP  55           HN       ASP  55 134.791   7.400   8.869
  441    HA   ASP  55           HA       ASP  55 133.195   8.271  11.122
  442   1HB   ASP  55           HB2      ASP  55 133.798   9.512   8.428
  443   2HB   ASP  55           HB1      ASP  55 132.775  10.309   9.624
  444    H    GLU  56           HN       GLU  56 131.230   7.296  11.384
  445    HA   GLU  56           HA       GLU  56 129.619   6.230   9.295
  446   1HB   GLU  56           HB2      GLU  56 129.512   5.542  11.673
  447   2HB   GLU  56           HB1      GLU  56 128.781   7.095  12.071
  448   1HG   GLU  56           HG2      GLU  56 126.887   6.595  10.568
  449   2HG   GLU  56           HG1      GLU  56 127.620   5.041  10.163
  450    H    ASP  57           HN       ASP  57 129.428   9.390  10.942
  451    HA   ASP  57           HA       ASP  57 126.941  10.155   9.691
  452   1HB   ASP  57           HB2      ASP  57 129.155  11.770  10.977
  453   2HB   ASP  57           HB1      ASP  57 127.656  12.487  10.384
  454    H    LEU  58           HN       LEU  58 130.325  10.661   8.861
  455    HA   LEU  58           HA       LEU  58 129.734  12.376   6.590
  456   1HB   LEU  58           HB2      LEU  58 132.184  10.729   7.267
  457   2HB   LEU  58           HB1      LEU  58 132.094  11.805   5.877
  458    HG   LEU  58           HG       LEU  58 131.655  12.669   8.753
  459   1HD1  LEU  58          HD11      LEU  58 134.065  12.953   6.933
  460   2HD1  LEU  58          HD13      LEU  58 133.887  13.753   8.495
  461   3HD1  LEU  58          HD12      LEU  58 133.974  11.995   8.411
  462   1HD2  LEU  58          HD23      LEU  58 131.551  14.066   6.091
  463   2HD2  LEU  58          HD22      LEU  58 130.563  14.318   7.529
  464   3HD2  LEU  58          HD21      LEU  58 132.200  14.957   7.467
  465    H    PHE  59           HN       PHE  59 130.187   8.893   6.998
  466    HA   PHE  59           HA       PHE  59 130.144   8.225   4.206
  467   1HB   PHE  59           HB2      PHE  59 130.891   6.609   5.872
  468   2HB   PHE  59           HB1      PHE  59 129.306   6.622   6.642
  469    HD1  PHE  59           HD1      PHE  59 130.936   5.982   3.324
  470    HD2  PHE  59           HD2      PHE  59 127.692   5.049   5.982
  471    HE1  PHE  59           HE1      PHE  59 130.185   4.189   1.782
  472    HE2  PHE  59           HE2      PHE  59 126.940   3.259   4.439
  473    HZ   PHE  59           HZ       PHE  59 128.188   2.828   2.339
  474    H    ARG  60           HN       ARG  60 127.551   8.491   6.640
  475    HA   ARG  60           HA       ARG  60 125.422   7.599   4.991
  476   1HB   ARG  60           HB2      ARG  60 125.470   9.553   7.299
  477   2HB   ARG  60           HB1      ARG  60 123.977   9.018   6.527
  478   1HG   ARG  60           HG2      ARG  60 124.426   6.719   7.103
  479   2HG   ARG  60           HG1      ARG  60 126.028   7.126   7.705
  480   1HD   ARG  60           HD2      ARG  60 124.403   6.865   9.556
  481   2HD   ARG  60           HD1      ARG  60 125.019   8.515   9.470
  482    HE   ARG  60           HE       ARG  60 122.726   8.593   7.922
  483   1HH1  ARG  60          HH21      ARG  60 123.543   7.539  11.102
  484   2HH1  ARG  60          HH22      ARG  60 121.994   7.927  11.770
  485   1HH2  ARG  60          HH11      ARG  60 120.703   9.108   8.776
  486   2HH2  ARG  60          HH12      ARG  60 120.384   8.816  10.454
  487    H    GLU  61           HN       GLU  61 126.608  10.968   5.489
  488    HA   GLU  61           HA       GLU  61 124.672  12.143   3.739
  489   1HB   GLU  61           HB2      GLU  61 127.462  13.019   4.537
  490   2HB   GLU  61           HB1      GLU  61 126.376  14.010   3.563
  491   1HG   GLU  61           HG2      GLU  61 125.622  12.906   6.278
  492   2HG   GLU  61           HG1      GLU  61 126.316  14.511   6.044
  493    H    TRP  62           HN       TRP  62 127.903  10.772   3.176
  494    HA   TRP  62           HA       TRP  62 128.093  11.545   0.433
  495   1HB   TRP  62           HB2      TRP  62 130.081  10.813   1.567
  496   2HB   TRP  62           HB1      TRP  62 129.350   9.259   1.966
  497    HD1  TRP  62           HD1      TRP  62 130.752  11.242  -0.997
  498    HE1  TRP  62           HE1      TRP  62 131.266   9.605  -2.923
  499    HE3  TRP  62           HE3      TRP  62 128.788   6.945   0.951
  500    HZ2  TRP  62           HZ2      TRP  62 130.883   6.833  -3.556
  501    HZ3  TRP  62           HZ3      TRP  62 128.887   4.828  -0.329
  502    HH2  TRP  62           HH2      TRP  62 129.927   4.767  -2.577
  503    H    LEU  63           HN       LEU  63 126.944   8.474   1.876
  504    HA   LEU  63           HA       LEU  63 126.387   7.274  -0.671
  505   1HB   LEU  63           HB2      LEU  63 126.709   5.939   1.365
  506   2HB   LEU  63           HB1      LEU  63 125.255   6.641   2.067
  507    HG   LEU  63           HG       LEU  63 123.896   5.656   0.263
  508   1HD1  LEU  63          HD13      LEU  63 126.602   4.831  -0.764
  509   2HD1  LEU  63          HD12      LEU  63 125.197   3.827  -1.119
  510   3HD1  LEU  63          HD11      LEU  63 125.236   5.506  -1.649
  511   1HD2  LEU  63          HD22      LEU  63 125.753   3.703   1.651
  512   2HD2  LEU  63          HD21      LEU  63 124.248   4.353   2.303
  513   3HD2  LEU  63          HD23      LEU  63 124.212   3.270   0.910
  514    H    LYS  64           HN       LYS  64 124.272   8.922   1.671
  515    HA   LYS  64           HA       LYS  64 121.879   8.555   0.121
  516   1HB   LYS  64           HB2      LYS  64 121.954   9.234   2.551
  517   2HB   LYS  64           HB1      LYS  64 122.430  10.848   2.020
  518   1HG   LYS  64           HG2      LYS  64 120.380  11.009   0.654
  519   2HG   LYS  64           HG1      LYS  64 119.898   9.400   1.188
  520   1HD   LYS  64           HD2      LYS  64 120.329  11.792   3.001
  521   2HD   LYS  64           HD1      LYS  64 118.763  11.165   2.492
  522   1HE   LYS  64           HE2      LYS  64 118.978  10.084   4.537
  523   2HE   LYS  64           HE1      LYS  64 119.740   8.887   3.491
  524   1HZ   LYS  64           HZ2      LYS  64 121.640  10.828   4.229
  525   2HZ   LYS  64           HZ1      LYS  64 120.873  10.255   5.633
  526   3HZ   LYS  64           HZ3      LYS  64 121.632   9.165   4.579
  527    H    ASP  65           HN       ASP  65 124.264  11.170   0.245
  528    HA   ASP  65           HA       ASP  65 122.899  12.860  -1.658
  529   1HB   ASP  65           HB2      ASP  65 125.793  12.748  -0.764
  530   2HB   ASP  65           HB1      ASP  65 125.153  13.981  -1.847
  531    H    THR  66           HN       THR  66 125.223  10.237  -1.910
  532    HA   THR  66           HA       THR  66 125.842  10.739  -4.695
  533    HB   THR  66           HB       THR  66 126.279   8.256  -3.014
  534    HG1  THR  66           HG1      THR  66 127.919  10.475  -3.668
  535   1HG2  THR  66          HG22      THR  66 127.407   9.133  -5.687
  536   2HG2  THR  66          HG21      THR  66 128.031   7.783  -4.741
  537   3HG2  THR  66          HG23      THR  66 126.392   7.723  -5.386
  538    H    CYS  67           HN       CYS  67 123.528   8.564  -3.030
  539    HA   CYS  67           HA       CYS  67 122.369   7.968  -5.740
  540   1HB   CYS  67           HB2      CYS  67 122.052   5.681  -5.149
  541   2HB   CYS  67           HB1      CYS  67 123.724   6.069  -4.744
  542    HG   CYS  67           HG       CYS  67 122.636   6.527  -2.218
  543    H    GLY  68           HN       GLY  68 121.724   8.236  -2.246
  544   1HA   GLY  68           HA2      GLY  68 119.668   9.489  -1.602
  545   2HA   GLY  68           HA1      GLY  68 118.823   8.659  -2.908
  546    H    ALA  69           HN       ALA  69 121.117   6.782  -1.117
  547    HA   ALA  69           HA       ALA  69 119.303   4.765  -0.385
  548   1HB   ALA  69           HB1      ALA  69 121.853   4.675  -0.343
  549   2HB   ALA  69           HB3      ALA  69 121.762   5.487   1.220
  550   3HB   ALA  69           HB2      ALA  69 121.038   3.893   1.012
  551    H    ASN  70           HN       ASN  70 118.282   4.251   1.654
  552    HA   ASN  70           HA       ASN  70 117.463   6.661   3.161
  553   1HB   ASN  70           HB2      ASN  70 116.540   3.778   3.390
  554   2HB   ASN  70           HB1      ASN  70 115.784   5.176   4.156
  555   1HD2  ASN  70          HD22      ASN  70 114.755   6.486   0.843
  556   2HD2  ASN  70          HD21      ASN  70 115.624   7.065   2.182
  557    H    ALA  71           HN       ALA  71 117.265   6.333   5.606
  558    HA   ALA  71           HA       ALA  71 119.835   5.963   6.745
  559   1HB   ALA  71           HB3      ALA  71 117.867   7.262   7.712
  560   2HB   ALA  71           HB2      ALA  71 117.237   5.710   8.265
  561   3HB   ALA  71           HB1      ALA  71 118.789   6.297   8.861
  562    H    LYS  72           HN       LYS  72 117.174   3.643   6.332
  563    HA   LYS  72           HA       LYS  72 118.280   1.691   8.150
  564   1HB   LYS  72           HB2      LYS  72 115.899   1.734   7.331
  565   2HB   LYS  72           HB1      LYS  72 116.482   1.177   5.763
  566   1HG   LYS  72           HG2      LYS  72 117.462  -0.823   6.849
  567   2HG   LYS  72           HG1      LYS  72 116.833  -0.275   8.403
  568   1HD   LYS  72           HD2      LYS  72 115.138  -0.887   5.963
  569   2HD   LYS  72           HD1      LYS  72 115.349  -1.965   7.339
  570   1HE   LYS  72           HE2      LYS  72 114.545   0.141   8.731
  571   2HE   LYS  72           HE1      LYS  72 113.852   0.635   7.185
  572   1HZ   LYS  72           HZ3      LYS  72 112.945  -1.751   7.138
  573   2HZ   LYS  72           HZ2      LYS  72 113.246  -1.745   8.809
  574   3HZ   LYS  72           HZ1      LYS  72 112.179  -0.611   8.132
  575    H    GLN  73           HN       GLN  73 118.558   2.184   4.648
  576    HA   GLN  73           HA       GLN  73 120.086  -0.186   4.149
  577   1HB   GLN  73           HB2      GLN  73 119.951   2.424   2.610
  578   2HB   GLN  73           HB1      GLN  73 120.679   0.936   2.005
  579   1HG   GLN  73           HG2      GLN  73 117.789   1.203   2.885
  580   2HG   GLN  73           HG1      GLN  73 118.333   1.247   1.210
  581   1HE2  GLN  73          HE22      GLN  73 117.472  -2.297   2.586
  582   2HE2  GLN  73          HE21      GLN  73 116.735  -0.822   2.990
  583    H    SER  74           HN       SER  74 121.040   3.128   4.999
  584    HA   SER  74           HA       SER  74 123.832   2.723   4.525
  585   1HB   SER  74           HB2      SER  74 122.641   4.949   4.831
  586   2HB   SER  74           HB1      SER  74 122.638   4.610   6.561
  587    HG   SER  74           HG       SER  74 125.037   4.137   5.980
  588    H    ARG  75           HN       ARG  75 121.781   2.193   7.401
  589    HA   ARG  75           HA       ARG  75 123.886   1.734   9.254
  590   1HB   ARG  75           HB2      ARG  75 121.084   0.594   9.089
  591   2HB   ARG  75           HB1      ARG  75 122.160   0.323  10.460
  592   1HG   ARG  75           HG2      ARG  75 122.264   2.682  10.940
  593   2HG   ARG  75           HG1      ARG  75 121.408   3.076   9.450
  594   1HD   ARG  75           HD2      ARG  75 119.931   3.135  11.473
  595   2HD   ARG  75           HD1      ARG  75 119.393   1.976  10.258
  596    HE   ARG  75           HE       ARG  75 121.021   0.482  11.936
  597   1HH1  ARG  75          HH21      ARG  75 118.288   2.557  12.275
  598   2HH1  ARG  75          HH22      ARG  75 117.669   1.734  13.667
  599   1HH2  ARG  75          HH11      ARG  75 120.228  -0.605  13.748
  600   2HH2  ARG  75          HH12      ARG  75 118.768  -0.057  14.503
  601    H    ASP  76           HN       ASP  76 122.291  -0.477   6.953
  602    HA   ASP  76           HA       ASP  76 123.605  -2.834   7.890
  603   1HB   ASP  76           HB2      ASP  76 122.420  -2.113   5.200
  604   2HB   ASP  76           HB1      ASP  76 123.039  -3.720   5.585
  605    H    CYS  77           HN       CYS  77 124.555  -0.443   5.391
  606    HA   CYS  77           HA       CYS  77 126.835  -1.963   4.506
  607   1HB   CYS  77           HB2      CYS  77 126.137   0.978   4.335
  608   2HB   CYS  77           HB1      CYS  77 127.574   0.282   3.589
  609    HG   CYS  77           HG       CYS  77 124.996  -1.159   2.784
  610    H    PHE  78           HN       PHE  78 126.433   0.604   6.980
  611    HA   PHE  78           HA       PHE  78 129.206   0.973   7.479
  612   1HB   PHE  78           HB2      PHE  78 127.491   2.479   8.380
  613   2HB   PHE  78           HB1      PHE  78 126.886   1.187   9.416
  614    HD1  PHE  78           HD1      PHE  78 129.657   3.540   8.820
  615    HD2  PHE  78           HD2      PHE  78 128.139   0.432  11.365
  616    HE1  PHE  78           HE1      PHE  78 131.337   4.133  10.544
  617    HE2  PHE  78           HE2      PHE  78 129.820   1.023  13.089
  618    HZ   PHE  78           HZ       PHE  78 131.420   2.873  12.678
  619    H    GLY  79           HN       GLY  79 126.940  -0.994   9.437
  620   1HA   GLY  79           HA2      GLY  79 128.958  -2.259  10.976
  621   2HA   GLY  79           HA1      GLY  79 127.343  -2.918  10.712
  622    H    CYS  80           HN       CYS  80 127.692  -3.000   7.779
  623    HA   CYS  80           HA       CYS  80 128.852  -5.649   7.623
  624   1HB   CYS  80           HB2      CYS  80 127.039  -4.871   6.119
  625   2HB   CYS  80           HB1      CYS  80 128.167  -3.744   5.367
  626    HG   CYS  80           HG       CYS  80 128.568  -6.850   5.253
  627    H    LEU  81           HN       LEU  81 129.969  -2.461   6.313
  628    HA   LEU  81           HA       LEU  81 132.481  -3.594   5.429
  629   1HB   LEU  81           HB2      LEU  81 131.733  -0.711   6.025
  630   2HB   LEU  81           HB1      LEU  81 133.166  -1.237   5.142
  631    HG   LEU  81           HG       LEU  81 130.293  -1.735   4.299
  632   1HD1  LEU  81          HD13      LEU  81 131.039   0.627   4.090
  633   2HD1  LEU  81          HD12      LEU  81 132.417   0.091   3.130
  634   3HD1  LEU  81          HD11      LEU  81 130.777  -0.122   2.516
  635   1HD2  LEU  81          HD23      LEU  81 132.965  -2.624   3.219
  636   2HD2  LEU  81          HD22      LEU  81 131.457  -3.530   3.348
  637   3HD2  LEU  81          HD21      LEU  81 131.646  -2.312   2.091
  638    H    ARG  82           HN       ARG  82 131.437  -1.847   8.354
  639    HA   ARG  82           HA       ARG  82 134.022  -1.563   9.518
  640   1HB   ARG  82           HB2      ARG  82 132.053  -0.346  10.354
  641   2HB   ARG  82           HB1      ARG  82 131.340  -1.863  10.903
  642   1HG   ARG  82           HG2      ARG  82 133.218  -2.215  12.450
  643   2HG   ARG  82           HG1      ARG  82 133.994  -0.745  11.864
  644   1HD   ARG  82           HD2      ARG  82 132.175   0.616  12.714
  645   2HD   ARG  82           HD1      ARG  82 131.259  -0.826  13.163
  646    HE   ARG  82           HE       ARG  82 133.630  -1.123  14.544
  647   1HH1  ARG  82          HH21      ARG  82 131.266   1.362  14.193
  648   2HH1  ARG  82          HH22      ARG  82 131.496   1.988  15.792
  649   1HH2  ARG  82          HH11      ARG  82 133.940  -0.324  16.630
  650   2HH2  ARG  82          HH12      ARG  82 133.008   1.031  17.174
  651    H    GLU  83           HN       GLU  83 131.641  -4.202   9.800
  652    HA   GLU  83           HA       GLU  83 133.213  -5.679  11.707
  653   1HB   GLU  83           HB2      GLU  83 130.932  -6.485   9.892
  654   2HB   GLU  83           HB1      GLU  83 131.690  -7.594  11.042
  655   1HG   GLU  83           HG2      GLU  83 131.130  -6.129  12.899
  656   2HG   GLU  83           HG1      GLU  83 130.492  -4.912  11.797
  657    H    TRP  84           HN       TRP  84 133.081  -5.733   8.145
  658    HA   TRP  84           HA       TRP  84 134.628  -8.095   7.771
  659   1HB   TRP  84           HB2      TRP  84 133.468  -6.769   5.944
  660   2HB   TRP  84           HB1      TRP  84 134.773  -5.588   6.065
  661    HD1  TRP  84           HD1      TRP  84 134.003  -9.109   4.889
  662    HE1  TRP  84           HE1      TRP  84 135.990  -9.991   3.484
  663    HE3  TRP  84           HE3      TRP  84 137.416  -5.395   5.717
  664    HZ2  TRP  84           HZ2      TRP  84 138.638  -9.244   2.816
  665    HZ3  TRP  84           HZ3      TRP  84 139.666  -5.511   4.681
  666    HH2  TRP  84           HH2      TRP  84 140.283  -7.430   3.230
  667    H    CYS  85           HN       CYS  85 135.527  -4.744   8.389
  668    HA   CYS  85           HA       CYS  85 138.368  -5.048   8.127
  669   1HB   CYS  85           HB2      CYS  85 136.664  -3.161   9.774
  670   2HB   CYS  85           HB1      CYS  85 138.423  -3.058   9.742
  671    HG   CYS  85           HG       CYS  85 137.909  -2.961   6.957
  672    H    ASP  86           HN       ASP  86 136.155  -5.513  10.849
  673    HA   ASP  86           HA       ASP  86 138.100  -6.018  12.863
  674   1HB   ASP  86           HB2      ASP  86 135.250  -6.983  12.548
  675   2HB   ASP  86           HB1      ASP  86 136.218  -7.287  13.987
  676    H    ALA  87           HN       ALA  87 136.607  -8.192  10.473
  677    HA   ALA  87           HA       ALA  87 137.979 -10.527  11.629
  678   1HB   ALA  87           HB1      ALA  87 136.325 -10.253   9.104
  679   2HB   ALA  87           HB3      ALA  87 136.896 -11.770   9.793
  680   3HB   ALA  87           HB2      ALA  87 135.726 -10.788  10.675
  681    H    PHE  88           HN       PHE  88 138.239  -8.523   8.698
  682    HA   PHE  88           HA       PHE  88 140.687 -10.061   7.926
  683   1HB   PHE  88           HB2      PHE  88 138.967  -8.095   6.393
  684   2HB   PHE  88           HB1      PHE  88 140.423  -8.858   5.752
  685    HD1  PHE  88           HD2      PHE  88 140.508 -11.305   5.385
  686    HD2  PHE  88           HD1      PHE  88 136.908  -9.345   6.676
  687    HE1  PHE  88           HE2      PHE  88 139.196 -13.321   4.784
  688    HE2  PHE  88           HE1      PHE  88 135.594 -11.366   6.074
  689    HZ   PHE  88           HZ       PHE  88 136.740 -13.351   5.127
  690    H    LEU  89           HN       LEU  89 140.043  -6.680   7.091
  691    HA   LEU  89           HA       LEU  89 142.743  -5.983   7.989
  692   1HB   LEU  89           HB2      LEU  89 142.009  -4.997   5.917
  693   2HB   LEU  89           HB1      LEU  89 140.517  -4.418   6.650
  694    HG   LEU  89           HG       LEU  89 141.746  -2.819   8.020
  695   1HD1  LEU  89          HD11      LEU  89 144.165  -4.227   6.875
  696   2HD1  LEU  89          HD13      LEU  89 144.265  -2.614   7.583
  697   3HD1  LEU  89          HD12      LEU  89 143.753  -3.979   8.573
  698   1HD2  LEU  89          HD21      LEU  89 141.254  -2.373   5.518
  699   2HD2  LEU  89          HD23      LEU  89 142.425  -1.322   6.317
  700   3HD2  LEU  89          HD22      LEU  89 142.981  -2.627   5.268
  701   1H    MET   1           HT1      MET   1 168.129  -4.674  -4.888
  702   2H    MET   1           HT3      MET   1 168.946  -4.924  -6.353
  703   3H    MET   1           HT2      MET   1 167.422  -4.176  -6.350
  704    HA   MET   1           HA       MET   1 166.530  -6.156  -6.721
  705   1HB   MET   1           HB2      MET   1 167.884  -8.198  -6.724
  706   2HB   MET   1           HB1      MET   1 168.772  -6.894  -7.512
  707   1HG   MET   1           HG2      MET   1 169.890  -6.440  -5.286
  708   2HG   MET   1           HG1      MET   1 169.152  -7.927  -4.691
  709   1HE   MET   1           HE3      MET   1 169.591 -10.140  -5.294
  710   2HE   MET   1           HE2      MET   1 169.284 -10.050  -7.027
  711   3HE   MET   1           HE1      MET   1 170.782 -10.770  -6.440
  712    H    THR   2           HN       THR   2 168.110  -5.504  -3.707
  713    HA   THR   2           HA       THR   2 166.378  -7.487  -2.281
  714    HB   THR   2           HB       THR   2 168.788  -7.606  -1.782
  715    HG1  THR   2           HG1      THR   2 168.562  -7.411   0.460
  716   1HG2  THR   2          HG22      THR   2 169.039  -5.038  -2.231
  717   2HG2  THR   2          HG21      THR   2 168.625  -4.879  -0.524
  718   3HG2  THR   2          HG23      THR   2 170.052  -5.794  -1.003
  719    H    THR   3           HN       THR   3 164.536  -6.679  -1.430
  720    HA   THR   3           HA       THR   3 164.151  -3.785  -1.168
  721    HB   THR   3           HB       THR   3 161.869  -4.387  -0.472
  722    HG1  THR   3           HG1      THR   3 163.035  -6.951  -0.371
  723   1HG2  THR   3          HG23      THR   3 162.455  -4.389  -2.888
  724   2HG2  THR   3          HG22      THR   3 162.827  -6.110  -2.774
  725   3HG2  THR   3          HG21      THR   3 161.177  -5.545  -2.510
  726    H    SER   4           HN       SER   4 163.429  -2.808   0.888
  727    HA   SER   4           HA       SER   4 165.148  -3.537   3.094
  728   1HB   SER   4           HB2      SER   4 164.117  -1.691   4.265
  729   2HB   SER   4           HB1      SER   4 164.342  -1.200   2.588
  730    HG   SER   4           HG       SER   4 162.271  -0.717   2.932
  731    H    GLN   5           HN       GLN   5 164.353  -4.098   5.256
  732    HA   GLN   5           HA       GLN   5 162.715  -6.409   5.267
  733   1HB   GLN   5           HB2      GLN   5 164.406  -5.861   7.010
  734   2HB   GLN   5           HB1      GLN   5 163.341  -4.589   7.607
  735   1HG   GLN   5           HG2      GLN   5 161.585  -6.269   8.058
  736   2HG   GLN   5           HG1      GLN   5 162.650  -7.539   7.463
  737   1HE2  GLN   5          HE22      GLN   5 164.903  -6.349  10.389
  738   2HE2  GLN   5          HE21      GLN   5 164.985  -5.911   8.751
  739    H    LYS   6           HN       LYS   6 161.829  -3.017   5.525
  740    HA   LYS   6           HA       LYS   6 159.336  -3.285   6.848
  741   1HB   LYS   6           HB2      LYS   6 160.314  -1.339   4.748
  742   2HB   LYS   6           HB1      LYS   6 158.767  -1.170   5.580
  743   1HG   LYS   6           HG2      LYS   6 159.929  -1.132   7.749
  744   2HG   LYS   6           HG1      LYS   6 161.481  -1.298   6.924
  745   1HD   LYS   6           HD2      LYS   6 161.075   0.826   5.732
  746   2HD   LYS   6           HD1      LYS   6 159.529   0.996   6.563
  747   1HE   LYS   6           HE2      LYS   6 160.553   1.344   8.656
  748   2HE   LYS   6           HE1      LYS   6 162.090   0.660   8.125
  749   1HZ   LYS   6           HZ3      LYS   6 161.992   2.616   6.437
  750   2HZ   LYS   6           HZ2      LYS   6 160.942   3.307   7.579
  751   3HZ   LYS   6           HZ1      LYS   6 162.527   2.889   8.023
  752    H    HIS   7           HN       HIS   7 160.225  -3.637   3.423
  753    HA   HIS   7           HA       HIS   7 157.601  -3.795   2.375
  754   1HB   HIS   7           HB2      HIS   7 159.516  -3.628   0.891
  755   2HB   HIS   7           HB1      HIS   7 160.157  -5.160   1.481
  756    HD2  HIS   7           HD2      HIS   7 159.044  -7.446   0.291
  757    HE1  HIS   7           HE1      HIS   7 156.268  -5.443  -2.180
  758    HE2  HIS   7           HE2      HIS   7 157.317  -7.686  -1.647
  759    H    ARG   8           HN       ARG   8 159.706  -6.469   3.501
  760    HA   ARG   8           HA       ARG   8 157.684  -8.474   3.117
  761   1HB   ARG   8           HB2      ARG   8 160.233  -8.418   4.744
  762   2HB   ARG   8           HB1      ARG   8 159.210  -9.847   4.600
  763   1HG   ARG   8           HG2      ARG   8 159.451  -9.781   2.147
  764   2HG   ARG   8           HG1      ARG   8 160.479  -8.354   2.286
  765   1HD   ARG   8           HD2      ARG   8 161.073 -11.076   3.484
  766   2HD   ARG   8           HD1      ARG   8 161.841 -10.398   2.047
  767    HE   ARG   8           HE       ARG   8 162.292  -8.484   3.997
  768   1HH1  ARG   8          HH21      ARG   8 162.781 -11.878   3.660
  769   2HH1  ARG   8          HH22      ARG   8 164.179 -11.915   4.683
  770   1HH2  ARG   8          HH11      ARG   8 164.116  -8.510   5.334
  771   2HH2  ARG   8          HH12      ARG   8 164.934 -10.006   5.631
  772    H    ASP   9           HN       ASP   9 158.565  -6.373   5.807
  773    HA   ASP   9           HA       ASP   9 157.111  -7.758   7.856
  774   1HB   ASP   9           HB2      ASP   9 157.754  -4.820   7.508
  775   2HB   ASP   9           HB1      ASP   9 157.008  -5.486   8.956
  776    H    PHE  10           HN       PHE  10 156.231  -5.278   5.511
  777    HA   PHE  10           HA       PHE  10 153.601  -4.763   6.475
  778   1HB   PHE  10           HB2      PHE  10 154.979  -3.527   4.683
  779   2HB   PHE  10           HB1      PHE  10 154.392  -4.749   3.556
  780    HD1  PHE  10           HD1      PHE  10 153.092  -2.478   6.240
  781    HD2  PHE  10           HD2      PHE  10 152.401  -4.290   2.405
  782    HE1  PHE  10           HE1      PHE  10 150.966  -1.217   6.024
  783    HE2  PHE  10           HE2      PHE  10 150.278  -3.027   2.190
  784    HZ   PHE  10           HZ       PHE  10 149.563  -1.490   3.999
  785    H    VAL  11           HN       VAL  11 154.638  -6.999   3.864
  786    HA   VAL  11           HA       VAL  11 151.954  -8.225   3.790
  787    HB   VAL  11           HB       VAL  11 152.932  -9.601   1.966
  788   1HG1  VAL  11          HG12      VAL  11 152.134  -7.008   1.822
  789   2HG1  VAL  11          HG11      VAL  11 153.798  -6.814   1.282
  790   3HG1  VAL  11          HG13      VAL  11 152.711  -7.898   0.422
  791   1HG2  VAL  11          HG22      VAL  11 155.245  -9.684   2.875
  792   2HG2  VAL  11          HG21      VAL  11 155.227  -9.111   1.210
  793   3HG2  VAL  11          HG23      VAL  11 155.425  -7.967   2.533
  794    H    ALA  12           HN       ALA  12 154.389  -8.662   5.913
  795    HA   ALA  12           HA       ALA  12 154.223 -11.660   5.911
  796   1HB   ALA  12           HB3      ALA  12 156.042  -9.761   7.401
  797   2HB   ALA  12           HB2      ALA  12 155.991 -11.497   7.690
  798   3HB   ALA  12           HB1      ALA  12 156.490 -10.881   6.117
  799    H    GLU  13           HN       GLU  13 153.107  -8.827   7.507
  800    HA   GLU  13           HA       GLU  13 151.508 -10.498   9.343
  801   1HB   GLU  13           HB2      GLU  13 152.144  -8.894  11.246
  802   2HB   GLU  13           HB1      GLU  13 153.370 -10.071  10.776
  803   1HG   GLU  13           HG2      GLU  13 154.549  -8.420   9.461
  804   2HG   GLU  13           HG1      GLU  13 153.253  -7.245   9.689
  805    HA   PRO  14           HA       PRO  14 148.222  -7.671   8.359
  806   1HB   PRO  14           HB2      PRO  14 148.092  -7.132  11.321
  807   2HB   PRO  14           HB1      PRO  14 146.774  -7.491  10.185
  808   1HG   PRO  14           HG2      PRO  14 147.750  -9.353  11.853
  809   2HG   PRO  14           HG1      PRO  14 147.169  -9.756  10.227
  810   1HD   PRO  14           HD2      PRO  14 149.956  -9.716  11.250
  811   2HD   PRO  14           HD1      PRO  14 149.284 -10.563   9.839
  812    H    MET  15           HN       MET  15 147.823  -5.300   8.337
  813    HA   MET  15           HA       MET  15 150.328  -3.792   8.772
  814   1HB   MET  15           HB2      MET  15 148.883  -1.897   7.761
  815   2HB   MET  15           HB1      MET  15 149.312  -3.246   6.712
  816   1HG   MET  15           HG2      MET  15 147.155  -4.207   6.872
  817   2HG   MET  15           HG1      MET  15 146.741  -3.254   8.297
  818   1HE   MET  15           HE3      MET  15 147.961  -3.237   4.818
  819   2HE   MET  15           HE2      MET  15 146.281  -3.269   4.292
  820   3HE   MET  15           HE1      MET  15 147.262  -1.836   3.997
  821    H    GLY  16           HN       GLY  16 147.224  -4.249  10.252
  822   1HA   GLY  16           HA2      GLY  16 146.237  -3.289  12.143
  823   2HA   GLY  16           HA1      GLY  16 147.894  -3.167  12.731
  824    H    GLU  17           HN       GLU  17 147.781  -1.157  13.673
  825    HA   GLU  17           HA       GLU  17 146.825   1.146  12.035
  826   1HB   GLU  17           HB2      GLU  17 147.397   0.860  14.998
  827   2HB   GLU  17           HB1      GLU  17 146.848   2.348  14.223
  828   1HG   GLU  17           HG2      GLU  17 144.818   1.187  13.429
  829   2HG   GLU  17           HG1      GLU  17 145.363  -0.299  14.208
  830    H    LYS  18           HN       LYS  18 149.483  -0.153  11.660
  831    HA   LYS  18           HA       LYS  18 151.547   1.410  12.850
  832   1HB   LYS  18           HB2      LYS  18 151.424  -0.013  10.175
  833   2HB   LYS  18           HB1      LYS  18 152.890   0.759  10.777
  834   1HG   LYS  18           HG2      LYS  18 152.575  -0.661  12.899
  835   2HG   LYS  18           HG1      LYS  18 151.394  -1.584  11.968
  836   1HD   LYS  18           HD2      LYS  18 154.299  -1.142  11.208
  837   2HD   LYS  18           HD1      LYS  18 153.615  -2.640  11.841
  838   1HE   LYS  18           HE2      LYS  18 151.984  -2.525   9.844
  839   2HE   LYS  18           HE1      LYS  18 153.088  -1.323   9.175
  840   1HZ   LYS  18           HZ1      LYS  18 154.892  -3.004   9.552
  841   2HZ   LYS  18           HZ3      LYS  18 153.675  -4.143   9.866
  842   3HZ   LYS  18           HZ2      LYS  18 153.769  -3.401   8.340
  843    HA   PRO  19           HA       PRO  19 150.877   5.358  10.988
  844   1HB   PRO  19           HB2      PRO  19 153.448   6.364  10.874
  845   2HB   PRO  19           HB1      PRO  19 152.497   6.242  12.368
  846   1HG   PRO  19           HG2      PRO  19 154.621   4.418  11.327
  847   2HG   PRO  19           HG1      PRO  19 154.335   4.985  12.983
  848   1HD   PRO  19           HD2      PRO  19 153.572   2.509  12.157
  849   2HD   PRO  19           HD1      PRO  19 152.653   3.420  13.374
  850    H    VAL  20           HN       VAL  20 151.064   6.572   9.072
  851    HA   VAL  20           HA       VAL  20 151.199   5.195   6.650
  852    HB   VAL  20           HB       VAL  20 150.169   7.367   6.750
  853   1HG1  VAL  20          HG13      VAL  20 152.931   8.411   7.449
  854   2HG1  VAL  20          HG12      VAL  20 151.505   9.411   7.166
  855   3HG1  VAL  20          HG11      VAL  20 151.554   8.310   8.545
  856   1HG2  VAL  20          HG21      VAL  20 151.421   6.679   4.618
  857   2HG2  VAL  20          HG23      VAL  20 151.068   8.399   4.792
  858   3HG2  VAL  20          HG22      VAL  20 152.689   7.794   5.128
  859    H    GLY  21           HN       GLY  21 153.817   6.694   8.446
  860   1HA   GLY  21           HA2      GLY  21 155.780   6.595   6.344
  861   2HA   GLY  21           HA1      GLY  21 156.132   6.781   8.061
  862    H    SER  22           HN       SER  22 154.283   4.081   7.996
  863    HA   SER  22           HA       SER  22 156.646   2.348   8.195
  864   1HB   SER  22           HB2      SER  22 153.708   1.628   8.412
  865   2HB   SER  22           HB1      SER  22 155.072   0.642   8.930
  866    HG   SER  22           HG       SER  22 154.913   3.244   9.911
  867    H    LEU  23           HN       LEU  23 154.308   3.206   5.802
  868    HA   LEU  23           HA       LEU  23 154.276   0.796   4.263
  869   1HB   LEU  23           HB2      LEU  23 153.976   3.687   3.400
  870   2HB   LEU  23           HB1      LEU  23 153.638   2.306   2.361
  871    HG   LEU  23           HG       LEU  23 152.294   2.769   5.040
  872   1HD1  LEU  23          HD13      LEU  23 151.423   3.482   2.229
  873   2HD1  LEU  23          HD12      LEU  23 150.312   3.401   3.596
  874   3HD1  LEU  23          HD11      LEU  23 151.630   4.574   3.597
  875   1HD2  LEU  23          HD23      LEU  23 151.996   0.745   2.819
  876   2HD2  LEU  23          HD22      LEU  23 152.024   0.492   4.562
  877   3HD2  LEU  23          HD21      LEU  23 150.593   1.171   3.803
  878    H    ALA  24           HN       ALA  24 155.726  -0.063   2.871
  879    HA   ALA  24           HA       ALA  24 158.435   0.849   2.849
  880   1HB   ALA  24           HB3      ALA  24 156.855  -1.161   1.265
  881   2HB   ALA  24           HB2      ALA  24 158.510  -0.783   0.784
  882   3HB   ALA  24           HB1      ALA  24 158.184  -1.436   2.390
  883    H    GLY  25           HN       GLY  25 159.480   2.237   1.537
  884   1HA   GLY  25           HA2      GLY  25 159.886   3.348  -0.601
  885   2HA   GLY  25           HA1      GLY  25 158.173   3.177  -0.987
  886    H    ILE  26           HN       ILE  26 157.659   4.035   1.949
  887    HA   ILE  26           HA       ILE  26 157.723   6.968   1.374
  888    HB   ILE  26           HB       ILE  26 156.277   5.505   3.601
  889   1HG1  ILE  26          HG12      ILE  26 155.442   4.628   1.498
  890   2HG1  ILE  26          HG11      ILE  26 154.253   5.763   2.131
  891   1HG2  ILE  26          HG21      ILE  26 156.632   7.931   3.916
  892   2HG2  ILE  26          HG23      ILE  26 155.875   8.240   2.353
  893   3HG2  ILE  26          HG22      ILE  26 154.925   7.558   3.674
  894   1HD1  ILE  26          HD11      ILE  26 155.520   7.525   0.658
  895   2HD1  ILE  26          HD13      ILE  26 156.148   6.107  -0.183
  896   3HD1  ILE  26          HD12      ILE  26 154.411   6.399  -0.119
  897    H    GLY  27           HN       GLY  27 159.416   8.087   2.335
  898   1HA   GLY  27           HA2      GLY  27 160.810   6.849   4.635
  899   2HA   GLY  27           HA1      GLY  27 161.365   8.246   3.711
  900    H    GLU  28           HN       GLU  28 161.521   8.585   6.346
  901    HA   GLU  28           HA       GLU  28 159.229   9.404   7.771
  902   1HB   GLU  28           HB2      GLU  28 162.094  10.354   7.946
  903   2HB   GLU  28           HB1      GLU  28 160.847  10.832   9.098
  904   1HG   GLU  28           HG2      GLU  28 160.437   8.474   9.656
  905   2HG   GLU  28           HG1      GLU  28 161.657   7.974   8.483
  906    H    VAL  29           HN       VAL  29 161.278  11.349   5.574
  907    HA   VAL  29           HA       VAL  29 159.910  13.821   6.155
  908    HB   VAL  29           HB       VAL  29 161.558  12.929   3.772
  909   1HG1  VAL  29          HG13      VAL  29 160.323  15.616   4.421
  910   2HG1  VAL  29          HG12      VAL  29 161.685  15.433   3.316
  911   3HG1  VAL  29          HG11      VAL  29 160.139  14.673   2.941
  912   1HG2  VAL  29          HG23      VAL  29 162.111  14.676   6.189
  913   2HG2  VAL  29          HG22      VAL  29 162.841  13.115   5.821
  914   3HG2  VAL  29          HG21      VAL  29 163.209  14.518   4.817
  915    H    LEU  30           HN       LEU  30 159.479  11.342   3.665
  916    HA   LEU  30           HA       LEU  30 157.396  12.710   2.238
  917   1HB   LEU  30           HB2      LEU  30 157.946   9.731   2.454
  918   2HB   LEU  30           HB1      LEU  30 156.934  10.500   1.233
  919    HG   LEU  30           HG       LEU  30 159.901  10.995   1.640
  920   1HD1  LEU  30          HD11      LEU  30 158.350   9.503  -0.494
  921   2HD1  LEU  30          HD13      LEU  30 160.063   9.906  -0.613
  922   3HD1  LEU  30          HD12      LEU  30 159.499   8.816   0.654
  923   1HD2  LEU  30          HD23      LEU  30 157.816  12.263  -0.131
  924   2HD2  LEU  30          HD22      LEU  30 159.139  13.023   0.754
  925   3HD2  LEU  30          HD21      LEU  30 159.474  12.119  -0.719
  926    H    GLY  31           HN       GLY  31 157.378  10.455   4.958
  927   1HA   GLY  31           HA2      GLY  31 154.573   9.981   5.054
  928   2HA   GLY  31           HA1      GLY  31 155.651   9.895   6.447
  929    H    LYS  32           HN       LYS  32 156.542  12.604   6.431
  930    HA   LYS  32           HA       LYS  32 154.451  13.838   7.933
  931   1HB   LYS  32           HB2      LYS  32 156.846  14.383   8.226
  932   2HB   LYS  32           HB1      LYS  32 156.860  15.146   6.637
  933   1HG   LYS  32           HG2      LYS  32 155.146  16.761   7.397
  934   2HG   LYS  32           HG1      LYS  32 155.132  15.996   8.985
  935   1HD   LYS  32           HD2      LYS  32 157.518  16.558   9.274
  936   2HD   LYS  32           HD1      LYS  32 157.529  17.323   7.684
  937   1HE   LYS  32           HE2      LYS  32 155.888  18.968   8.410
  938   2HE   LYS  32           HE1      LYS  32 155.719  18.160   9.969
  939   1HZ   LYS  32           HZ3      LYS  32 158.119  18.584  10.327
  940   2HZ   LYS  32           HZ2      LYS  32 158.133  19.520   8.908
  941   3HZ   LYS  32           HZ1      LYS  32 157.185  19.997  10.234
  942    H    LYS  33           HN       LYS  33 155.441  14.308   4.519
  943    HA   LYS  33           HA       LYS  33 153.678  16.549   4.110
  944   1HB   LYS  33           HB2      LYS  33 154.913  14.566   2.185
  945   2HB   LYS  33           HB1      LYS  33 153.962  15.957   1.663
  946   1HG   LYS  33           HG2      LYS  33 155.506  17.467   2.855
  947   2HG   LYS  33           HG1      LYS  33 156.462  16.080   3.377
  948   1HD   LYS  33           HD2      LYS  33 156.924  15.511   1.020
  949   2HD   LYS  33           HD1      LYS  33 155.974  16.903   0.499
  950   1HE   LYS  33           HE2      LYS  33 157.518  18.384   1.798
  951   2HE   LYS  33           HE1      LYS  33 158.507  16.970   2.164
  952   1HZ   LYS  33           HZ2      LYS  33 157.882  17.262  -0.630
  953   2HZ   LYS  33           HZ1      LYS  33 158.800  18.548  -0.004
  954   3HZ   LYS  33           HZ3      LYS  33 159.374  16.957   0.124
  955    H    LEU  34           HN       LEU  34 153.251  13.040   3.544
  956    HA   LEU  34           HA       LEU  34 150.626  13.253   2.414
  957   1HB   LEU  34           HB2      LEU  34 151.868  11.006   4.035
  958   2HB   LEU  34           HB1      LEU  34 150.364  10.872   3.129
  959    HG   LEU  34           HG       LEU  34 153.016  11.643   1.882
  960   1HD1  LEU  34          HD11      LEU  34 152.997   9.324   2.832
  961   2HD1  LEU  34          HD13      LEU  34 151.604   8.961   1.814
  962   3HD1  LEU  34          HD12      LEU  34 153.157   9.357   1.077
  963   1HD2  LEU  34          HD21      LEU  34 150.232  11.114   0.831
  964   2HD2  LEU  34          HD23      LEU  34 151.357  12.402   0.404
  965   3HD2  LEU  34          HD22      LEU  34 151.627  10.768  -0.188
  966    H    GLU  35           HN       GLU  35 151.811  13.032   5.722
  967    HA   GLU  35           HA       GLU  35 149.282  12.765   7.020
  968   1HB   GLU  35           HB2      GLU  35 151.425  12.476   8.202
  969   2HB   GLU  35           HB1      GLU  35 151.769  14.196   8.012
  970   1HG   GLU  35           HG2      GLU  35 149.775  14.754   9.343
  971   2HG   GLU  35           HG1      GLU  35 149.394  13.039   9.506
  972    H    GLU  36           HN       GLU  36 151.053  15.659   5.970
  973    HA   GLU  36           HA       GLU  36 149.161  17.546   7.049
  974   1HB   GLU  36           HB2      GLU  36 151.479  18.151   6.369
  975   2HB   GLU  36           HB1      GLU  36 151.036  17.870   4.685
  976   1HG   GLU  36           HG2      GLU  36 149.390  19.644   4.757
  977   2HG   GLU  36           HG1      GLU  36 149.624  19.850   6.493
  978    H    ARG  37           HN       ARG  37 149.156  15.456   4.328
  979    HA   ARG  37           HA       ARG  37 147.068  16.990   2.893
  980   1HB   ARG  37           HB2      ARG  37 148.498  14.388   2.307
  981   2HB   ARG  37           HB1      ARG  37 147.185  14.999   1.307
  982   1HG   ARG  37           HG2      ARG  37 149.586  16.717   1.941
  983   2HG   ARG  37           HG1      ARG  37 149.633  15.558   0.615
  984   1HD   ARG  37           HD2      ARG  37 147.519  16.649  -0.282
  985   2HD   ARG  37           HD1      ARG  37 147.741  17.909   0.928
  986    HE   ARG  37           HE       ARG  37 150.180  17.812  -0.374
  987   1HH1  ARG  37          HH21      ARG  37 146.864  18.132  -1.269
  988   2HH1  ARG  37          HH22      ARG  37 147.198  19.095  -2.670
  989   1HH2  ARG  37          HH11      ARG  37 150.633  19.068  -2.202
  990   2HH2  ARG  37          HH12      ARG  37 149.329  19.624  -3.197
  991    H    GLY  38           HN       GLY  38 147.041  15.038   5.543
  992   1HA   GLY  38           HA2      GLY  38 144.981  14.393   6.610
  993   2HA   GLY  38           HA1      GLY  38 144.205  14.295   5.034
  994    H    PHE  39           HN       PHE  39 147.289  12.772   6.008
  995    HA   PHE  39           HA       PHE  39 145.970  10.089   5.815
  996   1HB   PHE  39           HB2      PHE  39 148.537  11.018   4.507
  997   2HB   PHE  39           HB1      PHE  39 148.060   9.324   4.628
  998    HD1  PHE  39           HD1      PHE  39 147.281  12.584   3.105
  999    HD2  PHE  39           HD2      PHE  39 146.201   8.440   3.324
 1000    HE1  PHE  39           HE1      PHE  39 145.849  12.857   1.099
 1001    HE2  PHE  39           HE2      PHE  39 144.766   8.708   1.317
 1002    HZ   PHE  39           HZ       PHE  39 144.588  10.917   0.206
 1003    H    ASP  40           HN       ASP  40 146.130  10.609   8.260
 1004    HA   ASP  40           HA       ASP  40 148.812  10.550   9.414
 1005   1HB   ASP  40           HB2      ASP  40 147.613  10.488  11.572
 1006   2HB   ASP  40           HB1      ASP  40 146.971  11.754  10.525
 1007    H    LYS  41           HN       LYS  41 146.625   8.158   8.282
 1008    HA   LYS  41           HA       LYS  41 148.193   6.038   9.720
 1009   1HB   LYS  41           HB2      LYS  41 145.227   6.000   9.088
 1010   2HB   LYS  41           HB1      LYS  41 146.132   4.691   9.839
 1011   1HG   LYS  41           HG2      LYS  41 145.960   7.472  11.028
 1012   2HG   LYS  41           HG1      LYS  41 144.840   6.181  11.447
 1013   1HD   LYS  41           HD2      LYS  41 146.900   4.779  12.046
 1014   2HD   LYS  41           HD1      LYS  41 147.824   6.278  11.937
 1015   1HE   LYS  41           HE2      LYS  41 146.355   7.319  13.615
 1016   2HE   LYS  41           HE1      LYS  41 145.431   5.822  13.736
 1017   1HZ   LYS  41           HZ3      LYS  41 148.340   5.730  14.112
 1018   2HZ   LYS  41           HZ2      LYS  41 147.371   6.316  15.380
 1019   3HZ   LYS  41           HZ1      LYS  41 147.135   4.742  14.782
 1020    H    ALA  42           HN       ALA  42 148.550   4.134   8.540
 1021    HA   ALA  42           HA       ALA  42 148.972   4.484   5.734
 1022   1HB   ALA  42           HB1      ALA  42 150.243   2.927   7.243
 1023   2HB   ALA  42           HB3      ALA  42 148.840   1.861   7.233
 1024   3HB   ALA  42           HB2      ALA  42 149.708   2.190   5.733
 1025    H    TYR  43           HN       TYR  43 146.385   2.757   7.501
 1026    HA   TYR  43           HA       TYR  43 145.244   1.504   5.237
 1027   1HB   TYR  43           HB2      TYR  43 143.200   1.246   6.505
 1028   2HB   TYR  43           HB1      TYR  43 144.576   0.979   7.568
 1029    HD1  TYR  43           HD1      TYR  43 142.090   3.554   6.500
 1030    HD2  TYR  43           HD2      TYR  43 144.857   2.269   9.523
 1031    HE1  TYR  43           HE1      TYR  43 141.238   5.312   8.025
 1032    HE2  TYR  43           HE2      TYR  43 144.003   4.027  11.050
 1033    HH   TYR  43           HH       TYR  43 141.139   5.648  10.563
 1034    H    VAL  44           HN       VAL  44 145.259   4.869   6.017
 1035    HA   VAL  44           HA       VAL  44 142.880   5.476   4.393
 1036    HB   VAL  44           HB       VAL  44 145.101   7.310   5.379
 1037   1HG1  VAL  44          HG12      VAL  44 143.877   8.205   3.417
 1038   2HG1  VAL  44          HG11      VAL  44 142.352   7.934   4.253
 1039   3HG1  VAL  44          HG13      VAL  44 143.499   9.117   4.875
 1040   1HG2  VAL  44          HG22      VAL  44 142.329   6.704   6.456
 1041   2HG2  VAL  44          HG21      VAL  44 143.865   6.334   7.237
 1042   3HG2  VAL  44          HG23      VAL  44 143.362   8.010   7.039
 1043    H    VAL  45           HN       VAL  45 146.315   5.220   4.071
 1044    HA   VAL  45           HA       VAL  45 146.490   6.287   1.356
 1045    HB   VAL  45           HB       VAL  45 148.399   4.625   3.033
 1046   1HG1  VAL  45          HG11      VAL  45 148.674   5.807   0.265
 1047   2HG1  VAL  45          HG13      VAL  45 150.078   5.443   1.268
 1048   3HG1  VAL  45          HG12      VAL  45 148.984   4.148   0.777
 1049   1HG2  VAL  45          HG21      VAL  45 148.189   7.565   2.349
 1050   2HG2  VAL  45          HG23      VAL  45 148.168   6.823   3.947
 1051   3HG2  VAL  45          HG22      VAL  45 149.660   6.846   3.005
 1052    H    LEU  46           HN       LEU  46 146.183   3.130   2.897
 1053    HA   LEU  46           HA       LEU  46 146.523   1.476   0.590
 1054   1HB   LEU  46           HB2      LEU  46 146.384   0.614   2.937
 1055   2HB   LEU  46           HB1      LEU  46 144.688   1.073   2.985
 1056    HG   LEU  46           HG       LEU  46 144.378  -0.441   0.929
 1057   1HD1  LEU  46          HD12      LEU  46 147.179  -1.183   1.753
 1058   2HD1  LEU  46          HD11      LEU  46 146.127  -2.340   0.942
 1059   3HD1  LEU  46          HD13      LEU  46 146.559  -0.830   0.141
 1060   1HD2  LEU  46          HD23      LEU  46 145.001  -1.403   3.708
 1061   2HD2  LEU  46          HD22      LEU  46 143.439  -1.238   2.917
 1062   3HD2  LEU  46          HD21      LEU  46 144.522  -2.547   2.453
 1063    H    GLY  47           HN       GLY  47 143.806   3.251   1.933
 1064   1HA   GLY  47           HA2      GLY  47 141.732   2.260   0.257
 1065   2HA   GLY  47           HA1      GLY  47 141.721   3.842   1.035
 1066    H    GLN  48           HN       GLN  48 144.003   4.997  -0.242
 1067    HA   GLN  48           HA       GLN  48 142.847   5.926  -2.682
 1068   1HB   GLN  48           HB2      GLN  48 144.608   7.140  -1.380
 1069   2HB   GLN  48           HB1      GLN  48 145.781   5.929  -1.893
 1070   1HG   GLN  48           HG2      GLN  48 145.957   7.855  -3.365
 1071   2HG   GLN  48           HG1      GLN  48 145.265   6.516  -4.277
 1072   1HE2  GLN  48          HE21      GLN  48 143.565   7.233  -5.566
 1073   2HE2  GLN  48          HE22      GLN  48 142.453   8.440  -5.134
 1074    H    PHE  49           HN       PHE  49 145.338   3.472  -2.035
 1075    HA   PHE  49           HA       PHE  49 145.946   2.791  -4.735
 1076   1HB   PHE  49           HB2      PHE  49 147.275   2.057  -2.790
 1077   2HB   PHE  49           HB1      PHE  49 145.933   1.055  -2.245
 1078    HD1  PHE  49           HD1      PHE  49 148.205   1.599  -5.175
 1079    HD2  PHE  49           HD2      PHE  49 145.746  -1.161  -2.989
 1080    HE1  PHE  49           HE1      PHE  49 149.033  -0.262  -6.591
 1081    HE2  PHE  49           HE2      PHE  49 146.570  -3.019  -4.402
 1082    HZ   PHE  49           HZ       PHE  49 148.215  -2.572  -6.204
 1083    H    LEU  50           HN       LEU  50 143.467   1.623  -2.514
 1084    HA   LEU  50           HA       LEU  50 142.413  -0.383  -4.327
 1085   1HB   LEU  50           HB2      LEU  50 141.084   1.087  -2.031
 1086   2HB   LEU  50           HB1      LEU  50 140.375  -0.291  -2.869
 1087    HG   LEU  50           HG       LEU  50 143.060  -0.345  -1.451
 1088   1HD1  LEU  50          HD13      LEU  50 140.993  -0.027   0.013
 1089   2HD1  LEU  50          HD12      LEU  50 140.472  -1.618  -0.533
 1090   3HD1  LEU  50          HD11      LEU  50 141.975  -1.443   0.374
 1091   1HD2  LEU  50          HD22      LEU  50 141.427  -2.371  -2.974
 1092   2HD2  LEU  50          HD21      LEU  50 143.169  -2.102  -2.992
 1093   3HD2  LEU  50          HD23      LEU  50 142.419  -2.917  -1.624
 1094    H    VAL  51           HN       VAL  51 141.703   3.023  -3.744
 1095    HA   VAL  51           HA       VAL  51 139.426   3.182  -5.486
 1096    HB   VAL  51           HB       VAL  51 141.363   5.277  -4.477
 1097   1HG1  VAL  51          HG12      VAL  51 138.903   5.524  -6.215
 1098   2HG1  VAL  51          HG11      VAL  51 139.440   6.853  -5.187
 1099   3HG1  VAL  51          HG13      VAL  51 140.494   6.243  -6.464
 1100   1HG2  VAL  51          HG23      VAL  51 139.792   4.032  -2.896
 1101   2HG2  VAL  51          HG22      VAL  51 139.632   5.788  -2.903
 1102   3HG2  VAL  51          HG21      VAL  51 138.460   4.792  -3.767
 1103    H    LEU  52           HN       LEU  52 142.900   3.349  -6.081
 1104    HA   LEU  52           HA       LEU  52 142.529   4.398  -8.802
 1105   1HB   LEU  52           HB2      LEU  52 144.964   3.353  -7.332
 1106   2HB   LEU  52           HB1      LEU  52 145.006   4.053  -8.948
 1107    HG   LEU  52           HG       LEU  52 143.919   5.504  -6.516
 1108   1HD1  LEU  52          HD13      LEU  52 146.675   5.480  -7.758
 1109   2HD1  LEU  52          HD12      LEU  52 146.115   6.794  -6.725
 1110   3HD1  LEU  52          HD11      LEU  52 146.241   5.158  -6.080
 1111   1HD2  LEU  52          HD23      LEU  52 144.430   6.242  -9.398
 1112   2HD2  LEU  52          HD22      LEU  52 143.034   6.609  -8.388
 1113   3HD2  LEU  52          HD21      LEU  52 144.541   7.484  -8.151
 1114    H    LYS  53           HN       LYS  53 141.678   1.514  -7.690
 1115    HA   LYS  53           HA       LYS  53 141.642  -0.663  -8.583
 1116   1HB   LYS  53           HB2      LYS  53 141.813   1.046 -11.080
 1117   2HB   LYS  53           HB1      LYS  53 141.405  -0.670 -11.081
 1118   1HG   LYS  53           HG2      LYS  53 139.476  -0.215  -9.609
 1119   2HG   LYS  53           HG1      LYS  53 139.880   1.502  -9.609
 1120   1HD   LYS  53           HD2      LYS  53 139.572   1.576 -12.057
 1121   2HD   LYS  53           HD1      LYS  53 139.163  -0.139 -12.058
 1122   1HE   LYS  53           HE2      LYS  53 137.139   1.312 -12.075
 1123   2HE   LYS  53           HE1      LYS  53 137.217   0.289 -10.642
 1124   1HZ   LYS  53           HZ2      LYS  53 138.594   2.716 -10.187
 1125   2HZ   LYS  53           HZ1      LYS  53 137.018   3.046 -10.727
 1126   3HZ   LYS  53           HZ3      LYS  53 137.258   2.075  -9.357
 1127    H    LYS  54           HN       LYS  54 144.247   0.200  -7.779
 1128    HA   LYS  54           HA       LYS  54 146.481  -0.450  -7.934
 1129   1HB   LYS  54           HB2      LYS  54 145.401  -2.517  -9.876
 1130   2HB   LYS  54           HB1      LYS  54 146.948  -2.576  -9.038
 1131   1HG   LYS  54           HG2      LYS  54 145.782  -2.629  -6.867
 1132   2HG   LYS  54           HG1      LYS  54 144.229  -2.563  -7.697
 1133   1HD   LYS  54           HD2      LYS  54 144.751  -4.691  -8.840
 1134   2HD   LYS  54           HD1      LYS  54 146.297  -4.761  -7.995
 1135   1HE   LYS  54           HE2      LYS  54 143.596  -4.675  -6.621
 1136   2HE   LYS  54           HE1      LYS  54 144.531  -6.144  -6.892
 1137   1HZ   LYS  54           HZ1      LYS  54 146.391  -4.799  -5.722
 1138   2HZ   LYS  54           HZ3      LYS  54 145.106  -3.876  -5.111
 1139   3HZ   LYS  54           HZ2      LYS  54 145.181  -5.543  -4.791
 1140    H    ASP  55           HN       ASP  55 145.222   1.454 -10.065
 1141    HA   ASP  55           HA       ASP  55 146.757   0.982 -12.477
 1142   1HB   ASP  55           HB2      ASP  55 145.428   3.448 -11.328
 1143   2HB   ASP  55           HB1      ASP  55 146.315   3.482 -12.854
 1144    H    GLU  56           HN       GLU  56 148.945   0.778 -12.222
 1145    HA   GLU  56           HA       GLU  56 150.504   2.031 -10.200
 1146   1HB   GLU  56           HB2      GLU  56 151.149  -0.021 -11.432
 1147   2HB   GLU  56           HB1      GLU  56 151.411   0.952 -12.879
 1148   1HG   GLU  56           HG2      GLU  56 153.138   2.260 -11.693
 1149   2HG   GLU  56           HG1      GLU  56 152.873   1.292 -10.242
 1150    H    ASP  57           HN       ASP  57 149.924   3.026 -13.577
 1151    HA   ASP  57           HA       ASP  57 151.859   5.172 -13.520
 1152   1HB   ASP  57           HB2      ASP  57 149.454   4.644 -15.281
 1153   2HB   ASP  57           HB1      ASP  57 150.559   5.996 -15.534
 1154    H    LEU  58           HN       LEU  58 148.402   5.005 -12.861
 1155    HA   LEU  58           HA       LEU  58 148.117   7.872 -12.497
 1156   1HB   LEU  58           HB2      LEU  58 146.417   5.553 -11.542
 1157   2HB   LEU  58           HB1      LEU  58 145.975   7.242 -11.305
 1158    HG   LEU  58           HG       LEU  58 146.518   5.967 -14.006
 1159   1HD1  LEU  58          HD11      LEU  58 143.912   6.643 -12.609
 1160   2HD1  LEU  58          HD13      LEU  58 144.046   6.148 -14.297
 1161   3HD1  LEU  58          HD12      LEU  58 144.498   5.029 -13.011
 1162   1HD2  LEU  58          HD23      LEU  58 145.815   8.745 -13.085
 1163   2HD2  LEU  58          HD22      LEU  58 146.865   8.234 -14.405
 1164   3HD2  LEU  58          HD21      LEU  58 145.119   8.175 -14.602
 1165    H    PHE  59           HN       PHE  59 148.824   5.170 -10.329
 1166    HA   PHE  59           HA       PHE  59 148.687   6.663  -7.881
 1167   1HB   PHE  59           HB2      PHE  59 148.718   4.225  -7.867
 1168   2HB   PHE  59           HB1      PHE  59 150.313   4.210  -8.619
 1169    HD1  PHE  59           HD1      PHE  59 148.516   5.549  -5.609
 1170    HD2  PHE  59           HD2      PHE  59 152.227   4.145  -7.260
 1171    HE1  PHE  59           HE1      PHE  59 149.563   5.672  -3.363
 1172    HE2  PHE  59           HE2      PHE  59 153.273   4.270  -5.016
 1173    HZ   PHE  59           HZ       PHE  59 151.941   5.032  -3.067
 1174    H    ARG  60           HN       ARG  60 151.381   5.987 -10.116
 1175    HA   ARG  60           HA       ARG  60 153.433   7.211  -8.588
 1176   1HB   ARG  60           HB2      ARG  60 153.101   6.888 -11.575
 1177   2HB   ARG  60           HB1      ARG  60 154.564   7.540 -10.839
 1178   1HG   ARG  60           HG2      ARG  60 154.933   5.499  -9.608
 1179   2HG   ARG  60           HG1      ARG  60 153.383   4.844 -10.122
 1180   1HD   ARG  60           HD2      ARG  60 155.252   3.916 -11.458
 1181   2HD   ARG  60           HD1      ARG  60 154.148   4.857 -12.464
 1182    HE   ARG  60           HE       ARG  60 156.062   6.701 -11.694
 1183   1HH1  ARG  60          HH21      ARG  60 156.066   3.567 -13.132
 1184   2HH1  ARG  60          HH22      ARG  60 157.497   3.853 -14.065
 1185   1HH2  ARG  60          HH11      ARG  60 157.925   7.093 -12.903
 1186   2HH2  ARG  60          HH12      ARG  60 158.551   5.850 -13.934
 1187    H    GLU  61           HN       GLU  61 151.334   8.697 -11.115
 1188    HA   GLU  61           HA       GLU  61 152.555  11.280 -10.919
 1189   1HB   GLU  61           HB2      GLU  61 149.769  10.426 -11.749
 1190   2HB   GLU  61           HB1      GLU  61 150.350  12.086 -11.872
 1191   1HG   GLU  61           HG2      GLU  61 151.773   9.732 -13.139
 1192   2HG   GLU  61           HG1      GLU  61 150.592  10.727 -13.994
 1193    H    TRP  62           HN       TRP  62 149.858   9.749  -9.177
 1194    HA   TRP  62           HA       TRP  62 149.065  12.076  -7.730
 1195   1HB   TRP  62           HB2      TRP  62 147.580  10.189  -7.793
 1196   2HB   TRP  62           HB1      TRP  62 148.804   9.131  -7.093
 1197    HD1  TRP  62           HD1      TRP  62 146.460  12.018  -6.175
 1198    HE1  TRP  62           HE1      TRP  62 146.222  12.109  -3.608
 1199    HE3  TRP  62           HE3      TRP  62 149.906   8.490  -4.843
 1200    HZ2  TRP  62           HZ2      TRP  62 147.348  10.848  -1.293
 1201    HZ3  TRP  62           HZ3      TRP  62 150.293   7.950  -2.457
 1202    HH2  TRP  62           HH2      TRP  62 149.023   9.125  -0.683
 1203    H    LEU  63           HN       LEU  63 151.294   9.440  -6.779
 1204    HA   LEU  63           HA       LEU  63 151.841  10.583  -4.205
 1205   1HB   LEU  63           HB2      LEU  63 152.231   8.210  -4.694
 1206   2HB   LEU  63           HB1      LEU  63 153.480   8.644  -5.857
 1207    HG   LEU  63           HG       LEU  63 154.812   9.673  -4.058
 1208   1HD1  LEU  63          HD13      LEU  63 152.381   8.979  -2.427
 1209   2HD1  LEU  63          HD12      LEU  63 153.962   9.010  -1.651
 1210   3HD1  LEU  63          HD11      LEU  63 153.334  10.460  -2.427
 1211   1HD2  LEU  63          HD22      LEU  63 153.868   6.851  -3.479
 1212   2HD2  LEU  63          HD21      LEU  63 155.175   7.312  -4.570
 1213   3HD2  LEU  63          HD23      LEU  63 155.346   7.568  -2.834
 1214    H    LYS  64           HN       LYS  64 153.636  10.722  -7.272
 1215    HA   LYS  64           HA       LYS  64 155.791  12.303  -6.210
 1216   1HB   LYS  64           HB2      LYS  64 155.847  11.055  -8.401
 1217   2HB   LYS  64           HB1      LYS  64 154.823  12.323  -9.078
 1218   1HG   LYS  64           HG2      LYS  64 156.509  14.016  -8.466
 1219   2HG   LYS  64           HG1      LYS  64 157.538  12.752  -7.795
 1220   1HD   LYS  64           HD2      LYS  64 156.641  12.934 -10.686
 1221   2HD   LYS  64           HD1      LYS  64 158.236  13.373 -10.083
 1222   1HE   LYS  64           HE2      LYS  64 158.657  11.195 -10.772
 1223   2HE   LYS  64           HE1      LYS  64 158.171  10.887  -9.106
 1224   1HZ   LYS  64           HZ2      LYS  64 155.881  11.042 -10.735
 1225   2HZ   LYS  64           HZ1      LYS  64 156.977   9.951 -11.438
 1226   3HZ   LYS  64           HZ3      LYS  64 156.459   9.717  -9.840
 1227    H    ASP  65           HN       ASP  65 152.755  13.174  -7.809
 1228    HA   ASP  65           HA       ASP  65 153.251  16.018  -7.787
 1229   1HB   ASP  65           HB2      ASP  65 150.689  14.409  -7.990
 1230   2HB   ASP  65           HB1      ASP  65 150.755  16.163  -8.145
 1231    H    THR  66           HN       THR  66 151.842  13.740  -5.511
 1232    HA   THR  66           HA       THR  66 150.724  15.786  -3.795
 1233    HB   THR  66           HB       THR  66 151.312  12.868  -3.227
 1234    HG1  THR  66           HG1      THR  66 148.990  14.251  -4.086
 1235   1HG2  THR  66          HG22      THR  66 149.610  14.921  -1.787
 1236   2HG2  THR  66          HG21      THR  66 149.574  13.190  -1.455
 1237   3HG2  THR  66          HG23      THR  66 151.045  14.114  -1.154
 1238    H    CYS  67           HN       CYS  67 153.803  13.948  -3.760
 1239    HA   CYS  67           HA       CYS  67 154.702  15.790  -1.560
 1240   1HB   CYS  67           HB2      CYS  67 155.790  13.989  -0.438
 1241   2HB   CYS  67           HB1      CYS  67 154.153  13.435  -0.793
 1242    HG   CYS  67           HG       CYS  67 155.395  12.347  -3.044
 1243    H    GLY  68           HN       GLY  68 155.705  13.773  -4.317
 1244   1HA   GLY  68           HA2      GLY  68 157.345  14.796  -5.891
 1245   2HA   GLY  68           HA1      GLY  68 158.216  15.417  -4.491
 1246    H    ALA  69           HN       ALA  69 156.888  12.236  -4.185
 1247    HA   ALA  69           HA       ALA  69 159.321  10.985  -3.543
 1248   1HB   ALA  69           HB1      ALA  69 156.957  10.090  -3.197
 1249   2HB   ALA  69           HB3      ALA  69 157.003   9.578  -4.885
 1250   3HB   ALA  69           HB2      ALA  69 158.151   8.905  -3.728
 1251    H    ASN  70           HN       ASN  70 160.727   9.574  -4.769
 1252    HA   ASN  70           HA       ASN  70 160.953  10.374  -7.607
 1253   1HB   ASN  70           HB2      ASN  70 162.748   8.625  -5.896
 1254   2HB   ASN  70           HB1      ASN  70 163.133   9.255  -7.497
 1255   1HD2  ASN  70          HD22      ASN  70 163.235  12.711  -6.163
 1256   2HD2  ASN  70          HD21      ASN  70 162.428  11.895  -7.414
 1257    H    ALA  71           HN       ALA  71 161.581   8.542  -9.150
 1258    HA   ALA  71           HA       ALA  71 159.435   6.704  -9.390
 1259   1HB   ALA  71           HB3      ALA  71 161.018   7.514 -11.217
 1260   2HB   ALA  71           HB2      ALA  71 162.168   6.315 -10.620
 1261   3HB   ALA  71           HB1      ALA  71 160.606   5.802 -11.260
 1262    H    LYS  72           HN       LYS  72 162.603   6.312  -7.823
 1263    HA   LYS  72           HA       LYS  72 162.417   3.437  -7.637
 1264   1HB   LYS  72           HB2      LYS  72 164.532   4.782  -7.371
 1265   2HB   LYS  72           HB1      LYS  72 163.936   5.310  -5.798
 1266   1HG   LYS  72           HG2      LYS  72 163.782   2.946  -5.073
 1267   2HG   LYS  72           HG1      LYS  72 164.421   2.435  -6.635
 1268   1HD   LYS  72           HD2      LYS  72 165.866   4.246  -4.676
 1269   2HD   LYS  72           HD1      LYS  72 166.192   2.528  -4.891
 1270   1HE   LYS  72           HE2      LYS  72 166.493   3.208  -7.432
 1271   2HE   LYS  72           HE1      LYS  72 166.776   4.812  -6.753
 1272   1HZ   LYS  72           HZ3      LYS  72 168.363   3.574  -5.183
 1273   2HZ   LYS  72           HZ2      LYS  72 168.307   2.329  -6.338
 1274   3HZ   LYS  72           HZ1      LYS  72 168.867   3.872  -6.775
 1275    H    GLN  73           HN       GLN  73 161.519   6.077  -5.443
 1276    HA   GLN  73           HA       GLN  73 160.746   4.385  -3.266
 1277   1HB   GLN  73           HB2      GLN  73 159.849   7.192  -3.985
 1278   2HB   GLN  73           HB1      GLN  73 159.543   6.403  -2.438
 1279   1HG   GLN  73           HG2      GLN  73 162.299   6.891  -3.606
 1280   2HG   GLN  73           HG1      GLN  73 161.541   7.896  -2.370
 1281   1HE2  GLN  73          HE22      GLN  73 163.644   4.903  -1.022
 1282   2HE2  GLN  73          HE21      GLN  73 163.933   5.827  -2.416
 1283    H    SER  74           HN       SER  74 158.937   5.672  -6.044
 1284    HA   SER  74           HA       SER  74 156.374   4.847  -5.086
 1285   1HB   SER  74           HB2      SER  74 156.847   6.468  -6.985
 1286   2HB   SER  74           HB1      SER  74 157.200   5.060  -7.985
 1287    HG   SER  74           HG       SER  74 155.006   4.391  -6.945
 1288    H    ARG  75           HN       ARG  75 158.863   3.172  -7.024
 1289    HA   ARG  75           HA       ARG  75 157.281   0.933  -7.771
 1290   1HB   ARG  75           HB2      ARG  75 160.248   1.186  -7.207
 1291   2HB   ARG  75           HB1      ARG  75 159.510  -0.273  -7.869
 1292   1HG   ARG  75           HG2      ARG  75 158.749   0.911  -9.826
 1293   2HG   ARG  75           HG1      ARG  75 159.225   2.462  -9.137
 1294   1HD   ARG  75           HD2      ARG  75 160.877   1.578 -10.803
 1295   2HD   ARG  75           HD1      ARG  75 161.573   1.827  -9.202
 1296    HE   ARG  75           HE       ARG  75 160.740  -0.819  -9.167
 1297   1HH1  ARG  75          HH21      ARG  75 162.714   1.170 -11.175
 1298   2HH1  ARG  75          HH22      ARG  75 163.746  -0.129 -11.674
 1299   1HH2  ARG  75          HH11      ARG  75 162.074  -2.524  -9.803
 1300   2HH2  ARG  75          HH12      ARG  75 163.383  -2.222 -10.897
 1301    H    ASP  76           HN       ASP  76 159.154   1.570  -4.801
 1302    HA   ASP  76           HA       ASP  76 158.777  -1.029  -3.680
 1303   1HB   ASP  76           HB2      ASP  76 159.294   1.666  -2.406
 1304   2HB   ASP  76           HB1      ASP  76 159.266   0.154  -1.495
 1305    H    CYS  77           HN       CYS  77 156.794   1.951  -3.428
 1306    HA   CYS  77           HA       CYS  77 155.001   0.841  -1.469
 1307   1HB   CYS  77           HB2      CYS  77 154.720   3.104  -3.460
 1308   2HB   CYS  77           HB1      CYS  77 153.481   2.704  -2.272
 1309    HG   CYS  77           HG       CYS  77 156.240   3.131  -1.016
 1310    H    PHE  78           HN       PHE  78 154.924   0.949  -5.054
 1311    HA   PHE  78           HA       PHE  78 152.270  -0.031  -5.324
 1312   1HB   PHE  78           HB2      PHE  78 153.544   0.876  -7.216
 1313   2HB   PHE  78           HB1      PHE  78 154.656  -0.490  -7.137
 1314    HD1  PHE  78           HD1      PHE  78 151.236   0.585  -7.998
 1315    HD2  PHE  78           HD2      PHE  78 153.980  -2.717  -7.855
 1316    HE1  PHE  78           HE1      PHE  78 149.713  -0.743  -9.435
 1317    HE2  PHE  78           HE2      PHE  78 152.456  -4.046  -9.290
 1318    HZ   PHE  78           HZ       PHE  78 150.321  -3.060 -10.079
 1319    H    GLY  79           HN       GLY  79 155.280  -1.946  -5.643
 1320   1HA   GLY  79           HA2      GLY  79 153.989  -4.468  -5.616
 1321   2HA   GLY  79           HA1      GLY  79 155.675  -4.207  -5.172
 1322    H    CYS  80           HN       CYS  80 154.969  -2.356  -2.981
 1323    HA   CYS  80           HA       CYS  80 154.675  -4.346  -0.898
 1324   1HB   CYS  80           HB2      CYS  80 155.932  -2.228  -0.585
 1325   2HB   CYS  80           HB1      CYS  80 154.415  -1.335  -0.688
 1326    HG   CYS  80           HG       CYS  80 154.995  -3.409   1.587
 1327    H    LEU  81           HN       LEU  81 152.454  -1.717  -2.031
 1328    HA   LEU  81           HA       LEU  81 150.322  -2.646  -0.311
 1329   1HB   LEU  81           HB2      LEU  81 150.213  -0.935  -2.816
 1330   2HB   LEU  81           HB1      LEU  81 148.906  -1.126  -1.649
 1331    HG   LEU  81           HG       LEU  81 151.645   0.039  -1.055
 1332   1HD1  LEU  81          HD13      LEU  81 150.178   1.487  -2.446
 1333   2HD1  LEU  81          HD12      LEU  81 148.919   1.365  -1.218
 1334   3HD1  LEU  81          HD11      LEU  81 150.445   2.166  -0.841
 1335   1HD2  LEU  81          HD23      LEU  81 149.258  -0.649   0.656
 1336   2HD2  LEU  81          HD22      LEU  81 150.976  -0.850   1.005
 1337   3HD2  LEU  81          HD21      LEU  81 150.245   0.750   1.085
 1338    H    ARG  82           HN       ARG  82 151.165  -3.182  -3.733
 1339    HA   ARG  82           HA       ARG  82 148.809  -4.615  -4.441
 1340   1HB   ARG  82           HB2      ARG  82 150.402  -3.770  -6.117
 1341   2HB   ARG  82           HB1      ARG  82 151.616  -4.916  -5.547
 1342   1HG   ARG  82           HG2      ARG  82 150.175  -6.801  -6.181
 1343   2HG   ARG  82           HG1      ARG  82 148.907  -5.683  -6.680
 1344   1HD   ARG  82           HD2      ARG  82 150.310  -4.800  -8.451
 1345   2HD   ARG  82           HD1      ARG  82 151.684  -5.756  -7.888
 1346    HE   ARG  82           HE       ARG  82 149.742  -7.657  -8.377
 1347   1HH1  ARG  82          HH21      ARG  82 151.145  -5.042 -10.135
 1348   2HH1  ARG  82          HH22      ARG  82 150.955  -5.806 -11.677
 1349   1HH2  ARG  82          HH11      ARG  82 149.492  -8.668 -10.375
 1350   2HH2  ARG  82          HH12      ARG  82 150.022  -7.861 -11.813
 1351    H    GLU  83           HN       GLU  83 151.906  -5.782  -3.112
 1352    HA   GLU  83           HA       GLU  83 151.145  -8.555  -3.258
 1353   1HB   GLU  83           HB2      GLU  83 153.289  -7.114  -1.684
 1354   2HB   GLU  83           HB1      GLU  83 153.080  -8.868  -1.648
 1355   1HG   GLU  83           HG2      GLU  83 153.412  -9.007  -4.053
 1356   2HG   GLU  83           HG1      GLU  83 153.484  -7.251  -4.182
 1357    H    TRP  84           HN       TRP  84 150.796  -6.100  -0.695
 1358    HA   TRP  84           HA       TRP  84 150.021  -7.879   1.392
 1359   1HB   TRP  84           HB2      TRP  84 150.449  -5.390   1.638
 1360   2HB   TRP  84           HB1      TRP  84 148.873  -5.113   0.897
 1361    HD1  TRP  84           HD1      TRP  84 150.524  -6.364   4.070
 1362    HE1  TRP  84           HE1      TRP  84 148.735  -6.605   5.924
 1363    HE3  TRP  84           HE3      TRP  84 146.280  -5.583   1.333
 1364    HZ2  TRP  84           HZ2      TRP  84 145.916  -6.495   6.206
 1365    HZ3  TRP  84           HZ3      TRP  84 144.056  -5.659   2.424
 1366    HH2  TRP  84           HH2      TRP  84 143.867  -6.113   4.858
 1367    H    CYS  85           HN       CYS  85 148.218  -6.396  -1.250
 1368    HA   CYS  85           HA       CYS  85 145.607  -7.315  -0.503
 1369   1HB   CYS  85           HB2      CYS  85 146.851  -6.674  -3.189
 1370   2HB   CYS  85           HB1      CYS  85 145.160  -7.139  -3.022
 1371    HG   CYS  85           HG       CYS  85 145.224  -5.002  -1.167
 1372    H    ASP  86           HN       ASP  86 148.210  -8.788  -2.397
 1373    HA   ASP  86           HA       ASP  86 146.816 -11.118  -3.246
 1374   1HB   ASP  86           HB2      ASP  86 149.753 -10.631  -2.704
 1375   2HB   ASP  86           HB1      ASP  86 149.135 -12.126  -3.402
 1376    H    ALA  87           HN       ALA  87 148.568 -10.428  -0.227
 1377    HA   ALA  87           HA       ALA  87 148.157 -13.183   0.730
 1378   1HB   ALA  87           HB2      ALA  87 150.224 -11.979   1.312
 1379   2HB   ALA  87           HB1      ALA  87 149.275 -10.746   2.146
 1380   3HB   ALA  87           HB3      ALA  87 149.310 -12.400   2.761
 1381    H    PHE  88           HN       PHE  88 146.884  -9.939   1.468
 1382    HA   PHE  88           HA       PHE  88 144.953 -11.188   3.382
 1383   1HB   PHE  88           HB2      PHE  88 145.750  -8.305   2.907
 1384   2HB   PHE  88           HB1      PHE  88 144.529  -8.825   4.070
 1385    HD1  PHE  88           HD2      PHE  88 145.157 -10.200   6.031
 1386    HD2  PHE  88           HD1      PHE  88 148.112  -8.666   3.315
 1387    HE1  PHE  88           HE2      PHE  88 146.935 -10.687   7.689
 1388    HE2  PHE  88           HE1      PHE  88 149.894  -9.157   4.975
 1389    HZ   PHE  88           HZ       PHE  88 149.301 -10.166   7.162
 1390    H    LEU  89           HN       LEU  89 144.398  -8.201   1.561
 1391    HA   LEU  89           HA       LEU  89 141.761  -9.215   0.776
 1392   1HB   LEU  89           HB2      LEU  89 141.860  -6.915   1.480
 1393   2HB   LEU  89           HB1      LEU  89 143.184  -6.567   0.375
 1394    HG   LEU  89           HG       LEU  89 141.725  -6.855  -1.555
 1395   1HD1  LEU  89          HD11      LEU  89 139.723  -7.752   0.527
 1396   2HD1  LEU  89          HD13      LEU  89 139.230  -7.218  -1.080
 1397   3HD1  LEU  89          HD12      LEU  89 140.272  -8.628  -0.904
 1398   1HD2  LEU  89          HD21      LEU  89 141.701  -4.686  -0.142
 1399   2HD2  LEU  89          HD23      LEU  89 140.381  -4.919  -1.290
 1400   3HD2  LEU  89          HD22      LEU  89 140.122  -5.228   0.427
   
  No H/Q in entry =        1400
  Start of MODEL    7
    1   1H    MET   1           HT1      MET   1 113.158  -7.529  10.443
    2   2H    MET   1           HT3      MET   1 112.406  -6.045  10.769
    3   3H    MET   1           HT2      MET   1 112.716  -6.503   9.164
    4    HA   MET   1           HA       MET   1 114.544  -5.262   9.333
    5   1HB   MET   1           HB2      MET   1 115.452  -4.546  11.528
    6   2HB   MET   1           HB1      MET   1 113.722  -4.227  11.403
    7   1HG   MET   1           HG2      MET   1 113.278  -6.370  12.604
    8   2HG   MET   1           HG1      MET   1 115.017  -6.582  12.808
    9   1HE   MET   1           HE3      MET   1 112.954  -6.657  15.053
   10   2HE   MET   1           HE2      MET   1 114.663  -6.750  15.471
   11   3HE   MET   1           HE1      MET   1 113.612  -5.637  16.341
   12    H    THR   2           HN       THR   2 114.238  -8.380   9.745
   13    HA   THR   2           HA       THR   2 116.787  -9.156  10.909
   14    HB   THR   2           HB       THR   2 115.026 -10.781   9.053
   15    HG1  THR   2           HG1      THR   2 113.659 -10.433  10.631
   16   1HG2  THR   2          HG23      THR   2 117.077 -11.493  11.166
   17   2HG2  THR   2          HG22      THR   2 116.017 -12.665  10.382
   18   3HG2  THR   2          HG21      THR   2 117.204 -11.774   9.429
   19    H    THR   3           HN       THR   3 118.741  -9.253   9.881
   20    HA   THR   3           HA       THR   3 119.013  -8.218   7.196
   21    HB   THR   3           HB       THR   3 121.419  -8.870   7.478
   22    HG1  THR   3           HG1      THR   3 122.002  -9.779   9.454
   23   1HG2  THR   3          HG21      THR   3 120.054  -7.388   9.735
   24   2HG2  THR   3          HG23      THR   3 121.800  -7.391   9.483
   25   3HG2  THR   3          HG22      THR   3 120.732  -6.696   8.262
   26    H    SER   4           HN       SER   4 119.913  -9.410   5.364
   27    HA   SER   4           HA       SER   4 118.719 -12.082   5.120
   28   1HB   SER   4           HB2      SER   4 120.224 -10.311   3.180
   29   2HB   SER   4           HB1      SER   4 119.606 -11.906   2.759
   30    HG   SER   4           HG       SER   4 117.811 -10.237   4.027
   31    H    GLN   5           HN       GLN   5 120.106 -13.795   4.002
   32    HA   GLN   5           HA       GLN   5 122.288 -14.523   5.697
   33   1HB   GLN   5           HB2      GLN   5 121.427 -15.529   2.972
   34   2HB   GLN   5           HB1      GLN   5 122.718 -16.272   3.914
   35   1HG   GLN   5           HG2      GLN   5 121.139 -16.667   5.770
   36   2HG   GLN   5           HG1      GLN   5 119.846 -15.927   4.826
   37   1HE2  GLN   5          HE22      GLN   5 120.741 -18.864   2.403
   38   2HE2  GLN   5          HE21      GLN   5 121.382 -17.293   2.385
   39    H    LYS   6           HN       LYS   6 122.181 -12.486   2.869
   40    HA   LYS   6           HA       LYS   6 124.813 -12.881   1.898
   41   1HB   LYS   6           HB2      LYS   6 122.987 -10.476   1.844
   42   2HB   LYS   6           HB1      LYS   6 124.528 -10.548   0.985
   43   1HG   LYS   6           HG2      LYS   6 123.765 -12.557  -0.227
   44   2HG   LYS   6           HG1      LYS   6 122.225 -12.485   0.628
   45   1HD   LYS   6           HD2      LYS   6 121.783 -10.262  -0.341
   46   2HD   LYS   6           HD1      LYS   6 123.322 -10.331  -1.201
   47   1HE   LYS   6           HE2      LYS   6 122.584 -12.295  -2.447
   48   2HE   LYS   6           HE1      LYS   6 121.076 -12.338  -1.534
   49   1HZ   LYS   6           HZ1      LYS   6 121.187  -9.795  -2.479
   50   2HZ   LYS   6           HZ3      LYS   6 121.809 -10.703  -3.768
   51   3HZ   LYS   6           HZ2      LYS   6 120.270 -11.059  -3.145
   52    H    HIS   7           HN       HIS   7 123.562 -10.781   4.483
   53    HA   HIS   7           HA       HIS   7 125.919  -9.258   4.888
   54   1HB   HIS   7           HB2      HIS   7 123.891  -8.592   6.004
   55   2HB   HIS   7           HB1      HIS   7 123.758 -10.149   6.818
   56    HD2  HIS   7           HD2      HIS   7 125.448 -10.464   9.085
   57    HE1  HIS   7           HE1      HIS   7 126.924  -6.513   9.103
   58    HE2  HIS   7           HE2      HIS   7 126.813  -8.680  10.406
   59    H    ARG   8           HN       ARG   8 124.936 -12.307   6.495
   60    HA   ARG   8           HA       ARG   8 127.393 -12.559   7.959
   61   1HB   ARG   8           HB2      ARG   8 125.295 -14.611   7.194
   62   2HB   ARG   8           HB1      ARG   8 126.595 -14.901   8.346
   63   1HG   ARG   8           HG2      ARG   8 124.642 -12.615   8.667
   64   2HG   ARG   8           HG1      ARG   8 124.303 -14.213   9.307
   65   1HD   ARG   8           HD2      ARG   8 126.583 -12.373  10.068
   66   2HD   ARG   8           HD1      ARG   8 125.274 -12.922  11.097
   67    HE   ARG   8           HE       ARG   8 127.775 -14.262  10.655
   68   1HH1  ARG   8          HH21      ARG   8 124.393 -14.921  10.904
   69   2HH1  ARG   8          HH22      ARG   8 124.620 -16.616  11.159
   70   1HH2  ARG   8          HH11      ARG   8 128.074 -16.455  11.011
   71   2HH2  ARG   8          HH12      ARG   8 126.696 -17.482  11.230
   72    H    ASP   9           HN       ASP   9 126.313 -13.635   4.797
   73    HA   ASP   9           HA       ASP   9 128.514 -15.461   4.365
   74   1HB   ASP   9           HB2      ASP   9 126.644 -14.074   2.454
   75   2HB   ASP   9           HB1      ASP   9 127.866 -15.226   1.938
   76    H    PHE  10           HN       PHE  10 127.974 -12.017   3.638
   77    HA   PHE  10           HA       PHE  10 130.336 -11.689   2.046
   78   1HB   PHE  10           HB2      PHE  10 128.409 -10.062   2.201
   79   2HB   PHE  10           HB1      PHE  10 129.017  -9.590   3.788
   80    HD1  PHE  10           HD2      PHE  10 131.149  -8.403   4.028
   81    HD2  PHE  10           HD1      PHE  10 129.641  -9.516   0.163
   82    HE1  PHE  10           HE2      PHE  10 132.795  -6.893   2.952
   83    HE2  PHE  10           HE1      PHE  10 131.289  -8.008  -0.915
   84    HZ   PHE  10           HZ       PHE  10 132.865  -6.696   0.480
   85    H    VAL  11           HN       VAL  11 129.746 -11.190   5.541
   86    HA   VAL  11           HA       VAL  11 132.568 -10.509   5.993
   87    HB   VAL  11           HB       VAL  11 131.905 -10.390   8.367
   88   1HG1  VAL  11          HG11      VAL  11 129.897  -9.120   6.476
   89   2HG1  VAL  11          HG13      VAL  11 130.201  -8.606   8.136
   90   3HG1  VAL  11          HG12      VAL  11 131.467  -8.446   6.919
   91   1HG2  VAL  11          HG22      VAL  11 129.384 -11.634   7.271
   92   2HG2  VAL  11          HG21      VAL  11 130.370 -12.178   8.627
   93   3HG2  VAL  11          HG23      VAL  11 129.373 -10.732   8.784
   94    H    ALA  12           HN       ALA  12 131.387 -13.306   5.094
   95    HA   ALA  12           HA       ALA  12 132.784 -14.973   7.163
   96   1HB   ALA  12           HB1      ALA  12 130.717 -15.698   5.077
   97   2HB   ALA  12           HB3      ALA  12 131.558 -16.875   6.083
   98   3HB   ALA  12           HB2      ALA  12 130.499 -15.677   6.826
   99    H    GLU  13           HN       GLU  13 133.166 -13.711   4.002
  100    HA   GLU  13           HA       GLU  13 135.545 -15.392   3.630
  101   1HB   GLU  13           HB2      GLU  13 134.857 -16.073   1.317
  102   2HB   GLU  13           HB1      GLU  13 133.857 -16.795   2.573
  103   1HG   GLU  13           HG2      GLU  13 132.171 -15.005   2.232
  104   2HG   GLU  13           HG1      GLU  13 133.160 -14.347   0.927
  105    HA   PRO  14           HA       PRO  14 137.366 -11.698   1.942
  106   1HB   PRO  14           HB2      PRO  14 137.859 -13.376  -0.512
  107   2HB   PRO  14           HB1      PRO  14 138.965 -12.272   0.332
  108   1HG   PRO  14           HG2      PRO  14 139.118 -14.917   0.669
  109   2HG   PRO  14           HG1      PRO  14 139.423 -13.790   2.005
  110   1HD   PRO  14           HD2      PRO  14 137.104 -15.600   1.590
  111   2HD   PRO  14           HD1      PRO  14 137.712 -14.875   3.093
  112    H    MET  15           HN       MET  15 137.007 -10.113   0.152
  113    HA   MET  15           HA       MET  15 134.233 -10.302  -0.870
  114   1HB   MET  15           HB2      MET  15 134.806  -7.916  -1.674
  115   2HB   MET  15           HB1      MET  15 134.728  -8.177   0.068
  116   1HG   MET  15           HG2      MET  15 137.066  -8.160   0.307
  117   2HG   MET  15           HG1      MET  15 137.342  -8.482  -1.406
  118   1HE   MET  15           HE1      MET  15 135.779  -6.328   1.137
  119   2HE   MET  15           HE3      MET  15 137.347  -5.515   1.225
  120   3HE   MET  15           HE2      MET  15 135.937  -4.653   0.610
  121    H    GLY  16           HN       GLY  16 137.528 -10.504  -2.018
  122   1HA   GLY  16           HA2      GLY  16 138.403 -10.863  -4.164
  123   2HA   GLY  16           HA1      GLY  16 136.909 -11.757  -4.450
  124    H    GLU  17           HN       GLU  17 136.371 -11.039  -6.485
  125    HA   GLU  17           HA       GLU  17 136.272  -8.093  -6.991
  126   1HB   GLU  17           HB2      GLU  17 136.265 -10.500  -8.830
  127   2HB   GLU  17           HB1      GLU  17 136.044  -8.841  -9.389
  128   1HG   GLU  17           HG2      GLU  17 138.223  -8.217  -8.418
  129   2HG   GLU  17           HG1      GLU  17 138.448  -9.872  -7.852
  130    H    LYS  18           HN       LYS  18 134.197  -9.616  -5.442
  131    HA   LYS  18           HA       LYS  18 131.890 -10.094  -7.032
  132   1HB   LYS  18           HB2      LYS  18 132.159  -9.150  -4.161
  133   2HB   LYS  18           HB1      LYS  18 130.636  -9.665  -4.874
  134   1HG   LYS  18           HG2      LYS  18 133.063 -11.460  -4.984
  135   2HG   LYS  18           HG1      LYS  18 132.054 -11.412  -3.543
  136   1HD   LYS  18           HD2      LYS  18 130.060 -11.867  -5.093
  137   2HD   LYS  18           HD1      LYS  18 131.251 -12.234  -6.342
  138   1HE   LYS  18           HE2      LYS  18 130.714 -14.323  -5.310
  139   2HE   LYS  18           HE1      LYS  18 132.296 -13.864  -4.679
  140   1HZ   LYS  18           HZ1      LYS  18 130.049 -12.848  -3.175
  141   2HZ   LYS  18           HZ3      LYS  18 130.195 -14.537  -3.157
  142   3HZ   LYS  18           HZ2      LYS  18 131.487 -13.568  -2.629
  143    HA   PRO  19           HA       PRO  19 130.778  -5.979  -8.282
  144   1HB   PRO  19           HB2      PRO  19 128.032  -6.174  -8.440
  145   2HB   PRO  19           HB1      PRO  19 129.136  -6.896  -9.628
  146   1HG   PRO  19           HG2      PRO  19 127.756  -8.184  -7.308
  147   2HG   PRO  19           HG1      PRO  19 127.975  -8.786  -8.963
  148   1HD   PRO  19           HD2      PRO  19 129.539  -9.641  -6.918
  149   2HD   PRO  19           HD1      PRO  19 130.170  -9.469  -8.570
  150    H    VAL  20           HN       VAL  20 129.801  -4.004  -7.561
  151    HA   VAL  20           HA       VAL  20 129.909  -3.514  -4.795
  152    HB   VAL  20           HB       VAL  20 130.094  -1.695  -6.382
  153   1HG1  VAL  20          HG13      VAL  20 128.457  -2.749  -8.031
  154   2HG1  VAL  20          HG12      VAL  20 127.163  -2.080  -7.039
  155   3HG1  VAL  20          HG11      VAL  20 128.314  -1.004  -7.829
  156   1HG2  VAL  20          HG21      VAL  20 129.018  -1.325  -4.082
  157   2HG2  VAL  20          HG23      VAL  20 128.725  -0.073  -5.291
  158   3HG2  VAL  20          HG22      VAL  20 127.474  -1.263  -4.931
  159    H    GLY  21           HN       GLY  21 127.036  -4.105  -6.822
  160   1HA   GLY  21           HA2      GLY  21 125.052  -3.685  -4.874
  161   2HA   GLY  21           HA1      GLY  21 124.877  -4.790  -6.235
  162    H    SER  22           HN       SER  22 127.522  -5.956  -4.683
  163    HA   SER  22           HA       SER  22 125.960  -8.092  -3.428
  164   1HB   SER  22           HB2      SER  22 128.951  -7.598  -3.532
  165   2HB   SER  22           HB1      SER  22 128.189  -9.062  -2.919
  166    HG   SER  22           HG       SER  22 128.594  -9.509  -5.008
  167    H    LEU  23           HN       LEU  23 127.475  -5.142  -2.436
  168    HA   LEU  23           HA       LEU  23 127.995  -5.778   0.305
  169   1HB   LEU  23           HB2      LEU  23 127.239  -3.134  -0.967
  170   2HB   LEU  23           HB1      LEU  23 127.895  -3.317   0.658
  171    HG   LEU  23           HG       LEU  23 129.302  -4.263  -1.858
  172   1HD1  LEU  23          HD13      LEU  23 128.983  -1.755  -1.691
  173   2HD1  LEU  23          HD12      LEU  23 129.921  -1.804  -0.200
  174   3HD1  LEU  23          HD11      LEU  23 130.666  -2.283  -1.724
  175   1HD2  LEU  23          HD21      LEU  23 129.987  -4.219   1.082
  176   2HD2  LEU  23          HD23      LEU  23 130.251  -5.497  -0.105
  177   3HD2  LEU  23          HD22      LEU  23 131.280  -4.070  -0.106
  178    H    ALA  24           HN       ALA  24 126.683  -5.846   2.064
  179    HA   ALA  24           HA       ALA  24 123.843  -6.116   1.707
  180   1HB   ALA  24           HB1      ALA  24 125.243  -7.108   3.585
  181   2HB   ALA  24           HB3      ALA  24 125.253  -5.501   4.308
  182   3HB   ALA  24           HB2      ALA  24 123.729  -6.356   4.091
  183    H    GLY  25           HN       GLY  25 122.230  -4.638   1.899
  184   1HA   GLY  25           HA2      GLY  25 121.243  -2.558   2.711
  185   2HA   GLY  25           HA1      GLY  25 122.864  -1.882   2.879
  186    H    ILE  26           HN       ILE  26 123.410  -3.236   0.128
  187    HA   ILE  26           HA       ILE  26 122.425  -0.926  -1.492
  188    HB   ILE  26           HB       ILE  26 124.485  -3.048  -2.190
  189   1HG1  ILE  26          HG12      ILE  26 125.322  -1.787  -0.299
  190   2HG1  ILE  26          HG11      ILE  26 126.141  -1.203  -1.744
  191   1HG2  ILE  26          HG22      ILE  26 123.710  -0.407  -3.452
  192   2HG2  ILE  26          HG21      ILE  26 125.157  -1.315  -3.890
  193   3HG2  ILE  26          HG23      ILE  26 123.562  -2.013  -4.164
  194   1HD1  ILE  26          HD12      ILE  26 124.213   0.572  -1.814
  195   2HD1  ILE  26          HD11      ILE  26 123.993   0.139  -0.119
  196   3HD1  ILE  26          HD13      ILE  26 125.536   0.788  -0.669
  197    H    GLY  27           HN       GLY  27 120.555  -1.345  -2.640
  198   1HA   GLY  27           HA2      GLY  27 119.834  -4.152  -3.225
  199   2HA   GLY  27           HA1      GLY  27 118.789  -2.746  -3.430
  200    H    GLU  28           HN       GLU  28 118.797  -4.421  -5.516
  201    HA   GLU  28           HA       GLU  28 120.837  -4.183  -7.450
  202   1HB   GLU  28           HB2      GLU  28 117.845  -4.525  -7.770
  203   2HB   GLU  28           HB1      GLU  28 118.981  -4.644  -9.114
  204   1HG   GLU  28           HG2      GLU  28 120.168  -6.469  -7.974
  205   2HG   GLU  28           HG1      GLU  28 119.068  -6.339  -6.600
  206    H    VAL  29           HN       VAL  29 118.047  -2.020  -6.870
  207    HA   VAL  29           HA       VAL  29 118.612  -0.358  -9.164
  208    HB   VAL  29           HB       VAL  29 117.032   0.145  -6.627
  209   1HG1  VAL  29          HG12      VAL  29 117.546   1.911  -9.023
  210   2HG1  VAL  29          HG11      VAL  29 116.067   2.069  -8.076
  211   3HG1  VAL  29          HG13      VAL  29 117.636   2.327  -7.312
  212   1HG2  VAL  29          HG22      VAL  29 116.293  -0.503  -9.496
  213   2HG2  VAL  29          HG21      VAL  29 116.032  -1.517  -8.076
  214   3HG2  VAL  29          HG23      VAL  29 115.124  -0.016  -8.269
  215    H    LEU  30           HN       LEU  30 119.482  -0.150  -5.731
  216    HA   LEU  30           HA       LEU  30 120.833   2.379  -5.930
  217   1HB   LEU  30           HB2      LEU  30 121.287   0.109  -3.964
  218   2HB   LEU  30           HB1      LEU  30 121.831   1.773  -3.759
  219    HG   LEU  30           HG       LEU  30 118.942   0.871  -3.983
  220   1HD1  LEU  30          HD11      LEU  30 120.653   1.791  -1.661
  221   2HD1  LEU  30          HD13      LEU  30 118.892   1.727  -1.593
  222   3HD1  LEU  30          HD12      LEU  30 119.820   0.247  -1.839
  223   1HD2  LEU  30          HD23      LEU  30 120.263   3.581  -3.857
  224   2HD2  LEU  30          HD22      LEU  30 118.903   3.049  -4.848
  225   3HD2  LEU  30          HD21      LEU  30 118.671   3.357  -3.130
  226    H    GLY  31           HN       GLY  31 121.894  -0.977  -6.287
  227   1HA   GLY  31           HA2      GLY  31 124.697  -0.484  -6.419
  228   2HA   GLY  31           HA1      GLY  31 123.882  -1.848  -7.187
  229    H    LYS  32           HN       LYS  32 122.166  -0.286  -8.881
  230    HA   LYS  32           HA       LYS  32 123.881   0.053 -11.138
  231   1HB   LYS  32           HB2      LYS  32 121.045   0.957 -10.603
  232   2HB   LYS  32           HB1      LYS  32 121.841   1.145 -12.166
  233   1HG   LYS  32           HG2      LYS  32 122.158  -1.245 -12.372
  234   2HG   LYS  32           HG1      LYS  32 121.594  -1.510 -10.727
  235   1HD   LYS  32           HD2      LYS  32 119.699  -2.040 -12.013
  236   2HD   LYS  32           HD1      LYS  32 119.386  -0.374 -11.536
  237   1HE   LYS  32           HE2      LYS  32 118.945  -0.739 -13.949
  238   2HE   LYS  32           HE1      LYS  32 120.245   0.425 -13.699
  239   1HZ   LYS  32           HZ3      LYS  32 121.328  -2.168 -13.768
  240   2HZ   LYS  32           HZ2      LYS  32 120.334  -1.962 -15.131
  241   3HZ   LYS  32           HZ1      LYS  32 121.608  -0.878 -14.833
  242    H    LYS  33           HN       LYS  33 122.492   2.472  -8.880
  243    HA   LYS  33           HA       LYS  33 123.424   4.733 -10.396
  244   1HB   LYS  33           HB2      LYS  33 122.832   4.446  -7.434
  245   2HB   LYS  33           HB1      LYS  33 123.176   5.982  -8.230
  246   1HG   LYS  33           HG2      LYS  33 121.254   5.643  -9.734
  247   2HG   LYS  33           HG1      LYS  33 120.903   4.105  -8.946
  248   1HD   LYS  33           HD2      LYS  33 120.586   5.296  -6.794
  249   2HD   LYS  33           HD1      LYS  33 120.895   6.828  -7.611
  250   1HE   LYS  33           HE2      LYS  33 118.945   6.525  -9.031
  251   2HE   LYS  33           HE1      LYS  33 118.675   4.911  -8.371
  252   1HZ   LYS  33           HZ2      LYS  33 118.858   6.703  -6.237
  253   2HZ   LYS  33           HZ1      LYS  33 117.778   7.367  -7.367
  254   3HZ   LYS  33           HZ3      LYS  33 117.504   5.813  -6.746
  255    H    LEU  34           HN       LEU  34 124.899   2.927  -7.675
  256    HA   LEU  34           HA       LEU  34 127.244   4.561  -7.487
  257   1HB   LEU  34           HB2      LEU  34 126.773   1.642  -6.826
  258   2HB   LEU  34           HB1      LEU  34 128.269   2.485  -6.452
  259    HG   LEU  34           HG       LEU  34 125.551   3.418  -5.501
  260   1HD1  LEU  34          HD12      LEU  34 127.654   1.766  -4.068
  261   2HD1  LEU  34          HD11      LEU  34 126.217   2.452  -3.311
  262   3HD1  LEU  34          HD13      LEU  34 126.052   1.213  -4.554
  263   1HD2  LEU  34          HD22      LEU  34 128.405   4.301  -5.050
  264   2HD2  LEU  34          HD21      LEU  34 126.963   5.277  -5.312
  265   3HD2  LEU  34          HD23      LEU  34 127.232   4.509  -3.753
  266    H    GLU  35           HN       GLU  35 126.473   1.716  -9.427
  267    HA   GLU  35           HA       GLU  35 129.062   1.317 -10.559
  268   1HB   GLU  35           HB2      GLU  35 127.250  -0.341 -10.761
  269   2HB   GLU  35           HB1      GLU  35 126.349   0.762 -11.801
  270   1HG   GLU  35           HG2      GLU  35 128.154   0.694 -13.469
  271   2HG   GLU  35           HG1      GLU  35 129.101  -0.359 -12.418
  272    H    GLU  36           HN       GLU  36 126.376   3.368 -11.652
  273    HA   GLU  36           HA       GLU  36 127.649   4.192 -14.091
  274   1HB   GLU  36           HB2      GLU  36 125.497   5.479 -12.389
  275   2HB   GLU  36           HB1      GLU  36 126.008   6.118 -13.952
  276   1HG   GLU  36           HG2      GLU  36 125.430   3.972 -15.025
  277   2HG   GLU  36           HG1      GLU  36 124.914   3.331 -13.465
  278    H    ARG  37           HN       ARG  37 128.067   5.117 -10.780
  279    HA   ARG  37           HA       ARG  37 129.418   7.649 -11.519
  280   1HB   ARG  37           HB2      ARG  37 128.896   6.351  -8.836
  281   2HB   ARG  37           HB1      ARG  37 129.773   7.868  -9.035
  282   1HG   ARG  37           HG2      ARG  37 127.748   8.719 -10.342
  283   2HG   ARG  37           HG1      ARG  37 126.894   7.288  -9.767
  284   1HD   ARG  37           HD2      ARG  37 126.392   9.078  -8.243
  285   2HD   ARG  37           HD1      ARG  37 127.511   7.990  -7.412
  286    HE   ARG  37           HE       ARG  37 129.217   9.811  -8.530
  287   1HH1  ARG  37          HH21      ARG  37 126.288  10.064  -6.725
  288   2HH1  ARG  37          HH22      ARG  37 126.754  11.530  -5.928
  289   1HH2  ARG  37          HH11      ARG  37 129.839  11.719  -7.496
  290   2HH2  ARG  37          HH12      ARG  37 128.763  12.466  -6.363
  291    H    GLY  38           HN       GLY  38 130.443   4.501 -11.638
  292   1HA   GLY  38           HA2      GLY  38 132.780   4.144 -12.283
  293   2HA   GLY  38           HA1      GLY  38 133.269   5.381 -11.139
  294    H    PHE  39           HN       PHE  39 130.930   3.436  -9.655
  295    HA   PHE  39           HA       PHE  39 133.091   1.882  -8.272
  296   1HB   PHE  39           HB2      PHE  39 130.256   2.535  -7.466
  297   2HB   PHE  39           HB1      PHE  39 131.366   1.567  -6.503
  298    HD1  PHE  39           HD2      PHE  39 133.339   2.596  -5.453
  299    HD2  PHE  39           HD1      PHE  39 130.510   4.925  -7.683
  300    HE1  PHE  39           HE2      PHE  39 134.297   4.672  -4.490
  301    HE2  PHE  39           HE1      PHE  39 131.463   7.005  -6.725
  302    HZ   PHE  39           HZ       PHE  39 133.363   6.879  -5.127
  303    H    ASP  40           HN       ASP  40 133.000   0.449 -10.287
  304    HA   ASP  40           HA       ASP  40 130.586  -1.139 -10.675
  305   1HB   ASP  40           HB2      ASP  40 131.864  -2.303 -12.370
  306   2HB   ASP  40           HB1      ASP  40 132.221  -0.580 -12.501
  307    H    LYS  41           HN       LYS  41 133.174  -1.320  -8.437
  308    HA   LYS  41           HA       LYS  41 132.359  -4.119  -7.767
  309   1HB   LYS  41           HB2      LYS  41 135.196  -3.099  -8.037
  310   2HB   LYS  41           HB1      LYS  41 134.768  -4.620  -7.249
  311   1HG   LYS  41           HG2      LYS  41 133.670  -5.393  -9.323
  312   2HG   LYS  41           HG1      LYS  41 134.100  -3.876 -10.114
  313   1HD   LYS  41           HD2      LYS  41 136.494  -4.373  -9.762
  314   2HD   LYS  41           HD1      LYS  41 136.050  -5.893  -8.982
  315   1HE   LYS  41           HE2      LYS  41 134.877  -6.568 -11.090
  316   2HE   LYS  41           HE1      LYS  41 135.525  -5.120 -11.861
  317   1HZ   LYS  41           HZ3      LYS  41 137.303  -7.023 -10.475
  318   2HZ   LYS  41           HZ2      LYS  41 136.821  -7.300 -12.081
  319   3HZ   LYS  41           HZ1      LYS  41 137.687  -5.894 -11.681
  320    H    ALA  42           HN       ALA  42 132.793  -4.720  -5.572
  321    HA   ALA  42           HA       ALA  42 132.045  -2.692  -3.701
  322   1HB   ALA  42           HB3      ALA  42 132.951  -5.547  -3.451
  323   2HB   ALA  42           HB2      ALA  42 132.660  -4.572  -2.010
  324   3HB   ALA  42           HB1      ALA  42 131.353  -4.863  -3.157
  325    H    TYR  43           HN       TYR  43 135.270  -4.192  -4.273
  326    HA   TYR  43           HA       TYR  43 136.478  -3.050  -1.978
  327   1HB   TYR  43           HB2      TYR  43 138.626  -3.456  -2.948
  328   2HB   TYR  43           HB1      TYR  43 137.571  -4.788  -3.393
  329    HD1  TYR  43           HD1      TYR  43 138.882  -1.501  -4.681
  330    HD2  TYR  43           HD2      TYR  43 137.367  -5.410  -5.644
  331    HE1  TYR  43           HE1      TYR  43 139.427  -1.130  -7.061
  332    HE2  TYR  43           HE2      TYR  43 137.932  -5.027  -8.024
  333    HH   TYR  43           HH       TYR  43 139.893  -2.455  -9.069
  334    H    VAL  44           HN       VAL  44 135.412  -1.424  -4.826
  335    HA   VAL  44           HA       VAL  44 137.226   0.865  -4.464
  336    HB   VAL  44           HB       VAL  44 134.629   0.719  -6.040
  337   1HG1  VAL  44          HG13      VAL  44 135.633   3.007  -5.444
  338   2HG1  VAL  44          HG12      VAL  44 136.999   2.555  -6.459
  339   3HG1  VAL  44          HG11      VAL  44 135.387   2.689  -7.159
  340   1HG2  VAL  44          HG22      VAL  44 137.496   0.177  -6.866
  341   2HG2  VAL  44          HG21      VAL  44 136.152  -0.965  -6.891
  342   3HG2  VAL  44          HG23      VAL  44 136.168   0.402  -8.003
  343    H    VAL  45           HN       VAL  45 134.015  -0.122  -3.585
  344    HA   VAL  45           HA       VAL  45 133.217   2.427  -2.413
  345    HB   VAL  45           HB       VAL  45 132.058  -0.359  -2.094
  346   1HG1  VAL  45          HG13      VAL  45 131.150   2.360  -1.132
  347   2HG1  VAL  45          HG12      VAL  45 130.013   1.032  -1.368
  348   3HG1  VAL  45          HG11      VAL  45 131.324   0.873  -0.199
  349   1HG2  VAL  45          HG21      VAL  45 131.291   2.024  -3.808
  350   2HG2  VAL  45          HG23      VAL  45 131.921   0.480  -4.383
  351   3HG2  VAL  45          HG22      VAL  45 130.322   0.562  -3.643
  352    H    LEU  46           HN       LEU  46 134.553  -0.636  -1.182
  353    HA   LEU  46           HA       LEU  46 134.435   0.047   1.592
  354   1HB   LEU  46           HB2      LEU  46 135.026  -2.241   0.801
  355   2HB   LEU  46           HB1      LEU  46 136.527  -1.609   0.132
  356    HG   LEU  46           HG       LEU  46 137.165  -0.854   2.451
  357   1HD1  LEU  46          HD12      LEU  46 134.565  -2.222   3.096
  358   2HD1  LEU  46          HD11      LEU  46 135.854  -2.148   4.296
  359   3HD1  LEU  46          HD13      LEU  46 135.161  -0.662   3.656
  360   1HD2  LEU  46          HD22      LEU  46 137.674  -3.207   1.338
  361   2HD2  LEU  46          HD21      LEU  46 138.100  -2.888   3.015
  362   3HD2  LEU  46          HD23      LEU  46 136.640  -3.797   2.641
  363    H    GLY  47           HN       GLY  47 136.719   0.733  -0.989
  364   1HA   GLY  47           HA2      GLY  47 138.837   1.904   0.443
  365   2HA   GLY  47           HA1      GLY  47 138.350   2.423  -1.172
  366    H    GLN  48           HN       GLN  48 135.775   3.401  -0.638
  367    HA   GLN  48           HA       GLN  48 136.326   6.038   0.309
  368   1HB   GLN  48           HB2      GLN  48 134.408   5.482  -1.156
  369   2HB   GLN  48           HB1      GLN  48 133.665   4.578   0.161
  370   1HG   GLN  48           HG2      GLN  48 132.660   6.794   0.046
  371   2HG   GLN  48           HG1      GLN  48 133.614   6.681   1.520
  372   1HE2  GLN  48          HE22      GLN  48 135.478   8.737  -1.513
  373   2HE2  GLN  48          HE21      GLN  48 134.770   7.230  -1.843
  374    H    PHE  49           HN       PHE  49 134.933   3.200   1.943
  375    HA   PHE  49           HA       PHE  49 134.305   4.457   4.430
  376   1HB   PHE  49           HB2      PHE  49 133.640   2.123   3.682
  377   2HB   PHE  49           HB1      PHE  49 135.289   1.619   4.040
  378    HD1  PHE  49           HD1      PHE  49 132.448   3.484   5.637
  379    HD2  PHE  49           HD2      PHE  49 135.745   0.782   6.182
  380    HE1  PHE  49           HE1      PHE  49 131.816   3.188   8.018
  381    HE2  PHE  49           HE2      PHE  49 135.112   0.491   8.561
  382    HZ   PHE  49           HZ       PHE  49 133.148   1.688   9.478
  383    H    LEU  50           HN       LEU  50 137.261   2.988   3.177
  384    HA   LEU  50           HA       LEU  50 138.790   3.265   5.617
  385   1HB   LEU  50           HB2      LEU  50 139.788   3.208   2.747
  386   2HB   LEU  50           HB1      LEU  50 140.767   2.922   4.182
  387    HG   LEU  50           HG       LEU  50 138.444   1.222   3.219
  388   1HD1  LEU  50          HD13      LEU  50 140.788   1.121   2.083
  389   2HD1  LEU  50          HD12      LEU  50 141.309   0.339   3.574
  390   3HD1  LEU  50          HD11      LEU  50 140.041  -0.394   2.591
  391   1HD2  LEU  50          HD22      LEU  50 140.041   1.224   5.777
  392   2HD2  LEU  50          HD21      LEU  50 138.308   0.989   5.546
  393   3HD2  LEU  50          HD23      LEU  50 139.434  -0.302   5.134
  394    H    VAL  51           HN       VAL  51 138.319   5.334   2.783
  395    HA   VAL  51           HA       VAL  51 140.194   7.366   3.502
  396    HB   VAL  51           HB       VAL  51 137.676   7.451   1.821
  397   1HG1  VAL  51          HG13      VAL  51 139.757   9.567   2.391
  398   2HG1  VAL  51          HG12      VAL  51 138.822   9.576   0.896
  399   3HG1  VAL  51          HG11      VAL  51 138.001   9.715   2.452
  400   1HG2  VAL  51          HG21      VAL  51 139.555   6.023   1.025
  401   2HG2  VAL  51          HG23      VAL  51 139.268   7.397  -0.041
  402   3HG2  VAL  51          HG22      VAL  51 140.622   7.425   1.089
  403    H    LEU  52           HN       LEU  52 136.863   6.802   4.499
  404    HA   LEU  52           HA       LEU  52 136.703   9.444   5.828
  405   1HB   LEU  52           HB2      LEU  52 134.747   7.126   5.800
  406   2HB   LEU  52           HB1      LEU  52 134.431   8.721   6.480
  407    HG   LEU  52           HG       LEU  52 135.127   8.178   3.575
  408   1HD1  LEU  52          HD12      LEU  52 132.836   7.391   4.464
  409   2HD1  LEU  52          HD11      LEU  52 132.466   9.104   4.672
  410   3HD1  LEU  52          HD13      LEU  52 132.826   8.467   3.067
  411   1HD2  LEU  52          HD23      LEU  52 134.610  10.675   5.186
  412   2HD2  LEU  52          HD22      LEU  52 135.812  10.390   3.926
  413   3HD2  LEU  52          HD21      LEU  52 134.125  10.634   3.490
  414    H    LYS  53           HN       LYS  53 138.513   7.017   6.652
  415    HA   LYS  53           HA       LYS  53 139.212   6.036   8.671
  416   1HB   LYS  53           HB2      LYS  53 138.206   8.739   9.601
  417   2HB   LYS  53           HB1      LYS  53 139.175   7.651  10.593
  418   1HG   LYS  53           HG2      LYS  53 140.977   7.712   8.908
  419   2HG   LYS  53           HG1      LYS  53 140.012   8.804   7.914
  420   1HD   LYS  53           HD2      LYS  53 140.007  10.464   9.740
  421   2HD   LYS  53           HD1      LYS  53 140.977   9.375  10.733
  422   1HE   LYS  53           HE2      LYS  53 141.832  10.453   8.031
  423   2HE   LYS  53           HE1      LYS  53 142.351  11.117   9.581
  424   1HZ   LYS  53           HZ2      LYS  53 142.729   8.273   8.835
  425   2HZ   LYS  53           HZ1      LYS  53 143.899   9.469   8.538
  426   3HZ   LYS  53           HZ3      LYS  53 143.438   9.114  10.130
  427    H    LYS  54           HN       LYS  54 136.566   5.246   7.920
  428    HA   LYS  54           HA       LYS  54 134.714   4.125   8.813
  429   1HB   LYS  54           HB2      LYS  54 136.196   4.327  11.450
  430   2HB   LYS  54           HB1      LYS  54 134.982   3.138  10.991
  431   1HG   LYS  54           HG2      LYS  54 136.471   2.285   9.223
  432   2HG   LYS  54           HG1      LYS  54 137.689   3.475   9.672
  433   1HD   LYS  54           HD2      LYS  54 137.776   2.491  11.954
  434   2HD   LYS  54           HD1      LYS  54 136.621   1.260  11.444
  435   1HE   LYS  54           HE2      LYS  54 138.907   0.381  11.282
  436   2HE   LYS  54           HE1      LYS  54 138.203   0.537   9.672
  437   1HZ   LYS  54           HZ2      LYS  54 139.696   2.807  10.764
  438   2HZ   LYS  54           HZ1      LYS  54 140.575   1.465  10.204
  439   3HZ   LYS  54           HZ3      LYS  54 139.531   2.293   9.153
  440    H    ASP  55           HN       ASP  55 135.024   7.230   9.072
  441    HA   ASP  55           HA       ASP  55 133.539   7.948  11.443
  442   1HB   ASP  55           HB2      ASP  55 134.861   9.587  10.157
  443   2HB   ASP  55           HB1      ASP  55 133.780   9.388   8.784
  444    H    GLU  56           HN       GLU  56 131.498   7.225  11.816
  445    HA   GLU  56           HA       GLU  56 129.817   6.038   9.857
  446   1HB   GLU  56           HB2      GLU  56 129.709   5.519  12.257
  447   2HB   GLU  56           HB1      GLU  56 129.083   7.136  12.577
  448   1HG   GLU  56           HG2      GLU  56 127.087   6.692  11.276
  449   2HG   GLU  56           HG1      GLU  56 127.733   5.143  10.734
  450    H    ASP  57           HN       ASP  57 129.626   9.328  11.266
  451    HA   ASP  57           HA       ASP  57 127.126   9.935   9.942
  452   1HB   ASP  57           HB2      ASP  57 129.251  11.705  11.170
  453   2HB   ASP  57           HB1      ASP  57 127.744  12.330  10.498
  454    H    LEU  58           HN       LEU  58 130.494  10.523   9.124
  455    HA   LEU  58           HA       LEU  58 129.849  12.068   6.749
  456   1HB   LEU  58           HB2      LEU  58 132.374  10.520   7.383
  457   2HB   LEU  58           HB1      LEU  58 132.204  11.694   6.086
  458    HG   LEU  58           HG       LEU  58 131.808  12.315   9.030
  459   1HD1  LEU  58          HD12      LEU  58 134.168  11.736   8.368
  460   2HD1  LEU  58          HD11      LEU  58 134.116  13.073   7.218
  461   3HD1  LEU  58          HD13      LEU  58 133.974  13.391   8.948
  462   1HD2  LEU  58          HD21      LEU  58 131.638  13.928   6.485
  463   2HD2  LEU  58          HD23      LEU  58 130.568  13.946   7.886
  464   3HD2  LEU  58          HD22      LEU  58 132.148  14.715   7.978
  465    H    PHE  59           HN       PHE  59 130.467   8.632   7.361
  466    HA   PHE  59           HA       PHE  59 130.441   7.819   4.611
  467   1HB   PHE  59           HB2      PHE  59 131.258   6.311   6.345
  468   2HB   PHE  59           HB1      PHE  59 129.669   6.285   7.111
  469    HD1  PHE  59           HD1      PHE  59 131.292   5.649   3.784
  470    HD2  PHE  59           HD2      PHE  59 128.161   4.580   6.528
  471    HE1  PHE  59           HE1      PHE  59 130.607   3.797   2.283
  472    HE2  PHE  59           HE2      PHE  59 127.478   2.729   5.025
  473    HZ   PHE  59           HZ       PHE  59 128.701   2.337   2.903
  474    H    ARG  60           HN       ARG  60 127.824   7.867   7.064
  475    HA   ARG  60           HA       ARG  60 125.782   6.904   5.343
  476   1HB   ARG  60           HB2      ARG  60 125.630   8.737   7.748
  477   2HB   ARG  60           HB1      ARG  60 124.207   8.093   6.931
  478   1HG   ARG  60           HG2      ARG  60 125.078   5.785   7.322
  479   2HG   ARG  60           HG1      ARG  60 126.410   6.473   8.240
  480   1HD   ARG  60           HD2      ARG  60 123.469   6.805   8.893
  481   2HD   ARG  60           HD1      ARG  60 124.593   5.745   9.740
  482    HE   ARG  60           HE       ARG  60 125.780   8.248   9.894
  483   1HH1  ARG  60          HH21      ARG  60 122.704   6.874  10.644
  484   2HH1  ARG  60          HH22      ARG  60 122.390   7.961  11.954
  485   1HH2  ARG  60          HH11      ARG  60 125.384   9.675  11.601
  486   2HH2  ARG  60          HH12      ARG  60 123.907   9.547  12.497
  487    H    GLU  61           HN       GLU  61 126.813  10.276   5.985
  488    HA   GLU  61           HA       GLU  61 124.792  11.491   4.357
  489   1HB   GLU  61           HB2      GLU  61 127.583  12.390   5.124
  490   2HB   GLU  61           HB1      GLU  61 126.443  13.410   4.247
  491   1HG   GLU  61           HG2      GLU  61 125.838  12.135   6.928
  492   2HG   GLU  61           HG1      GLU  61 126.442  13.782   6.739
  493    H    TRP  62           HN       TRP  62 128.012  10.197   3.651
  494    HA   TRP  62           HA       TRP  62 128.177  11.136   0.960
  495   1HB   TRP  62           HB2      TRP  62 130.171  10.311   2.018
  496   2HB   TRP  62           HB1      TRP  62 129.418   8.751   2.352
  497    HD1  TRP  62           HD1      TRP  62 130.771  10.858  -0.561
  498    HE1  TRP  62           HE1      TRP  62 131.238   9.292  -2.557
  499    HE3  TRP  62           HE3      TRP  62 128.844   6.493   1.272
  500    HZ2  TRP  62           HZ2      TRP  62 130.836   6.542  -3.283
  501    HZ3  TRP  62           HZ3      TRP  62 128.907   4.423  -0.086
  502    HH2  TRP  62           HH2      TRP  62 129.897   4.442  -2.357
  503    H    LEU  63           HN       LEU  63 127.000   8.024   2.259
  504    HA   LEU  63           HA       LEU  63 126.384   6.941  -0.326
  505   1HB   LEU  63           HB2      LEU  63 126.716   5.531   1.663
  506   2HB   LEU  63           HB1      LEU  63 125.282   6.232   2.405
  507    HG   LEU  63           HG       LEU  63 123.899   5.343   0.553
  508   1HD1  LEU  63          HD13      LEU  63 126.596   4.453  -0.445
  509   2HD1  LEU  63          HD12      LEU  63 125.166   3.498  -0.839
  510   3HD1  LEU  63          HD11      LEU  63 125.264   5.184  -1.339
  511   1HD2  LEU  63          HD22      LEU  63 124.351   4.033   2.648
  512   2HD2  LEU  63          HD21      LEU  63 123.974   3.025   1.252
  513   3HD2  LEU  63          HD23      LEU  63 125.645   3.198   1.789
  514    H    LYS  64           HN       LYS  64 124.334   8.460   2.151
  515    HA   LYS  64           HA       LYS  64 121.886   8.246   0.691
  516   1HB   LYS  64           HB2      LYS  64 121.991   8.822   3.104
  517   2HB   LYS  64           HB1      LYS  64 122.675  10.393   2.682
  518   1HG   LYS  64           HG2      LYS  64 120.656  10.963   1.410
  519   2HG   LYS  64           HG1      LYS  64 119.974   9.371   1.749
  520   1HD   LYS  64           HD2      LYS  64 120.009   9.861   4.160
  521   2HD   LYS  64           HD1      LYS  64 120.702  11.450   3.832
  522   1HE   LYS  64           HE2      LYS  64 118.231  11.539   4.174
  523   2HE   LYS  64           HE1      LYS  64 118.712  12.100   2.573
  524   1HZ   LYS  64           HZ2      LYS  64 118.283   9.285   2.612
  525   2HZ   LYS  64           HZ1      LYS  64 116.900  10.120   3.138
  526   3HZ   LYS  64           HZ3      LYS  64 117.575  10.469   1.621
  527    H    ASP  65           HN       ASP  65 124.241  10.903   0.868
  528    HA   ASP  65           HA       ASP  65 122.843  12.589  -1.007
  529   1HB   ASP  65           HB2      ASP  65 124.621  13.333   0.653
  530   2HB   ASP  65           HB1      ASP  65 125.815  12.614  -0.428
  531    H    THR  66           HN       THR  66 125.191  10.001  -1.319
  532    HA   THR  66           HA       THR  66 125.826  10.599  -4.087
  533    HB   THR  66           HB       THR  66 126.348   8.162  -2.365
  534    HG1  THR  66           HG1      THR  66 127.428  10.116  -1.824
  535   1HG2  THR  66          HG21      THR  66 127.271   8.849  -5.169
  536   2HG2  THR  66          HG23      THR  66 128.031   7.616  -4.164
  537   3HG2  THR  66          HG22      THR  66 126.353   7.429  -4.667
  538    H    CYS  67           HN       CYS  67 123.531   8.368  -2.477
  539    HA   CYS  67           HA       CYS  67 122.458   7.733  -5.215
  540   1HB   CYS  67           HB2      CYS  67 122.136   5.459  -4.582
  541   2HB   CYS  67           HB1      CYS  67 123.788   5.871  -4.123
  542    HG   CYS  67           HG       CYS  67 122.403   6.431  -1.682
  543    H    GLY  68           HN       GLY  68 121.709   8.329  -1.816
  544   1HA   GLY  68           HA2      GLY  68 119.613   9.464  -1.245
  545   2HA   GLY  68           HA1      GLY  68 118.830   8.638  -2.592
  546    H    ALA  69           HN       ALA  69 120.994   6.667  -0.798
  547    HA   ALA  69           HA       ALA  69 119.104   4.719  -0.100
  548   1HB   ALA  69           HB1      ALA  69 121.668   5.468   1.339
  549   2HB   ALA  69           HB3      ALA  69 120.767   3.978   1.617
  550   3HB   ALA  69           HB2      ALA  69 121.501   4.285   0.043
  551    H    ASN  70           HN       ASN  70 118.022   4.237   1.948
  552    HA   ASN  70           HA       ASN  70 117.185   6.702   3.351
  553   1HB   ASN  70           HB2      ASN  70 116.205   3.839   3.428
  554   2HB   ASN  70           HB1      ASN  70 115.561   5.109   4.469
  555   1HD2  ASN  70          HD22      ASN  70 113.510   4.916   1.314
  556   2HD2  ASN  70          HD21      ASN  70 113.937   3.777   2.498
  557    H    ALA  71           HN       ALA  71 116.840   6.401   5.800
  558    HA   ALA  71           HA       ALA  71 119.363   6.121   7.066
  559   1HB   ALA  71           HB3      ALA  71 117.329   7.386   7.923
  560   2HB   ALA  71           HB2      ALA  71 116.688   5.829   8.448
  561   3HB   ALA  71           HB1      ALA  71 118.196   6.438   9.132
  562    H    LYS  72           HN       LYS  72 116.724   3.767   6.649
  563    HA   LYS  72           HA       LYS  72 117.895   1.834   8.460
  564   1HB   LYS  72           HB2      LYS  72 115.480   1.843   7.719
  565   2HB   LYS  72           HB1      LYS  72 116.027   1.282   6.137
  566   1HG   LYS  72           HG2      LYS  72 117.058  -0.697   7.188
  567   2HG   LYS  72           HG1      LYS  72 116.510  -0.143   8.770
  568   1HD   LYS  72           HD2      LYS  72 114.167  -0.262   8.006
  569   2HD   LYS  72           HD1      LYS  72 114.712  -0.822   6.425
  570   1HE   LYS  72           HE2      LYS  72 114.049  -2.750   7.758
  571   2HE   LYS  72           HE1      LYS  72 115.798  -2.777   7.538
  572   1HZ   LYS  72           HZ1      LYS  72 114.742  -1.378   9.874
  573   2HZ   LYS  72           HZ3      LYS  72 114.699  -3.073   9.893
  574   3HZ   LYS  72           HZ2      LYS  72 116.180  -2.263   9.698
  575    H    GLN  73           HN       GLN  73 118.066   2.360   4.963
  576    HA   GLN  73           HA       GLN  73 119.579  -0.003   4.387
  577   1HB   GLN  73           HB2      GLN  73 119.356   2.623   2.893
  578   2HB   GLN  73           HB1      GLN  73 120.103   1.163   2.243
  579   1HG   GLN  73           HG2      GLN  73 117.253   1.260   3.265
  580   2HG   GLN  73           HG1      GLN  73 117.685   1.495   1.570
  581   1HE2  GLN  73          HE22      GLN  73 117.089  -2.206   2.618
  582   2HE2  GLN  73          HE21      GLN  73 116.294  -0.819   3.191
  583    H    SER  74           HN       SER  74 120.536   3.332   5.205
  584    HA   SER  74           HA       SER  74 123.311   2.964   4.663
  585   1HB   SER  74           HB2      SER  74 123.599   5.054   5.710
  586   2HB   SER  74           HB1      SER  74 121.970   5.138   5.056
  587    HG   SER  74           HG       SER  74 122.122   5.804   7.269
  588    H    ARG  75           HN       ARG  75 121.360   2.432   7.613
  589    HA   ARG  75           HA       ARG  75 123.546   1.975   9.377
  590   1HB   ARG  75           HB2      ARG  75 120.731   0.856   9.370
  591   2HB   ARG  75           HB1      ARG  75 121.881   0.575  10.679
  592   1HG   ARG  75           HG2      ARG  75 122.110   3.002  11.015
  593   2HG   ARG  75           HG1      ARG  75 120.970   3.297   9.708
  594   1HD   ARG  75           HD2      ARG  75 119.813   3.430  11.865
  595   2HD   ARG  75           HD1      ARG  75 119.237   2.030  10.959
  596    HE   ARG  75           HE       ARG  75 121.289   1.003  12.501
  597   1HH1  ARG  75          HH21      ARG  75 118.450   2.878  13.048
  598   2HH1  ARG  75          HH22      ARG  75 118.187   2.261  14.644
  599   1HH2  ARG  75          HH11      ARG  75 120.964   0.187  14.585
  600   2HH2  ARG  75          HH12      ARG  75 119.611   0.738  15.514
  601    H    ASP  76           HN       ASP  76 121.890  -0.219   7.111
  602    HA   ASP  76           HA       ASP  76 123.226  -2.585   8.010
  603   1HB   ASP  76           HB2      ASP  76 121.964  -1.856   5.358
  604   2HB   ASP  76           HB1      ASP  76 122.598  -3.462   5.719
  605    H    CYS  77           HN       CYS  77 124.109  -0.158   5.525
  606    HA   CYS  77           HA       CYS  77 126.353  -1.667   4.547
  607   1HB   CYS  77           HB2      CYS  77 125.669   1.280   4.457
  608   2HB   CYS  77           HB1      CYS  77 127.086   0.594   3.664
  609    HG   CYS  77           HG       CYS  77 125.348   0.383   1.831
  610    H    PHE  78           HN       PHE  78 126.001   0.823   7.089
  611    HA   PHE  78           HA       PHE  78 128.777   1.171   7.591
  612   1HB   PHE  78           HB2      PHE  78 127.080   2.651   8.557
  613   2HB   PHE  78           HB1      PHE  78 126.448   1.321   9.527
  614    HD1  PHE  78           HD1      PHE  78 129.301   3.617   9.035
  615    HD2  PHE  78           HD2      PHE  78 127.620   0.518  11.488
  616    HE1  PHE  78           HE1      PHE  78 130.969   4.111  10.803
  617    HE2  PHE  78           HE2      PHE  78 129.289   1.012  13.257
  618    HZ   PHE  78           HZ       PHE  78 130.963   2.808  12.913
  619    H    GLY  79           HN       GLY  79 126.513  -0.849   9.500
  620   1HA   GLY  79           HA2      GLY  79 128.542  -2.189  10.967
  621   2HA   GLY  79           HA1      GLY  79 126.908  -2.803  10.729
  622    H    CYS  80           HN       CYS  80 127.152  -2.850   7.803
  623    HA   CYS  80           HA       CYS  80 128.282  -5.509   7.541
  624   1HB   CYS  80           HB2      CYS  80 126.402  -4.751   6.158
  625   2HB   CYS  80           HB1      CYS  80 127.434  -3.529   5.417
  626    HG   CYS  80           HG       CYS  80 128.501  -6.396   5.134
  627    H    LEU  81           HN       LEU  81 129.331  -2.291   6.310
  628    HA   LEU  81           HA       LEU  81 131.780  -3.369   5.214
  629   1HB   LEU  81           HB2      LEU  81 131.045  -0.539   6.030
  630   2HB   LEU  81           HB1      LEU  81 132.447  -0.980   5.060
  631    HG   LEU  81           HG       LEU  81 129.617  -1.700   4.252
  632   1HD1  LEU  81          HD12      LEU  81 131.248   0.775   3.632
  633   2HD1  LEU  81          HD11      LEU  81 129.868   0.265   2.658
  634   3HD1  LEU  81          HD13      LEU  81 129.640   0.697   4.353
  635   1HD2  LEU  81          HD21      LEU  81 132.311  -1.675   2.872
  636   2HD2  LEU  81          HD23      LEU  81 131.175  -3.012   3.022
  637   3HD2  LEU  81          HD22      LEU  81 130.809  -1.664   1.955
  638    H    ARG  82           HN       ARG  82 130.875  -1.824   8.285
  639    HA   ARG  82           HA       ARG  82 133.504  -1.629   9.366
  640   1HB   ARG  82           HB2      ARG  82 131.557  -0.500  10.381
  641   2HB   ARG  82           HB1      ARG  82 130.894  -2.069  10.844
  642   1HG   ARG  82           HG2      ARG  82 132.801  -2.514  12.284
  643   2HG   ARG  82           HG1      ARG  82 133.610  -1.049  11.727
  644   1HD   ARG  82           HD2      ARG  82 132.601  -0.563  13.865
  645   2HD   ARG  82           HD1      ARG  82 131.659   0.270  12.627
  646    HE   ARG  82           HE       ARG  82 130.358  -2.155  12.914
  647   1HH1  ARG  82          HH21      ARG  82 131.435   0.361  15.008
  648   2HH1  ARG  82          HH22      ARG  82 130.154   0.139  16.153
  649   1HH2  ARG  82          HH11      ARG  82 128.678  -2.461  14.395
  650   2HH2  ARG  82          HH12      ARG  82 128.593  -1.459  15.806
  651    H    GLU  83           HN       GLU  83 131.130  -4.281   9.446
  652    HA   GLU  83           HA       GLU  83 132.687  -5.941  11.195
  653   1HB   GLU  83           HB2      GLU  83 130.418  -6.500   9.277
  654   2HB   GLU  83           HB1      GLU  83 131.200  -7.790  10.190
  655   1HG   GLU  83           HG2      GLU  83 130.068  -5.305  11.499
  656   2HG   GLU  83           HG1      GLU  83 129.138  -6.790  11.291
  657    H    TRP  84           HN       TRP  84 132.554  -5.681   7.618
  658    HA   TRP  84           HA       TRP  84 134.200  -7.960   7.117
  659   1HB   TRP  84           HB2      TRP  84 132.949  -6.671   5.345
  660   2HB   TRP  84           HB1      TRP  84 134.158  -5.393   5.500
  661    HD1  TRP  84           HD1      TRP  84 133.712  -8.983   4.313
  662    HE1  TRP  84           HE1      TRP  84 135.761  -9.674   2.915
  663    HE3  TRP  84           HE3      TRP  84 136.708  -4.912   5.066
  664    HZ2  TRP  84           HZ2      TRP  84 138.336  -8.640   2.210
  665    HZ3  TRP  84           HZ3      TRP  84 138.955  -4.798   4.022
  666    HH2  TRP  84           HH2      TRP  84 139.770  -6.653   2.594
  667    H    CYS  85           HN       CYS  85 134.988  -4.531   7.698
  668    HA   CYS  85           HA       CYS  85 137.798  -4.725   7.378
  669   1HB   CYS  85           HB2      CYS  85 136.039  -2.910   9.036
  670   2HB   CYS  85           HB1      CYS  85 137.789  -2.718   8.990
  671    HG   CYS  85           HG       CYS  85 136.911  -2.817   6.166
  672    H    ASP  86           HN       ASP  86 135.749  -5.283  10.218
  673    HA   ASP  86           HA       ASP  86 137.817  -5.607  12.138
  674   1HB   ASP  86           HB2      ASP  86 135.070  -6.865  11.936
  675   2HB   ASP  86           HB1      ASP  86 136.119  -7.052  13.340
  676    H    ALA  87           HN       ALA  87 136.534  -7.837   9.722
  677    HA   ALA  87           HA       ALA  87 138.147 -10.068  10.830
  678   1HB   ALA  87           HB2      ALA  87 135.758 -10.300   9.904
  679   2HB   ALA  87           HB1      ALA  87 136.492 -10.147   8.307
  680   3HB   ALA  87           HB3      ALA  87 136.949 -11.482   9.365
  681    H    PHE  88           HN       PHE  88 138.122  -7.914   8.014
  682    HA   PHE  88           HA       PHE  88 140.571  -9.306   6.975
  683   1HB   PHE  88           HB2      PHE  88 138.543  -7.547   5.599
  684   2HB   PHE  88           HB1      PHE  88 139.995  -8.182   4.828
  685    HD1  PHE  88           HD2      PHE  88 140.307 -10.662   4.620
  686    HD2  PHE  88           HD1      PHE  88 136.615  -8.917   5.957
  687    HE1  PHE  88           HE2      PHE  88 139.129 -12.795   4.154
  688    HE2  PHE  88           HE1      PHE  88 135.438 -11.051   5.491
  689    HZ   PHE  88           HZ       PHE  88 136.696 -12.985   4.583
  690    H    LEU  89           HN       LEU  89 139.857  -6.567   8.752
  691    HA   LEU  89           HA       LEU  89 142.354  -5.230   7.769
  692   1HB   LEU  89           HB2      LEU  89 140.244  -4.153   6.802
  693   2HB   LEU  89           HB1      LEU  89 139.811  -3.729   8.455
  694    HG   LEU  89           HG       LEU  89 142.210  -2.666   8.543
  695   1HD1  LEU  89          HD13      LEU  89 141.686  -2.760   5.552
  696   2HD1  LEU  89          HD12      LEU  89 142.924  -1.769   6.326
  697   3HD1  LEU  89          HD11      LEU  89 143.030  -3.525   6.399
  698   1HD2  LEU  89          HD22      LEU  89 139.813  -1.544   7.085
  699   2HD2  LEU  89          HD21      LEU  89 140.325  -1.239   8.744
  700   3HD2  LEU  89          HD23      LEU  89 141.246  -0.562   7.400
  701   1H    MET   1           HT1      MET   1 170.322  -2.662  -3.738
  702   2H    MET   1           HT3      MET   1 170.607  -1.676  -5.087
  703   3H    MET   1           HT2      MET   1 170.256  -0.971  -3.583
  704    HA   MET   1           HA       MET   1 168.169  -0.838  -4.319
  705   1HB   MET   1           HB2      MET   1 167.370  -2.162  -6.259
  706   2HB   MET   1           HB1      MET   1 168.885  -1.334  -6.617
  707   1HG   MET   1           HG2      MET   1 170.120  -3.428  -6.058
  708   2HG   MET   1           HG1      MET   1 168.574  -4.245  -5.825
  709   1HE   MET   1           HE3      MET   1 170.824  -5.199  -7.651
  710   2HE   MET   1           HE2      MET   1 169.299  -6.079  -7.652
  711   3HE   MET   1           HE1      MET   1 170.047  -5.626  -9.181
  712    H    THR   2           HN       THR   2 169.487  -3.073  -2.511
  713    HA   THR   2           HA       THR   2 167.475  -5.172  -2.465
  714    HB   THR   2           HB       THR   2 169.410  -4.408  -0.262
  715    HG1  THR   2           HG1      THR   2 170.786  -4.846  -1.809
  716   1HG2  THR   2          HG23      THR   2 167.969  -6.967  -1.000
  717   2HG2  THR   2          HG22      THR   2 169.234  -6.863   0.224
  718   3HG2  THR   2          HG21      THR   2 167.718  -5.991   0.447
  719    H    THR   3           HN       THR   3 165.538  -5.133  -1.404
  720    HA   THR   3           HA       THR   3 164.620  -2.691  -0.162
  721    HB   THR   3           HB       THR   3 162.595  -4.059   0.405
  722    HG1  THR   3           HG1      THR   3 162.577  -6.196  -0.304
  723   1HG2  THR   3          HG21      THR   3 163.699  -4.220  -2.408
  724   2HG2  THR   3          HG23      THR   3 162.025  -4.586  -1.993
  725   3HG2  THR   3          HG22      THR   3 162.662  -2.960  -1.740
  726    H    SER   4           HN       SER   4 163.916  -2.488   2.081
  727    HA   SER   4           HA       SER   4 165.844  -3.697   3.937
  728   1HB   SER   4           HB2      SER   4 163.629  -1.663   4.297
  729   2HB   SER   4           HB1      SER   4 164.648  -2.228   5.618
  730    HG   SER   4           HG       SER   4 165.984  -1.452   3.329
  731    H    GLN   5           HN       GLN   5 164.935  -4.481   6.096
  732    HA   GLN   5           HA       GLN   5 163.319  -6.799   5.679
  733   1HB   GLN   5           HB2      GLN   5 164.106  -5.316   8.201
  734   2HB   GLN   5           HB1      GLN   5 163.241  -6.851   8.214
  735   1HG   GLN   5           HG2      GLN   5 165.081  -7.901   6.948
  736   2HG   GLN   5           HG1      GLN   5 165.950  -6.365   6.940
  737   1HE2  GLN   5          HE22      GLN   5 165.725  -6.897  10.810
  738   2HE2  GLN   5          HE21      GLN   5 164.626  -6.054   9.828
  739    H    LYS   6           HN       LYS   6 162.429  -3.485   6.280
  740    HA   LYS   6           HA       LYS   6 159.953  -3.893   7.597
  741   1HB   LYS   6           HB2      LYS   6 160.910  -1.714   5.739
  742   2HB   LYS   6           HB1      LYS   6 159.374  -1.648   6.607
  743   1HG   LYS   6           HG2      LYS   6 160.569  -1.891   8.751
  744   2HG   LYS   6           HG1      LYS   6 162.106  -1.954   7.887
  745   1HD   LYS   6           HD2      LYS   6 161.700   0.308   6.991
  746   2HD   LYS   6           HD1      LYS   6 160.165   0.376   7.858
  747   1HE   LYS   6           HE2      LYS   6 161.318   0.179  10.000
  748   2HE   LYS   6           HE1      LYS   6 162.866  -0.011   9.176
  749   1HZ   LYS   6           HZ1      LYS   6 161.847   2.270   8.114
  750   2HZ   LYS   6           HZ3      LYS   6 161.383   2.373   9.742
  751   3HZ   LYS   6           HZ2      LYS   6 163.023   2.186   9.338
  752    H    HIS   7           HN       HIS   7 160.799  -3.910   4.141
  753    HA   HIS   7           HA       HIS   7 158.154  -3.924   3.119
  754   1HB   HIS   7           HB2      HIS   7 159.994  -3.625   1.595
  755   2HB   HIS   7           HB1      HIS   7 160.710  -5.164   2.065
  756    HD2  HIS   7           HD2      HIS   7 159.504  -7.456   0.890
  757    HE1  HIS   7           HE1      HIS   7 156.880  -5.340  -1.646
  758    HE2  HIS   7           HE2      HIS   7 157.832  -7.621  -1.100
  759    H    ARG   8           HN       ARG   8 160.238  -6.722   3.936
  760    HA   ARG   8           HA       ARG   8 158.189  -8.659   3.392
  761   1HB   ARG   8           HB2      ARG   8 160.712  -8.823   5.070
  762   2HB   ARG   8           HB1      ARG   8 159.723 -10.211   4.621
  763   1HG   ARG   8           HG2      ARG   8 160.882  -8.328   2.560
  764   2HG   ARG   8           HG1      ARG   8 161.785  -9.709   3.153
  765   1HD   ARG   8           HD2      ARG   8 159.157  -9.735   1.651
  766   2HD   ARG   8           HD1      ARG   8 160.691 -10.399   1.119
  767    HE   ARG   8           HE       ARG   8 158.700 -11.747   2.690
  768   1HH1  ARG   8          HH21      ARG   8 162.121 -11.305   2.515
  769   2HH1  ARG   8          HH22      ARG   8 162.469 -12.664   3.528
  770   1HH2  ARG   8          HH11      ARG   8 159.149 -13.522   3.985
  771   2HH2  ARG   8          HH12      ARG   8 160.794 -13.918   4.352
  772    H    ASP   9           HN       ASP   9 159.142  -6.849   6.246
  773    HA   ASP   9           HA       ASP   9 157.586  -8.431   8.102
  774   1HB   ASP   9           HB2      ASP   9 158.672  -5.624   8.265
  775   2HB   ASP   9           HB1      ASP   9 157.815  -6.401   9.588
  776    H    PHE  10           HN       PHE  10 156.927  -5.503   6.186
  777    HA   PHE  10           HA       PHE  10 154.396  -4.927   7.405
  778   1HB   PHE  10           HB2      PHE  10 155.720  -3.369   5.922
  779   2HB   PHE  10           HB1      PHE  10 155.202  -4.341   4.544
  780    HD1  PHE  10           HD2      PHE  10 152.853  -4.390   3.840
  781    HD2  PHE  10           HD1      PHE  10 154.136  -1.988   7.163
  782    HE1  PHE  10           HE2      PHE  10 150.694  -3.168   3.792
  783    HE2  PHE  10           HE1      PHE  10 151.977  -0.767   7.116
  784    HZ   PHE  10           HZ       PHE  10 150.256  -1.359   5.430
  785    H    VAL  11           HN       VAL  11 155.240  -6.826   4.492
  786    HA   VAL  11           HA       VAL  11 152.427  -7.566   4.075
  787    HB   VAL  11           HB       VAL  11 153.314  -8.917   2.210
  788   1HG1  VAL  11          HG11      VAL  11 154.570  -6.161   2.423
  789   2HG1  VAL  11          HG13      VAL  11 154.333  -7.058   0.923
  790   3HG1  VAL  11          HG12      VAL  11 152.938  -6.507   1.853
  791   1HG2  VAL  11          HG22      VAL  11 155.940  -8.196   3.513
  792   2HG2  VAL  11          HG21      VAL  11 155.350  -9.792   3.053
  793   3HG2  VAL  11          HG23      VAL  11 155.855  -8.647   1.809
  794    H    ALA  12           HN       ALA  12 154.297  -8.413   6.485
  795    HA   ALA  12           HA       ALA  12 153.766 -11.362   6.340
  796   1HB   ALA  12           HB1      ALA  12 155.677  -9.760   8.050
  797   2HB   ALA  12           HB3      ALA  12 155.383 -11.485   8.255
  798   3HB   ALA  12           HB2      ALA  12 156.096 -10.884   6.759
  799    H    GLU  13           HN       GLU  13 152.617  -8.478   7.777
  800    HA   GLU  13           HA       GLU  13 150.856 -10.057   9.518
  801   1HB   GLU  13           HB2      GLU  13 151.427  -8.694  11.545
  802   2HB   GLU  13           HB1      GLU  13 152.752  -9.725  11.013
  803   1HG   GLU  13           HG2      GLU  13 153.737  -7.795   9.797
  804   2HG   GLU  13           HG1      GLU  13 152.436  -6.771  10.408
  805    HA   PRO  14           HA       PRO  14 147.774  -7.036   8.427
  806   1HB   PRO  14           HB2      PRO  14 147.524  -6.600  11.396
  807   2HB   PRO  14           HB1      PRO  14 146.244  -6.801  10.180
  808   1HG   PRO  14           HG2      PRO  14 146.971  -8.815  11.780
  809   2HG   PRO  14           HG1      PRO  14 146.500  -9.091  10.093
  810   1HD   PRO  14           HD2      PRO  14 149.199  -9.274  11.323
  811   2HD   PRO  14           HD1      PRO  14 148.587 -10.020   9.831
  812    H    MET  15           HN       MET  15 147.392  -4.656   8.564
  813    HA   MET  15           HA       MET  15 149.929  -3.214   9.056
  814   1HB   MET  15           HB2      MET  15 148.541  -1.278   8.063
  815   2HB   MET  15           HB1      MET  15 148.915  -2.627   6.990
  816   1HG   MET  15           HG2      MET  15 146.737  -3.504   7.123
  817   2HG   MET  15           HG1      MET  15 146.366  -2.617   8.603
  818   1HE   MET  15           HE1      MET  15 147.487  -2.474   5.098
  819   2HE   MET  15           HE3      MET  15 145.766  -2.492   4.682
  820   3HE   MET  15           HE2      MET  15 146.744  -1.065   4.342
  821    H    GLY  16           HN       GLY  16 146.750  -3.582  10.452
  822   1HA   GLY  16           HA2      GLY  16 145.764  -2.608  12.347
  823   2HA   GLY  16           HA1      GLY  16 147.413  -2.534  12.969
  824    H    GLU  17           HN       GLU  17 147.438  -0.496  13.856
  825    HA   GLU  17           HA       GLU  17 146.550   1.814  12.178
  826   1HB   GLU  17           HB2      GLU  17 147.076   1.510  15.145
  827   2HB   GLU  17           HB1      GLU  17 146.695   3.049  14.369
  828   1HG   GLU  17           HG2      GLU  17 144.570   2.115  13.539
  829   2HG   GLU  17           HG1      GLU  17 144.947   0.571  14.306
  830    H    LYS  18           HN       LYS  18 149.175   0.392  11.842
  831    HA   LYS  18           HA       LYS  18 151.295   1.893  12.996
  832   1HB   LYS  18           HB2      LYS  18 151.108   0.451  10.335
  833   2HB   LYS  18           HB1      LYS  18 152.613   1.076  10.996
  834   1HG   LYS  18           HG2      LYS  18 150.875  -0.777  12.630
  835   2HG   LYS  18           HG1      LYS  18 151.989  -1.427  11.433
  836   1HD   LYS  18           HD2      LYS  18 153.816  -0.042  12.585
  837   2HD   LYS  18           HD1      LYS  18 152.654   0.210  13.889
  838   1HE   LYS  18           HE2      LYS  18 153.944  -1.703  14.516
  839   2HE   LYS  18           HE1      LYS  18 152.390  -2.326  13.961
  840   1HZ   LYS  18           HZ1      LYS  18 154.373  -2.001  11.886
  841   2HZ   LYS  18           HZ3      LYS  18 154.772  -3.163  13.055
  842   3HZ   LYS  18           HZ2      LYS  18 153.316  -3.297  12.188
  843    HA   PRO  19           HA       PRO  19 150.895   5.794  10.913
  844   1HB   PRO  19           HB2      PRO  19 153.522   6.626  10.792
  845   2HB   PRO  19           HB1      PRO  19 152.560   6.630  12.284
  846   1HG   PRO  19           HG2      PRO  19 154.552   4.617  11.331
  847   2HG   PRO  19           HG1      PRO  19 154.325   5.295  12.955
  848   1HD   PRO  19           HD2      PRO  19 153.380   2.840  12.292
  849   2HD   PRO  19           HD1      PRO  19 152.523   3.894  13.437
  850    H    VAL  20           HN       VAL  20 151.286   6.897   8.909
  851    HA   VAL  20           HA       VAL  20 151.379   5.279   6.612
  852    HB   VAL  20           HB       VAL  20 150.437   7.505   6.518
  853   1HG1  VAL  20          HG13      VAL  20 152.095   8.460   8.203
  854   2HG1  VAL  20          HG12      VAL  20 153.235   8.612   6.865
  855   3HG1  VAL  20          HG11      VAL  20 151.717   9.507   6.836
  856   1HG2  VAL  20          HG21      VAL  20 151.623   6.496   4.479
  857   2HG2  VAL  20          HG23      VAL  20 151.353   8.239   4.442
  858   3HG2  VAL  20          HG22      VAL  20 152.949   7.600   4.836
  859    H    GLY  21           HN       GLY  21 154.013   7.176   8.081
  860   1HA   GLY  21           HA2      GLY  21 155.995   6.724   6.139
  861   2HA   GLY  21           HA1      GLY  21 156.333   6.993   7.847
  862    H    SER  22           HN       SER  22 154.403   4.339   7.886
  863    HA   SER  22           HA       SER  22 156.704   2.561   8.255
  864   1HB   SER  22           HB2      SER  22 153.721   2.024   8.389
  865   2HB   SER  22           HB1      SER  22 154.978   0.882   8.858
  866    HG   SER  22           HG       SER  22 154.472   1.904  10.709
  867    H    LEU  23           HN       LEU  23 154.478   3.341   5.721
  868    HA   LEU  23           HA       LEU  23 154.532   0.874   4.273
  869   1HB   LEU  23           HB2      LEU  23 154.257   3.717   3.260
  870   2HB   LEU  23           HB1      LEU  23 153.901   2.272   2.315
  871    HG   LEU  23           HG       LEU  23 152.557   2.951   4.948
  872   1HD1  LEU  23          HD13      LEU  23 152.088   4.576   3.062
  873   2HD1  LEU  23          HD12      LEU  23 151.411   3.224   2.158
  874   3HD1  LEU  23          HD11      LEU  23 150.668   3.730   3.674
  875   1HD2  LEU  23          HD21      LEU  23 152.273   0.738   2.916
  876   2HD2  LEU  23          HD23      LEU  23 152.268   0.641   4.677
  877   3HD2  LEU  23          HD22      LEU  23 150.855   1.255   3.827
  878    H    ALA  24           HN       ALA  24 156.013   0.023   2.891
  879    HA   ALA  24           HA       ALA  24 158.724   0.973   2.954
  880   1HB   ALA  24           HB1      ALA  24 157.953  -1.405   2.482
  881   2HB   ALA  24           HB3      ALA  24 157.532  -0.854   0.862
  882   3HB   ALA  24           HB2      ALA  24 159.207  -0.792   1.404
  883    H    GLY  25           HN       GLY  25 159.802   2.310   1.589
  884   1HA   GLY  25           HA2      GLY  25 160.186   3.421  -0.554
  885   2HA   GLY  25           HA1      GLY  25 158.470   3.241  -0.925
  886    H    ILE  26           HN       ILE  26 158.036   4.082   2.045
  887    HA   ILE  26           HA       ILE  26 158.031   7.018   1.480
  888    HB   ILE  26           HB       ILE  26 156.667   5.467   3.708
  889   1HG1  ILE  26          HG12      ILE  26 155.724   4.733   1.601
  890   2HG1  ILE  26          HG11      ILE  26 154.586   5.856   2.341
  891   1HG2  ILE  26          HG22      ILE  26 156.411   8.308   2.691
  892   2HG2  ILE  26          HG21      ILE  26 155.275   7.565   3.818
  893   3HG2  ILE  26          HG23      ILE  26 156.961   7.791   4.284
  894   1HD1  ILE  26          HD12      ILE  26 155.841   7.667   0.917
  895   2HD1  ILE  26          HD11      ILE  26 156.395   6.284  -0.026
  896   3HD1  ILE  26          HD13      ILE  26 154.670   6.614   0.125
  897    H    GLY  27           HN       GLY  27 159.777   8.113   2.334
  898   1HA   GLY  27           HA2      GLY  27 161.264   6.904   4.586
  899   2HA   GLY  27           HA1      GLY  27 161.778   8.293   3.625
  900    H    GLU  28           HN       GLU  28 162.033   8.628   6.268
  901    HA   GLU  28           HA       GLU  28 159.796   9.481   7.759
  902   1HB   GLU  28           HB2      GLU  28 162.679  10.405   7.822
  903   2HB   GLU  28           HB1      GLU  28 161.480  10.899   9.016
  904   1HG   GLU  28           HG2      GLU  28 161.077   8.548   9.610
  905   2HG   GLU  28           HG1      GLU  28 162.245   8.031   8.394
  906    H    VAL  29           HN       VAL  29 161.819  11.365   5.487
  907    HA   VAL  29           HA       VAL  29 160.477  13.860   6.054
  908    HB   VAL  29           HB       VAL  29 162.126  12.928   3.688
  909   1HG1  VAL  29          HG12      VAL  29 160.791  15.579   4.251
  910   2HG1  VAL  29          HG11      VAL  29 162.251  15.483   3.265
  911   3HG1  VAL  29          HG13      VAL  29 160.787  14.642   2.757
  912   1HG2  VAL  29          HG22      VAL  29 162.662  14.713   6.080
  913   2HG2  VAL  29          HG21      VAL  29 163.406  13.152   5.732
  914   3HG2  VAL  29          HG23      VAL  29 163.767  14.548   4.715
  915    H    LEU  30           HN       LEU  30 160.026  11.360   3.578
  916    HA   LEU  30           HA       LEU  30 157.936  12.731   2.160
  917   1HB   LEU  30           HB2      LEU  30 158.468   9.751   2.379
  918   2HB   LEU  30           HB1      LEU  30 157.459  10.530   1.161
  919    HG   LEU  30           HG       LEU  30 160.432  10.989   1.554
  920   1HD1  LEU  30          HD11      LEU  30 158.826   9.463  -0.509
  921   2HD1  LEU  30          HD13      LEU  30 160.512   9.920  -0.748
  922   3HD1  LEU  30          HD12      LEU  30 160.072   8.830   0.568
  923   1HD2  LEU  30          HD23      LEU  30 158.358  12.270  -0.221
  924   2HD2  LEU  30          HD22      LEU  30 159.682  13.024   0.670
  925   3HD2  LEU  30          HD21      LEU  30 160.018  12.114  -0.798
  926    H    GLY  31           HN       GLY  31 157.944  10.452   4.865
  927   1HA   GLY  31           HA2      GLY  31 155.135   9.996   4.993
  928   2HA   GLY  31           HA1      GLY  31 156.232   9.886   6.371
  929    H    LYS  32           HN       LYS  32 157.146  12.609   6.280
  930    HA   LYS  32           HA       LYS  32 155.141  13.856   7.882
  931   1HB   LYS  32           HB2      LYS  32 157.595  14.956   6.499
  932   2HB   LYS  32           HB1      LYS  32 156.591  15.913   7.590
  933   1HG   LYS  32           HG2      LYS  32 157.010  14.390   9.424
  934   2HG   LYS  32           HG1      LYS  32 157.832  13.257   8.359
  935   1HD   LYS  32           HD2      LYS  32 159.620  14.383   9.390
  936   2HD   LYS  32           HD1      LYS  32 159.453  15.244   7.862
  937   1HE   LYS  32           HE2      LYS  32 159.678  16.804   9.774
  938   2HE   LYS  32           HE1      LYS  32 158.122  16.989   8.969
  939   1HZ   LYS  32           HZ3      LYS  32 157.905  15.006  10.947
  940   2HZ   LYS  32           HZ2      LYS  32 158.604  16.390  11.644
  941   3HZ   LYS  32           HZ1      LYS  32 157.103  16.498  10.855
  942    H    LYS  33           HN       LYS  33 155.975  14.312   4.422
  943    HA   LYS  33           HA       LYS  33 154.196  16.546   4.074
  944   1HB   LYS  33           HB2      LYS  33 155.217  14.502   2.078
  945   2HB   LYS  33           HB1      LYS  33 154.311  15.949   1.633
  946   1HG   LYS  33           HG2      LYS  33 156.035  17.362   2.687
  947   2HG   LYS  33           HG1      LYS  33 156.947  15.918   3.133
  948   1HD   LYS  33           HD2      LYS  33 157.144  15.317   0.736
  949   2HD   LYS  33           HD1      LYS  33 156.270  16.788   0.308
  950   1HE   LYS  33           HE2      LYS  33 158.021  18.173   1.267
  951   2HE   LYS  33           HE1      LYS  33 158.863  16.748   1.876
  952   1HZ   LYS  33           HZ2      LYS  33 158.404  16.387  -0.855
  953   2HZ   LYS  33           HZ1      LYS  33 159.071  17.936  -0.651
  954   3HZ   LYS  33           HZ3      LYS  33 159.892  16.577  -0.058
  955    H    LEU  34           HN       LEU  34 153.714  13.034   3.569
  956    HA   LEU  34           HA       LEU  34 151.021  13.245   2.623
  957   1HB   LEU  34           HB2      LEU  34 152.462  11.026   4.096
  958   2HB   LEU  34           HB1      LEU  34 150.838  10.856   3.450
  959    HG   LEU  34           HG       LEU  34 153.225  11.655   1.766
  960   1HD1  LEU  34          HD12      LEU  34 151.942   8.934   2.162
  961   2HD1  LEU  34          HD11      LEU  34 153.177   9.306   0.959
  962   3HD1  LEU  34          HD13      LEU  34 153.562   9.403   2.677
  963   1HD2  LEU  34          HD22      LEU  34 150.318  11.038   1.219
  964   2HD2  LEU  34          HD21      LEU  34 151.339  12.303   0.541
  965   3HD2  LEU  34          HD23      LEU  34 151.519  10.641  -0.006
  966    H    GLU  35           HN       GLU  35 152.393  12.962   5.861
  967    HA   GLU  35           HA       GLU  35 149.939  12.672   7.289
  968   1HB   GLU  35           HB2      GLU  35 152.139  12.292   8.329
  969   2HB   GLU  35           HB1      GLU  35 152.506  14.011   8.193
  970   1HG   GLU  35           HG2      GLU  35 150.620  14.553   9.674
  971   2HG   GLU  35           HG1      GLU  35 150.192  12.844   9.773
  972    H    GLU  36           HN       GLU  36 151.689  15.604   6.308
  973    HA   GLU  36           HA       GLU  36 149.923  17.431   7.646
  974   1HB   GLU  36           HB2      GLU  36 151.760  17.764   5.261
  975   2HB   GLU  36           HB1      GLU  36 150.881  19.103   6.000
  976   1HG   GLU  36           HG2      GLU  36 151.961  18.622   8.167
  977   2HG   GLU  36           HG1      GLU  36 152.845  17.285   7.429
  978    H    ARG  37           HN       ARG  37 149.658  15.624   4.703
  979    HA   ARG  37           HA       ARG  37 147.500  17.373   3.670
  980   1HB   ARG  37           HB2      ARG  37 148.737  14.837   2.576
  981   2HB   ARG  37           HB1      ARG  37 147.410  15.696   1.793
  982   1HG   ARG  37           HG2      ARG  37 148.885  17.783   1.868
  983   2HG   ARG  37           HG1      ARG  37 150.210  16.716   2.330
  984   1HD   ARG  37           HD2      ARG  37 150.314  16.991  -0.056
  985   2HD   ARG  37           HD1      ARG  37 149.706  15.360   0.250
  986    HE   ARG  37           HE       ARG  37 147.390  16.792   0.025
  987   1HH1  ARG  37          HH21      ARG  37 150.293  16.624  -1.830
  988   2HH1  ARG  37          HH22      ARG  37 149.497  16.887  -3.345
  989   1HH2  ARG  37          HH11      ARG  37 146.334  17.132  -1.945
  990   2HH2  ARG  37          HH12      ARG  37 147.257  17.176  -3.410
  991    H    GLY  38           HN       GLY  38 147.504  15.077   6.058
  992   1HA   GLY  38           HA2      GLY  38 145.337  14.562   7.073
  993   2HA   GLY  38           HA1      GLY  38 144.633  14.432   5.471
  994    H    PHE  39           HN       PHE  39 147.631  12.862   5.440
  995    HA   PHE  39           HA       PHE  39 146.258  10.219   5.807
  996   1HB   PHE  39           HB2      PHE  39 148.825  10.970   4.402
  997   2HB   PHE  39           HB1      PHE  39 148.204   9.329   4.530
  998    HD1  PHE  39           HD2      PHE  39 146.156   8.668   3.337
  999    HD2  PHE  39           HD1      PHE  39 147.811  12.607   2.948
 1000    HE1  PHE  39           HE2      PHE  39 144.724   9.070   1.352
 1001    HE2  PHE  39           HE1      PHE  39 146.380  13.014   0.964
 1002    HZ   PHE  39           HZ       PHE  39 144.832  11.242   0.162
 1003    H    ASP  40           HN       ASP  40 146.541  10.697   8.215
 1004    HA   ASP  40           HA       ASP  40 149.260  10.674   9.266
 1005   1HB   ASP  40           HB2      ASP  40 148.206  10.686  11.445
 1006   2HB   ASP  40           HB1      ASP  40 147.315  11.793  10.401
 1007    H    LYS  41           HN       LYS  41 147.165   8.212   8.135
 1008    HA   LYS  41           HA       LYS  41 148.891   6.170   9.477
 1009   1HB   LYS  41           HB2      LYS  41 145.867   6.144   9.345
 1010   2HB   LYS  41           HB1      LYS  41 146.846   4.738   9.771
 1011   1HG   LYS  41           HG2      LYS  41 147.858   6.000  11.637
 1012   2HG   LYS  41           HG1      LYS  41 146.879   7.406  11.216
 1013   1HD   LYS  41           HD2      LYS  41 144.825   6.096  11.623
 1014   2HD   LYS  41           HD1      LYS  41 145.815   4.699  12.052
 1015   1HE   LYS  41           HE2      LYS  41 146.868   6.074  13.865
 1016   2HE   LYS  41           HE1      LYS  41 145.705   7.351  13.506
 1017   1HZ   LYS  41           HZ3      LYS  41 144.808   4.596  14.064
 1018   2HZ   LYS  41           HZ2      LYS  41 145.139   5.675  15.334
 1019   3HZ   LYS  41           HZ1      LYS  41 143.935   6.045  14.195
 1020    H    ALA  42           HN       ALA  42 148.946   4.128   8.381
 1021    HA   ALA  42           HA       ALA  42 149.252   4.399   5.551
 1022   1HB   ALA  42           HB3      ALA  42 149.321   2.073   7.454
 1023   2HB   ALA  42           HB2      ALA  42 149.475   1.813   5.716
 1024   3HB   ALA  42           HB1      ALA  42 150.650   2.816   6.566
 1025    H    TYR  43           HN       TYR  43 146.612   2.806   7.419
 1026    HA   TYR  43           HA       TYR  43 145.404   1.601   5.158
 1027   1HB   TYR  43           HB2      TYR  43 143.387   1.339   6.415
 1028   2HB   TYR  43           HB1      TYR  43 144.743   1.100   7.507
 1029    HD1  TYR  43           HD1      TYR  43 142.321   3.734   6.343
 1030    HD2  TYR  43           HD2      TYR  43 144.844   2.306   9.516
 1031    HE1  TYR  43           HE1      TYR  43 141.388   5.449   7.858
 1032    HE2  TYR  43           HE2      TYR  43 143.891   4.021  11.027
 1033    HH   TYR  43           HH       TYR  43 141.110   5.816  10.266
 1034    H    VAL  44           HN       VAL  44 145.539   4.961   5.934
 1035    HA   VAL  44           HA       VAL  44 143.161   5.650   4.341
 1036    HB   VAL  44           HB       VAL  44 145.456   7.443   5.217
 1037   1HG1  VAL  44          HG13      VAL  44 143.866   8.217   3.354
 1038   2HG1  VAL  44          HG12      VAL  44 142.596   8.199   4.572
 1039   3HG1  VAL  44          HG11      VAL  44 143.985   9.268   4.762
 1040   1HG2  VAL  44          HG22      VAL  44 142.824   6.770   6.565
 1041   2HG2  VAL  44          HG21      VAL  44 144.445   6.457   7.187
 1042   3HG2  VAL  44          HG23      VAL  44 143.862   8.115   7.043
 1043    H    VAL  45           HN       VAL  45 146.604   5.390   3.966
 1044    HA   VAL  45           HA       VAL  45 146.705   6.499   1.269
 1045    HB   VAL  45           HB       VAL  45 148.710   4.814   2.801
 1046   1HG1  VAL  45          HG13      VAL  45 148.832   6.214   0.124
 1047   2HG1  VAL  45          HG12      VAL  45 150.289   5.860   1.053
 1048   3HG1  VAL  45          HG11      VAL  45 149.253   4.544   0.502
 1049   1HG2  VAL  45          HG21      VAL  45 148.469   7.794   2.281
 1050   2HG2  VAL  45          HG23      VAL  45 148.287   6.985   3.837
 1051   3HG2  VAL  45          HG22      VAL  45 149.860   7.024   3.041
 1052    H    LEU  46           HN       LEU  46 146.561   3.232   2.676
 1053    HA   LEU  46           HA       LEU  46 146.808   1.803   0.210
 1054   1HB   LEU  46           HB2      LEU  46 146.868   0.668   2.425
 1055   2HB   LEU  46           HB1      LEU  46 145.172   1.077   2.669
 1056    HG   LEU  46           HG       LEU  46 144.628  -0.225   0.579
 1057   1HD1  LEU  46          HD12      LEU  46 147.586  -0.761   0.714
 1058   2HD1  LEU  46          HD11      LEU  46 146.500  -1.936  -0.023
 1059   3HD1  LEU  46          HD13      LEU  46 146.609  -0.308  -0.680
 1060   1HD2  LEU  46          HD22      LEU  46 144.746  -1.158   3.059
 1061   2HD2  LEU  46          HD21      LEU  46 144.460  -2.238   1.699
 1062   3HD2  LEU  46          HD23      LEU  46 146.071  -2.118   2.399
 1063    H    GLY  47           HN       GLY  47 144.116   3.322   1.885
 1064   1HA   GLY  47           HA2      GLY  47 141.939   2.449   0.338
 1065   2HA   GLY  47           HA1      GLY  47 142.032   4.053   1.068
 1066    H    GLN  48           HN       GLN  48 144.214   5.125  -0.329
 1067    HA   GLN  48           HA       GLN  48 142.990   6.025  -2.745
 1068   1HB   GLN  48           HB2      GLN  48 144.785   7.269  -1.574
 1069   2HB   GLN  48           HB1      GLN  48 145.934   5.999  -1.990
 1070   1HG   GLN  48           HG2      GLN  48 146.173   7.841  -3.566
 1071   2HG   GLN  48           HG1      GLN  48 145.496   6.454  -4.414
 1072   1HE2  GLN  48          HE22      GLN  48 142.713   9.311  -3.415
 1073   2HE2  GLN  48          HE21      GLN  48 143.810   8.770  -2.238
 1074    H    PHE  49           HN       PHE  49 145.396   3.475  -2.143
 1075    HA   PHE  49           HA       PHE  49 145.910   2.776  -4.865
 1076   1HB   PHE  49           HB2      PHE  49 147.170   1.969  -2.815
 1077   2HB   PHE  49           HB1      PHE  49 145.821   0.881  -2.504
 1078    HD1  PHE  49           HD1      PHE  49 148.113   1.882  -5.306
 1079    HD2  PHE  49           HD2      PHE  49 145.922  -1.284  -3.397
 1080    HE1  PHE  49           HE1      PHE  49 149.101   0.245  -6.885
 1081    HE2  PHE  49           HE2      PHE  49 146.908  -2.918  -4.979
 1082    HZ   PHE  49           HZ       PHE  49 148.499  -2.157  -6.720
 1083    H    LEU  50           HN       LEU  50 143.423   1.764  -2.568
 1084    HA   LEU  50           HA       LEU  50 142.209  -0.212  -4.297
 1085   1HB   LEU  50           HB2      LEU  50 140.923   1.418  -2.077
 1086   2HB   LEU  50           HB1      LEU  50 140.274  -0.063  -2.775
 1087    HG   LEU  50           HG       LEU  50 142.871   0.209  -1.228
 1088   1HD1  LEU  50          HD13      LEU  50 140.554   0.197  -0.034
 1089   2HD1  LEU  50          HD12      LEU  50 140.496  -1.503  -0.492
 1090   3HD1  LEU  50          HD11      LEU  50 141.796  -0.915   0.546
 1091   1HD2  LEU  50          HD22      LEU  50 141.691  -2.048  -2.841
 1092   2HD2  LEU  50          HD21      LEU  50 143.367  -1.505  -2.745
 1093   3HD2  LEU  50          HD23      LEU  50 142.659  -2.417  -1.414
 1094    H    VAL  51           HN       VAL  51 141.643   3.241  -3.758
 1095    HA   VAL  51           HA       VAL  51 139.336   3.497  -5.424
 1096    HB   VAL  51           HB       VAL  51 141.468   5.493  -4.618
 1097   1HG1  VAL  51          HG13      VAL  51 138.919   5.837  -6.202
 1098   2HG1  VAL  51          HG12      VAL  51 139.608   7.165  -5.266
 1099   3HG1  VAL  51          HG11      VAL  51 140.533   6.438  -6.580
 1100   1HG2  VAL  51          HG21      VAL  51 140.049   4.523  -2.816
 1101   2HG2  VAL  51          HG23      VAL  51 139.753   6.247  -3.038
 1102   3HG2  VAL  51          HG22      VAL  51 138.613   5.064  -3.681
 1103    H    LEU  52           HN       LEU  52 142.775   3.467  -6.187
 1104    HA   LEU  52           HA       LEU  52 142.268   4.335  -8.974
 1105   1HB   LEU  52           HB2      LEU  52 144.830   3.443  -7.619
 1106   2HB   LEU  52           HB1      LEU  52 144.715   4.117  -9.243
 1107    HG   LEU  52           HG       LEU  52 143.860   5.548  -6.705
 1108   1HD1  LEU  52          HD12      LEU  52 146.377   5.132  -7.105
 1109   2HD1  LEU  52          HD11      LEU  52 146.212   6.226  -8.478
 1110   3HD1  LEU  52          HD13      LEU  52 145.872   6.801  -6.847
 1111   1HD2  LEU  52          HD23      LEU  52 143.772   6.236  -9.641
 1112   2HD2  LEU  52          HD22      LEU  52 142.568   6.540  -8.388
 1113   3HD2  LEU  52          HD21      LEU  52 144.022   7.527  -8.464
 1114    H    LYS  53           HN       LYS  53 141.421   1.618  -7.658
 1115    HA   LYS  53           HA       LYS  53 141.329  -0.633  -8.328
 1116   1HB   LYS  53           HB2      LYS  53 141.546   0.812 -10.983
 1117   2HB   LYS  53           HB1      LYS  53 141.101  -0.886 -10.816
 1118   1HG   LYS  53           HG2      LYS  53 139.171  -0.246  -9.415
 1119   2HG   LYS  53           HG1      LYS  53 139.612   1.453  -9.583
 1120   1HD   LYS  53           HD2      LYS  53 139.329   1.287 -12.029
 1121   2HD   LYS  53           HD1      LYS  53 138.882  -0.410 -11.863
 1122   1HE   LYS  53           HE2      LYS  53 137.397   1.889 -10.559
 1123   2HE   LYS  53           HE1      LYS  53 136.897   1.095 -12.052
 1124   1HZ   LYS  53           HZ2      LYS  53 137.339  -0.374  -9.517
 1125   2HZ   LYS  53           HZ1      LYS  53 135.825   0.254  -9.967
 1126   3HZ   LYS  53           HZ3      LYS  53 136.569  -0.931 -10.925
 1127    H    LYS  54           HN       LYS  54 143.967   0.189  -7.599
 1128    HA   LYS  54           HA       LYS  54 146.175  -0.585  -7.710
 1129   1HB   LYS  54           HB2      LYS  54 145.053  -2.730  -9.536
 1130   2HB   LYS  54           HB1      LYS  54 146.510  -2.815  -8.549
 1131   1HG   LYS  54           HG2      LYS  54 145.151  -2.622  -6.504
 1132   2HG   LYS  54           HG1      LYS  54 143.688  -2.529  -7.483
 1133   1HD   LYS  54           HD2      LYS  54 144.205  -4.771  -8.424
 1134   2HD   LYS  54           HD1      LYS  54 145.614  -4.868  -7.367
 1135   1HE   LYS  54           HE2      LYS  54 143.716  -6.042  -6.343
 1136   2HE   LYS  54           HE1      LYS  54 144.128  -4.614  -5.394
 1137   1HZ   LYS  54           HZ2      LYS  54 142.149  -4.340  -7.535
 1138   2HZ   LYS  54           HZ1      LYS  54 141.671  -5.106  -6.096
 1139   3HZ   LYS  54           HZ3      LYS  54 142.262  -3.516  -6.053
 1140    H    ASP  55           HN       ASP  55 144.946   1.171  -9.993
 1141    HA   ASP  55           HA       ASP  55 146.423   0.468 -12.373
 1142   1HB   ASP  55           HB2      ASP  55 144.500   2.013 -12.413
 1143   2HB   ASP  55           HB1      ASP  55 145.403   3.166 -11.438
 1144    H    GLU  56           HN       GLU  56 148.617   0.373 -12.414
 1145    HA   GLU  56           HA       GLU  56 150.323   1.466 -10.421
 1146   1HB   GLU  56           HB2      GLU  56 150.887  -0.494 -11.795
 1147   2HB   GLU  56           HB1      GLU  56 151.011   0.541 -13.218
 1148   1HG   GLU  56           HG2      GLU  56 152.867   1.761 -12.251
 1149   2HG   GLU  56           HG1      GLU  56 152.675   0.920 -10.713
 1150    H    ASP  57           HN       ASP  57 149.652   2.708 -13.717
 1151    HA   ASP  57           HA       ASP  57 151.645   4.794 -13.524
 1152   1HB   ASP  57           HB2      ASP  57 149.244   4.448 -15.333
 1153   2HB   ASP  57           HB1      ASP  57 150.382   5.787 -15.486
 1154    H    LEU  58           HN       LEU  58 148.190   4.696 -12.895
 1155    HA   LEU  58           HA       LEU  58 148.011   7.548 -12.350
 1156   1HB   LEU  58           HB2      LEU  58 146.199   5.313 -11.402
 1157   2HB   LEU  58           HB1      LEU  58 145.829   7.028 -11.306
 1158    HG   LEU  58           HG       LEU  58 146.378   5.529 -13.889
 1159   1HD1  LEU  58          HD12      LEU  58 144.252   4.873 -12.705
 1160   2HD1  LEU  58          HD11      LEU  58 143.738   6.557 -12.807
 1161   3HD1  LEU  58          HD13      LEU  58 143.990   5.622 -14.281
 1162   1HD2  LEU  58          HD21      LEU  58 145.712   8.391 -13.201
 1163   2HD2  LEU  58          HD23      LEU  58 146.893   7.772 -14.356
 1164   3HD2  LEU  58          HD22      LEU  58 145.176   7.721 -14.741
 1165    H    PHE  59           HN       PHE  59 148.582   4.683 -10.342
 1166    HA   PHE  59           HA       PHE  59 148.514   6.054  -7.825
 1167   1HB   PHE  59           HB2      PHE  59 148.436   3.616  -7.915
 1168   2HB   PHE  59           HB1      PHE  59 150.037   3.565  -8.656
 1169    HD1  PHE  59           HD1      PHE  59 148.290   4.937  -5.628
 1170    HD2  PHE  59           HD2      PHE  59 151.917   3.318  -7.267
 1171    HE1  PHE  59           HE1      PHE  59 149.324   4.973  -3.374
 1172    HE2  PHE  59           HE2      PHE  59 152.950   3.354  -5.013
 1173    HZ   PHE  59           HZ       PHE  59 151.654   4.181  -3.067
 1174    H    ARG  60           HN       ARG  60 151.272   5.206  -9.958
 1175    HA   ARG  60           HA       ARG  60 153.278   6.396  -8.341
 1176   1HB   ARG  60           HB2      ARG  60 153.150   5.981 -11.336
 1177   2HB   ARG  60           HB1      ARG  60 154.588   6.567 -10.500
 1178   1HG   ARG  60           HG2      ARG  60 154.541   4.518  -9.074
 1179   2HG   ARG  60           HG1      ARG  60 153.188   3.921 -10.024
 1180   1HD   ARG  60           HD2      ARG  60 155.936   4.599 -11.111
 1181   2HD   ARG  60           HD1      ARG  60 155.313   2.973 -10.835
 1182    HE   ARG  60           HE       ARG  60 153.430   4.136 -12.509
 1183   1HH1  ARG  60          HH21      ARG  60 156.852   3.676 -12.511
 1184   2HH1  ARG  60          HH22      ARG  60 156.971   3.581 -14.236
 1185   1HH2  ARG  60          HH11      ARG  60 153.571   4.018 -14.762
 1186   2HH2  ARG  60          HH12      ARG  60 155.115   3.775 -15.510
 1187    H    GLU  61           HN       GLU  61 151.336   7.841 -10.983
 1188    HA   GLU  61           HA       GLU  61 152.650  10.385 -10.925
 1189   1HB   GLU  61           HB2      GLU  61 149.837   9.579 -11.718
 1190   2HB   GLU  61           HB1      GLU  61 150.480  11.205 -11.944
 1191   1HG   GLU  61           HG2      GLU  61 151.791   8.712 -13.060
 1192   2HG   GLU  61           HG1      GLU  61 150.681   9.731 -13.979
 1193    H    TRP  62           HN       TRP  62 149.939   9.025  -9.099
 1194    HA   TRP  62           HA       TRP  62 149.148  11.444  -7.803
 1195   1HB   TRP  62           HB2      TRP  62 147.664   9.557  -7.724
 1196   2HB   TRP  62           HB1      TRP  62 148.902   8.540  -6.989
 1197    HD1  TRP  62           HD1      TRP  62 146.598  11.504  -6.179
 1198    HE1  TRP  62           HE1      TRP  62 146.397  11.709  -3.616
 1199    HE3  TRP  62           HE3      TRP  62 150.012   7.981  -4.742
 1200    HZ2  TRP  62           HZ2      TRP  62 147.546  10.534  -1.260
 1201    HZ3  TRP  62           HZ3      TRP  62 150.429   7.542  -2.341
 1202    HH2  TRP  62           HH2      TRP  62 149.205   8.811  -0.602
 1203    H    LEU  63           HN       LEU  63 151.394   8.876  -6.746
 1204    HA   LEU  63           HA       LEU  63 151.987  10.140  -4.237
 1205   1HB   LEU  63           HB2      LEU  63 152.366   7.743  -4.642
 1206   2HB   LEU  63           HB1      LEU  63 153.591   8.134  -5.845
 1207    HG   LEU  63           HG       LEU  63 154.936   9.258  -4.096
 1208   1HD1  LEU  63          HD13      LEU  63 152.551   8.529  -2.413
 1209   2HD1  LEU  63          HD12      LEU  63 154.146   8.615  -1.666
 1210   3HD1  LEU  63          HD11      LEU  63 153.466  10.036  -2.453
 1211   1HD2  LEU  63          HD22      LEU  63 155.181   6.813  -4.632
 1212   2HD2  LEU  63          HD21      LEU  63 155.682   7.234  -2.994
 1213   3HD2  LEU  63          HD23      LEU  63 154.120   6.461  -3.269
 1214    H    LYS  64           HN       LYS  64 153.755  10.062  -7.324
 1215    HA   LYS  64           HA       LYS  64 155.939  11.689  -6.461
 1216   1HB   LYS  64           HB2      LYS  64 155.964  10.370  -8.565
 1217   2HB   LYS  64           HB1      LYS  64 154.777  11.479  -9.253
 1218   1HG   LYS  64           HG2      LYS  64 156.341  13.353  -9.002
 1219   2HG   LYS  64           HG1      LYS  64 157.522  12.284  -8.245
 1220   1HD   LYS  64           HD2      LYS  64 157.636  10.940 -10.303
 1221   2HD   LYS  64           HD1      LYS  64 156.445  11.996 -11.064
 1222   1HE   LYS  64           HE2      LYS  64 158.785  12.583 -11.699
 1223   2HE   LYS  64           HE1      LYS  64 157.956  13.903 -10.874
 1224   1HZ   LYS  64           HZ2      LYS  64 159.245  12.161  -9.028
 1225   2HZ   LYS  64           HZ1      LYS  64 160.353  12.777 -10.159
 1226   3HZ   LYS  64           HZ3      LYS  64 159.418  13.839  -9.224
 1227    H    ASP  65           HN       ASP  65 152.911  12.575  -8.097
 1228    HA   ASP  65           HA       ASP  65 153.468  15.405  -8.102
 1229   1HB   ASP  65           HB2      ASP  65 151.781  14.208  -9.574
 1230   2HB   ASP  65           HB1      ASP  65 150.741  14.093  -8.153
 1231    H    THR  66           HN       THR  66 152.027  13.196  -5.790
 1232    HA   THR  66           HA       THR  66 150.891  15.299  -4.142
 1233    HB   THR  66           HB       THR  66 151.382  12.356  -3.626
 1234    HG1  THR  66           HG1      THR  66 149.819  12.924  -5.209
 1235   1HG2  THR  66          HG21      THR  66 149.946  14.450  -1.975
 1236   2HG2  THR  66          HG23      THR  66 149.745  12.714  -1.740
 1237   3HG2  THR  66          HG22      THR  66 151.319  13.460  -1.480
 1238    H    CYS  67           HN       CYS  67 153.952  13.441  -4.066
 1239    HA   CYS  67           HA       CYS  67 154.820  15.243  -1.817
 1240   1HB   CYS  67           HB2      CYS  67 155.916  13.417  -0.751
 1241   2HB   CYS  67           HB1      CYS  67 154.291  12.858  -1.141
 1242    HG   CYS  67           HG       CYS  67 155.721  11.971  -3.454
 1243    H    GLY  68           HN       GLY  68 155.770  13.520  -4.754
 1244   1HA   GLY  68           HA2      GLY  68 157.458  14.520  -6.221
 1245   2HA   GLY  68           HA1      GLY  68 158.283  15.153  -4.796
 1246    H    ALA  69           HN       ALA  69 157.086  11.955  -4.437
 1247    HA   ALA  69           HA       ALA  69 159.563  10.784  -3.841
 1248   1HB   ALA  69           HB1      ALA  69 157.099   9.487  -5.047
 1249   2HB   ALA  69           HB3      ALA  69 158.446   8.601  -4.333
 1250   3HB   ALA  69           HB2      ALA  69 157.457   9.660  -3.329
 1251    H    ASN  70           HN       ASN  70 160.991   9.391  -5.118
 1252    HA   ASN  70           HA       ASN  70 161.187  10.301  -7.924
 1253   1HB   ASN  70           HB2      ASN  70 163.012   8.675  -6.140
 1254   2HB   ASN  70           HB1      ASN  70 163.353   8.987  -7.841
 1255   1HD2  ASN  70          HD22      ASN  70 164.945  11.675  -5.731
 1256   2HD2  ASN  70          HD21      ASN  70 165.048   9.980  -5.727
 1257    H    ALA  71           HN       ALA  71 161.910   8.523  -9.512
 1258    HA   ALA  71           HA       ALA  71 159.782   6.686  -9.885
 1259   1HB   ALA  71           HB3      ALA  71 161.409   7.553 -11.641
 1260   2HB   ALA  71           HB2      ALA  71 162.564   6.370 -11.027
 1261   3HB   ALA  71           HB1      ALA  71 161.041   5.830 -11.732
 1262    H    LYS  72           HN       LYS  72 162.950   6.252  -8.319
 1263    HA   LYS  72           HA       LYS  72 162.685   3.373  -8.130
 1264   1HB   LYS  72           HB2      LYS  72 164.859   4.638  -7.927
 1265   2HB   LYS  72           HB1      LYS  72 164.321   5.190  -6.340
 1266   1HG   LYS  72           HG2      LYS  72 164.105   2.848  -5.593
 1267   2HG   LYS  72           HG1      LYS  72 164.646   2.293  -7.178
 1268   1HD   LYS  72           HD2      LYS  72 166.792   3.468  -6.859
 1269   2HD   LYS  72           HD1      LYS  72 166.254   4.020  -5.273
 1270   1HE   LYS  72           HE2      LYS  72 167.652   2.044  -4.989
 1271   2HE   LYS  72           HE1      LYS  72 165.986   1.632  -4.581
 1272   1HZ   LYS  72           HZ1      LYS  72 166.840   1.273  -7.353
 1273   2HZ   LYS  72           HZ3      LYS  72 167.412   0.160  -6.207
 1274   3HZ   LYS  72           HZ2      LYS  72 165.739   0.366  -6.430
 1275    H    GLN  73           HN       GLN  73 161.918   6.071  -5.972
 1276    HA   GLN  73           HA       GLN  73 161.161   4.453  -3.731
 1277   1HB   GLN  73           HB2      GLN  73 160.362   7.272  -4.502
 1278   2HB   GLN  73           HB1      GLN  73 160.032   6.533  -2.935
 1279   1HG   GLN  73           HG2      GLN  73 162.814   6.774  -4.109
 1280   2HG   GLN  73           HG1      GLN  73 162.120   7.962  -3.006
 1281   1HE2  GLN  73          HE22      GLN  73 163.970   5.002  -1.286
 1282   2HE2  GLN  73          HE21      GLN  73 164.356   5.760  -2.756
 1283    H    SER  74           HN       SER  74 159.321   5.777  -6.480
 1284    HA   SER  74           HA       SER  74 156.754   5.050  -5.473
 1285   1HB   SER  74           HB2      SER  74 155.959   5.611  -7.617
 1286   2HB   SER  74           HB1      SER  74 157.388   6.618  -7.427
 1287    HG   SER  74           HG       SER  74 157.313   5.484  -9.445
 1288    H    ARG  75           HN       ARG  75 159.130   3.275  -7.471
 1289    HA   ARG  75           HA       ARG  75 157.436   1.082  -8.124
 1290   1HB   ARG  75           HB2      ARG  75 160.434   1.225  -7.727
 1291   2HB   ARG  75           HB1      ARG  75 159.604  -0.217  -8.313
 1292   1HG   ARG  75           HG2      ARG  75 158.671   1.070 -10.192
 1293   2HG   ARG  75           HG1      ARG  75 159.489   2.517  -9.616
 1294   1HD   ARG  75           HD2      ARG  75 160.805   1.474 -11.400
 1295   2HD   ARG  75           HD1      ARG  75 161.673   1.359  -9.867
 1296    HE   ARG  75           HE       ARG  75 160.257  -1.011  -9.986
 1297   1HH1  ARG  75          HH21      ARG  75 162.412   0.720 -12.047
 1298   2HH1  ARG  75          HH22      ARG  75 163.051  -0.704 -12.797
 1299   1HH2  ARG  75          HH11      ARG  75 161.083  -2.883 -10.952
 1300   2HH2  ARG  75          HH12      ARG  75 162.299  -2.742 -12.177
 1301    H    ASP  76           HN       ASP  76 159.396   1.718  -5.220
 1302    HA   ASP  76           HA       ASP  76 158.994  -0.865  -4.057
 1303   1HB   ASP  76           HB2      ASP  76 159.619   1.830  -2.833
 1304   2HB   ASP  76           HB1      ASP  76 159.571   0.331  -1.902
 1305    H    CYS  77           HN       CYS  77 157.090   2.161  -3.835
 1306    HA   CYS  77           HA       CYS  77 155.327   1.151  -1.800
 1307   1HB   CYS  77           HB2      CYS  77 155.036   3.353  -3.855
 1308   2HB   CYS  77           HB1      CYS  77 153.816   3.012  -2.627
 1309    HG   CYS  77           HG       CYS  77 155.286   4.675  -1.404
 1310    H    PHE  78           HN       PHE  78 155.198   1.138  -5.374
 1311    HA   PHE  78           HA       PHE  78 152.539   0.161  -5.601
 1312   1HB   PHE  78           HB2      PHE  78 153.795   0.990  -7.535
 1313   2HB   PHE  78           HB1      PHE  78 154.928  -0.355  -7.397
 1314    HD1  PHE  78           HD1      PHE  78 151.460   0.604  -8.240
 1315    HD2  PHE  78           HD2      PHE  78 154.322  -2.595  -8.089
 1316    HE1  PHE  78           HE1      PHE  78 149.957  -0.807  -9.621
 1317    HE2  PHE  78           HE2      PHE  78 152.820  -4.006  -9.469
 1318    HZ   PHE  78           HZ       PHE  78 150.636  -3.112 -10.234
 1319    H    GLY  79           HN       GLY  79 155.544  -1.776  -5.876
 1320   1HA   GLY  79           HA2      GLY  79 154.234  -4.292  -5.732
 1321   2HA   GLY  79           HA1      GLY  79 155.936  -4.025  -5.359
 1322    H    CYS  80           HN       CYS  80 155.354  -2.116  -3.205
 1323    HA   CYS  80           HA       CYS  80 155.089  -4.027  -1.040
 1324   1HB   CYS  80           HB2      CYS  80 156.446  -1.990  -0.826
 1325   2HB   CYS  80           HB1      CYS  80 154.996  -1.002  -0.995
 1326    HG   CYS  80           HG       CYS  80 154.860  -3.021   1.317
 1327    H    LEU  81           HN       LEU  81 152.938  -1.396  -2.234
 1328    HA   LEU  81           HA       LEU  81 150.832  -2.106  -0.385
 1329   1HB   LEU  81           HB2      LEU  81 150.742  -0.586  -3.011
 1330   2HB   LEU  81           HB1      LEU  81 149.436  -0.642  -1.829
 1331    HG   LEU  81           HG       LEU  81 152.225   0.323  -1.136
 1332   1HD1  LEU  81          HD12      LEU  81 149.835   1.865  -2.172
 1333   2HD1  LEU  81          HD11      LEU  81 151.173   2.630  -1.314
 1334   3HD1  LEU  81          HD13      LEU  81 151.462   1.815  -2.851
 1335   1HD2  LEU  81          HD21      LEU  81 149.509   0.455   0.196
 1336   2HD2  LEU  81          HD23      LEU  81 151.017  -0.177   0.853
 1337   3HD2  LEU  81          HD22      LEU  81 150.806   1.556   0.642
 1338    H    ARG  82           HN       ARG  82 151.586  -2.929  -3.759
 1339    HA   ARG  82           HA       ARG  82 149.187  -4.365  -4.315
 1340   1HB   ARG  82           HB2      ARG  82 150.794  -3.716  -6.075
 1341   2HB   ARG  82           HB1      ARG  82 151.969  -4.857  -5.415
 1342   1HG   ARG  82           HG2      ARG  82 150.498  -6.733  -5.882
 1343   2HG   ARG  82           HG1      ARG  82 149.205  -5.642  -6.382
 1344   1HD   ARG  82           HD2      ARG  82 150.270  -6.480  -8.378
 1345   2HD   ARG  82           HD1      ARG  82 150.742  -4.790  -8.192
 1346    HE   ARG  82           HE       ARG  82 152.760  -6.176  -6.903
 1347   1HH1  ARG  82          HH21      ARG  82 151.222  -6.306  -9.983
 1348   2HH1  ARG  82          HH22      ARG  82 152.642  -6.839 -10.819
 1349   1HH2  ARG  82          HH11      ARG  82 154.625  -6.877  -7.975
 1350   2HH2  ARG  82          HH12      ARG  82 154.568  -7.164  -9.683
 1351    H    GLU  83           HN       GLU  83 152.263  -5.415  -2.862
 1352    HA   GLU  83           HA       GLU  83 151.539  -8.192  -2.761
 1353   1HB   GLU  83           HB2      GLU  83 153.609  -6.535  -1.309
 1354   2HB   GLU  83           HB1      GLU  83 153.391  -8.253  -0.973
 1355   1HG   GLU  83           HG2      GLU  83 153.843  -7.173  -3.765
 1356   2HG   GLU  83           HG1      GLU  83 155.158  -7.712  -2.720
 1357    H    TRP  84           HN       TRP  84 151.130  -5.517  -0.404
 1358    HA   TRP  84           HA       TRP  84 150.231  -7.175   1.741
 1359   1HB   TRP  84           HB2      TRP  84 150.781  -4.721   1.951
 1360   2HB   TRP  84           HB1      TRP  84 149.261  -4.367   1.122
 1361    HD1  TRP  84           HD1      TRP  84 150.657  -5.764   4.377
 1362    HE1  TRP  84           HE1      TRP  84 148.769  -5.889   6.123
 1363    HE3  TRP  84           HE3      TRP  84 146.656  -4.546   1.441
 1364    HZ2  TRP  84           HZ2      TRP  84 145.936  -5.524   6.262
 1365    HZ3  TRP  84           HZ3      TRP  84 144.375  -4.447   2.410
 1366    HH2  TRP  84           HH2      TRP  84 144.010  -4.932   4.815
 1367    H    CYS  85           HN       CYS  85 148.491  -5.574  -0.927
 1368    HA   CYS  85           HA       CYS  85 145.865  -6.351  -0.192
 1369   1HB   CYS  85           HB2      CYS  85 147.164  -5.758  -2.856
 1370   2HB   CYS  85           HB1      CYS  85 145.449  -6.144  -2.725
 1371    HG   CYS  85           HG       CYS  85 145.944  -3.993  -0.756
 1372    H    ASP  86           HN       ASP  86 148.326  -8.038  -2.107
 1373    HA   ASP  86           HA       ASP  86 146.724 -10.212  -2.980
 1374   1HB   ASP  86           HB2      ASP  86 149.678 -10.046  -2.336
 1375   2HB   ASP  86           HB1      ASP  86 148.926 -11.461  -3.072
 1376    H    ALA  87           HN       ALA  87 148.322  -9.613   0.107
 1377    HA   ALA  87           HA       ALA  87 147.645 -12.339   1.064
 1378   1HB   ALA  87           HB2      ALA  87 149.849 -11.111   1.567
 1379   2HB   ALA  87           HB1      ALA  87 148.906 -10.136   2.697
 1380   3HB   ALA  87           HB3      ALA  87 149.029 -11.881   2.925
 1381    H    PHE  88           HN       PHE  88 146.638  -8.981   1.591
 1382    HA   PHE  88           HA       PHE  88 144.636  -9.937   3.613
 1383   1HB   PHE  88           HB2      PHE  88 145.820  -7.206   3.118
 1384   2HB   PHE  88           HB1      PHE  88 144.555  -7.543   4.299
 1385    HD1  PHE  88           HD2      PHE  88 145.017  -9.118   6.198
 1386    HD2  PHE  88           HD1      PHE  88 148.110  -7.751   3.547
 1387    HE1  PHE  88           HE2      PHE  88 146.737  -9.827   7.839
 1388    HE2  PHE  88           HE1      PHE  88 149.831  -8.460   5.189
 1389    HZ   PHE  88           HZ       PHE  88 149.140  -9.492   7.336
 1390    H    LEU  89           HN       LEU  89 144.680  -9.140   0.368
 1391    HA   LEU  89           HA       LEU  89 141.788  -8.368   0.478
 1392   1HB   LEU  89           HB2      LEU  89 143.304  -6.336   0.161
 1393   2HB   LEU  89           HB1      LEU  89 143.798  -7.054  -1.369
 1394    HG   LEU  89           HG       LEU  89 141.212  -7.180  -1.849
 1395   1HD1  LEU  89          HD13      LEU  89 141.365  -5.008   0.272
 1396   2HD1  LEU  89          HD12      LEU  89 139.985  -5.274  -0.794
 1397   3HD1  LEU  89          HD11      LEU  89 140.443  -6.506   0.376
 1398   1HD2  LEU  89          HD22      LEU  89 142.932  -4.693  -1.910
 1399   2HD2  LEU  89          HD21      LEU  89 142.566  -5.800  -3.232
 1400   3HD2  LEU  89          HD23      LEU  89 141.317  -4.716  -2.619
   
  No H/Q in entry =        1400
  Start of MODEL    8
    1   1H    MET   1           HT2      MET   1 116.555  -5.169  11.157
    2   2H    MET   1           HT1      MET   1 116.068  -5.848  12.636
    3   3H    MET   1           HT3      MET   1 117.470  -4.897  12.562
    4    HA   MET   1           HA       MET   1 118.740  -6.531  11.680
    5   1HB   MET   1           HB2      MET   1 116.462  -7.967  13.072
    6   2HB   MET   1           HB1      MET   1 117.958  -8.764  12.588
    7   1HG   MET   1           HG2      MET   1 119.252  -7.155  13.950
    8   2HG   MET   1           HG1      MET   1 117.749  -6.383  14.454
    9   1HE   MET   1           HE3      MET   1 115.888  -7.442  15.388
   10   2HE   MET   1           HE2      MET   1 115.751  -9.154  14.998
   11   3HE   MET   1           HE1      MET   1 115.950  -8.654  16.675
   12    H    THR   2           HN       THR   2 116.359  -8.941  11.356
   13    HA   THR   2           HA       THR   2 115.751 -10.184   9.454
   14    HB   THR   2           HB       THR   2 115.242  -7.524   8.120
   15    HG1  THR   2           HG1      THR   2 113.373  -8.557   9.896
   16   1HG2  THR   2          HG21      THR   2 114.670  -9.719   7.015
   17   2HG2  THR   2          HG23      THR   2 113.551 -10.028   8.343
   18   3HG2  THR   2          HG22      THR   2 113.286  -8.658   7.266
   19    H    THR   3           HN       THR   3 118.591  -9.121   9.619
   20    HA   THR   3           HA       THR   3 119.505  -8.348   7.038
   21    HB   THR   3           HB       THR   3 121.711  -9.106   7.796
   22    HG1  THR   3           HG1      THR   3 120.252 -10.876   9.103
   23   1HG2  THR   3          HG22      THR   3 120.700  -7.021   8.753
   24   2HG2  THR   3          HG21      THR   3 120.138  -7.976  10.125
   25   3HG2  THR   3          HG23      THR   3 121.867  -7.790   9.829
   26    H    SER   4           HN       SER   4 120.046  -9.543   5.220
   27    HA   SER   4           HA       SER   4 118.913 -12.233   5.031
   28   1HB   SER   4           HB2      SER   4 119.585 -12.094   2.669
   29   2HB   SER   4           HB1      SER   4 118.745 -10.626   3.155
   30    HG   SER   4           HG       SER   4 120.790  -9.652   3.444
   31    H    GLN   5           HN       GLN   5 120.301 -13.961   3.938
   32    HA   GLN   5           HA       GLN   5 122.485 -14.645   5.639
   33   1HB   GLN   5           HB2      GLN   5 121.649 -15.703   2.923
   34   2HB   GLN   5           HB1      GLN   5 122.942 -16.417   3.884
   35   1HG   GLN   5           HG2      GLN   5 121.006 -17.683   4.429
   36   2HG   GLN   5           HG1      GLN   5 121.218 -16.581   5.788
   37   1HE2  GLN   5          HE22      GLN   5 118.354 -15.372   3.104
   38   2HE2  GLN   5          HE21      GLN   5 119.875 -15.865   2.535
   39    H    LYS   6           HN       LYS   6 122.382 -12.610   2.822
   40    HA   LYS   6           HA       LYS   6 125.007 -12.962   1.832
   41   1HB   LYS   6           HB2      LYS   6 123.243 -10.507   1.941
   42   2HB   LYS   6           HB1      LYS   6 124.739 -10.608   1.013
   43   1HG   LYS   6           HG2      LYS   6 123.823 -12.513  -0.262
   44   2HG   LYS   6           HG1      LYS   6 122.324 -12.409   0.663
   45   1HD   LYS   6           HD2      LYS   6 121.969 -10.111  -0.161
   46   2HD   LYS   6           HD1      LYS   6 123.465 -10.213  -1.088
   47   1HE   LYS   6           HE2      LYS   6 121.544 -10.682  -2.539
   48   2HE   LYS   6           HE1      LYS   6 122.532 -12.132  -2.354
   49   1HZ   LYS   6           HZ2      LYS   6 120.679 -12.086  -0.269
   50   2HZ   LYS   6           HZ1      LYS   6 119.827 -11.769  -1.704
   51   3HZ   LYS   6           HZ3      LYS   6 120.763 -13.177  -1.569
   52    H    HIS   7           HN       HIS   7 123.758 -10.961   4.497
   53    HA   HIS   7           HA       HIS   7 126.109  -9.457   4.983
   54   1HB   HIS   7           HB2      HIS   7 124.022  -8.870   6.069
   55   2HB   HIS   7           HB1      HIS   7 123.971 -10.423   6.902
   56    HD2  HIS   7           HD2      HIS   7 125.614 -10.602   9.193
   57    HE1  HIS   7           HE1      HIS   7 127.119  -6.660   9.028
   58    HE2  HIS   7           HE2      HIS   7 126.988  -8.766  10.432
   59    H    ARG   8           HN       ARG   8 125.113 -12.541   6.535
   60    HA   ARG   8           HA       ARG   8 127.570 -12.783   8.008
   61   1HB   ARG   8           HB2      ARG   8 125.406 -14.773   7.281
   62   2HB   ARG   8           HB1      ARG   8 126.791 -15.183   8.299
   63   1HG   ARG   8           HG2      ARG   8 126.167 -13.376   9.869
   64   2HG   ARG   8           HG1      ARG   8 124.777 -12.982   8.856
   65   1HD   ARG   8           HD2      ARG   8 125.271 -15.647  10.218
   66   2HD   ARG   8           HD1      ARG   8 124.107 -14.427  10.741
   67    HE   ARG   8           HE       ARG   8 123.354 -14.914   8.142
   68   1HH1  ARG   8          HH21      ARG   8 124.043 -16.834  10.920
   69   2HH1  ARG   8          HH22      ARG   8 122.938 -18.097  10.488
   70   1HH2  ARG   8          HH11      ARG   8 121.903 -16.551   7.561
   71   2HH2  ARG   8          HH12      ARG   8 121.725 -17.935   8.586
   72    H    ASP   9           HN       ASP   9 126.505 -13.797   4.836
   73    HA   ASP   9           HA       ASP   9 128.691 -15.624   4.343
   74   1HB   ASP   9           HB2      ASP   9 126.816 -14.148   2.498
   75   2HB   ASP   9           HB1      ASP   9 128.019 -15.298   1.929
   76    H    PHE  10           HN       PHE  10 128.148 -12.164   3.684
   77    HA   PHE  10           HA       PHE  10 130.525 -11.805   2.115
   78   1HB   PHE  10           HB2      PHE  10 128.559 -10.232   2.221
   79   2HB   PHE  10           HB1      PHE  10 129.119  -9.729   3.815
   80    HD1  PHE  10           HD1      PHE  10 129.885  -9.750   0.205
   81    HD2  PHE  10           HD2      PHE  10 131.119  -8.376   4.084
   82    HE1  PHE  10           HE1      PHE  10 131.476  -8.174  -0.861
   83    HE2  PHE  10           HE2      PHE  10 132.711  -6.801   3.018
   84    HZ   PHE  10           HZ       PHE  10 132.890  -6.699   0.546
   85    H    VAL  11           HN       VAL  11 129.894 -11.362   5.609
   86    HA   VAL  11           HA       VAL  11 132.690 -10.582   6.084
   87    HB   VAL  11           HB       VAL  11 132.027 -10.505   8.444
   88   1HG1  VAL  11          HG13      VAL  11 129.946  -9.364   6.554
   89   2HG1  VAL  11          HG12      VAL  11 130.141  -8.878   8.238
   90   3HG1  VAL  11          HG11      VAL  11 131.433  -8.572   7.078
   91   1HG2  VAL  11          HG21      VAL  11 129.587 -11.918   7.371
   92   2HG2  VAL  11          HG23      VAL  11 130.634 -12.408   8.701
   93   3HG2  VAL  11          HG22      VAL  11 129.539 -11.041   8.899
   94    H    ALA  12           HN       ALA  12 131.651 -13.372   5.079
   95    HA   ALA  12           HA       ALA  12 133.125 -15.045   7.094
   96   1HB   ALA  12           HB2      ALA  12 130.868 -15.720   5.200
   97   2HB   ALA  12           HB1      ALA  12 131.802 -16.942   6.061
   98   3HB   ALA  12           HB3      ALA  12 130.844 -15.767   6.962
   99    H    GLU  13           HN       GLU  13 133.275 -13.801   3.910
  100    HA   GLU  13           HA       GLU  13 135.620 -15.487   3.376
  101   1HB   GLU  13           HB2      GLU  13 134.732 -16.072   1.055
  102   2HB   GLU  13           HB1      GLU  13 133.987 -16.937   2.398
  103   1HG   GLU  13           HG2      GLU  13 132.041 -15.574   2.329
  104   2HG   GLU  13           HG1      GLU  13 132.817 -14.383   1.286
  105    HA   PRO  14           HA       PRO  14 137.311 -11.801   1.548
  106   1HB   PRO  14           HB2      PRO  14 137.683 -13.479  -0.926
  107   2HB   PRO  14           HB1      PRO  14 138.828 -12.374  -0.135
  108   1HG   PRO  14           HG2      PRO  14 139.012 -15.013   0.187
  109   2HG   PRO  14           HG1      PRO  14 139.361 -13.894   1.517
  110   1HD   PRO  14           HD2      PRO  14 137.023 -15.703   1.163
  111   2HD   PRO  14           HD1      PRO  14 137.717 -15.030   2.655
  112    H    MET  15           HN       MET  15 136.834 -10.211  -0.179
  113    HA   MET  15           HA       MET  15 134.031 -10.442  -1.113
  114   1HB   MET  15           HB2      MET  15 134.522  -8.018  -1.863
  115   2HB   MET  15           HB1      MET  15 134.490  -8.334  -0.129
  116   1HG   MET  15           HG2      MET  15 136.833  -8.255   0.060
  117   2HG   MET  15           HG1      MET  15 137.078  -8.519  -1.667
  118   1HE   MET  15           HE1      MET  15 135.193  -6.315   0.809
  119   2HE   MET  15           HE3      MET  15 136.874  -5.877   1.140
  120   3HE   MET  15           HE2      MET  15 135.762  -4.683   0.468
  121    H    GLY  16           HN       GLY  16 137.255 -10.706  -2.325
  122   1HA   GLY  16           HA2      GLY  16 138.104 -10.985  -4.500
  123   2HA   GLY  16           HA1      GLY  16 136.584 -11.831  -4.795
  124    H    GLU  17           HN       GLU  17 136.103 -11.038  -6.828
  125    HA   GLU  17           HA       GLU  17 136.030  -8.073  -7.221
  126   1HB   GLU  17           HB2      GLU  17 136.015 -10.398  -9.164
  127   2HB   GLU  17           HB1      GLU  17 135.794  -8.717  -9.650
  128   1HG   GLU  17           HG2      GLU  17 137.983  -8.141  -8.664
  129   2HG   GLU  17           HG1      GLU  17 138.206  -9.823  -8.180
  130    H    LYS  18           HN       LYS  18 133.929  -9.678  -5.760
  131    HA   LYS  18           HA       LYS  18 131.641 -10.033  -7.415
  132   1HB   LYS  18           HB2      LYS  18 131.872  -9.309  -4.477
  133   2HB   LYS  18           HB1      LYS  18 130.343  -9.704  -5.258
  134   1HG   LYS  18           HG2      LYS  18 131.332 -11.899  -5.963
  135   2HG   LYS  18           HG1      LYS  18 132.769 -11.506  -5.018
  136   1HD   LYS  18           HD2      LYS  18 131.292 -11.244  -3.001
  137   2HD   LYS  18           HD1      LYS  18 129.941 -11.829  -3.974
  138   1HE   LYS  18           HE2      LYS  18 132.359 -13.319  -2.998
  139   2HE   LYS  18           HE1      LYS  18 130.668 -13.821  -3.004
  140   1HZ   LYS  18           HZ2      LYS  18 132.276 -13.448  -5.468
  141   2HZ   LYS  18           HZ1      LYS  18 132.103 -14.943  -4.681
  142   3HZ   LYS  18           HZ3      LYS  18 130.743 -14.168  -5.333
  143    HA   PRO  19           HA       PRO  19 130.610  -5.842  -8.452
  144   1HB   PRO  19           HB2      PRO  19 127.853  -5.979  -8.605
  145   2HB   PRO  19           HB1      PRO  19 128.944  -6.624  -9.848
  146   1HG   PRO  19           HG2      PRO  19 127.554  -8.065  -7.630
  147   2HG   PRO  19           HG1      PRO  19 127.772  -8.547  -9.323
  148   1HD   PRO  19           HD2      PRO  19 129.320  -9.570  -7.349
  149   2HD   PRO  19           HD1      PRO  19 129.966  -9.268  -8.977
  150    H    VAL  20           HN       VAL  20 129.682  -3.889  -7.607
  151    HA   VAL  20           HA       VAL  20 129.804  -3.572  -4.819
  152    HB   VAL  20           HB       VAL  20 129.982  -1.684  -6.362
  153   1HG1  VAL  20          HG13      VAL  20 128.163  -2.630  -7.908
  154   2HG1  VAL  20          HG12      VAL  20 126.998  -1.904  -6.802
  155   3HG1  VAL  20          HG11      VAL  20 128.154  -0.884  -7.660
  156   1HG2  VAL  20          HG23      VAL  20 129.144  -1.374  -3.984
  157   2HG2  VAL  20          HG22      VAL  20 128.695  -0.088  -5.103
  158   3HG2  VAL  20          HG21      VAL  20 127.511  -1.313  -4.648
  159    H    GLY  21           HN       GLY  21 126.923  -4.032  -6.864
  160   1HA   GLY  21           HA2      GLY  21 124.934  -3.704  -4.913
  161   2HA   GLY  21           HA1      GLY  21 124.773  -4.764  -6.311
  162    H    SER  22           HN       SER  22 127.417  -5.976  -4.794
  163    HA   SER  22           HA       SER  22 125.846  -8.147  -3.604
  164   1HB   SER  22           HB2      SER  22 128.844  -7.688  -3.686
  165   2HB   SER  22           HB1      SER  22 128.049  -9.173  -3.171
  166    HG   SER  22           HG       SER  22 127.646  -9.652  -5.190
  167    H    LEU  23           HN       LEU  23 127.367  -5.233  -2.536
  168    HA   LEU  23           HA       LEU  23 127.912  -5.962   0.182
  169   1HB   LEU  23           HB2      LEU  23 127.175  -3.270  -0.998
  170   2HB   LEU  23           HB1      LEU  23 127.840  -3.515   0.615
  171    HG   LEU  23           HG       LEU  23 129.213  -4.331  -1.965
  172   1HD1  LEU  23          HD11      LEU  23 129.020  -1.870  -1.683
  173   2HD1  LEU  23          HD13      LEU  23 129.782  -2.006  -0.099
  174   3HD1  LEU  23          HD12      LEU  23 130.691  -2.419  -1.554
  175   1HD2  LEU  23          HD23      LEU  23 129.890  -4.584   0.964
  176   2HD2  LEU  23          HD22      LEU  23 130.151  -5.736  -0.347
  177   3HD2  LEU  23          HD21      LEU  23 131.198  -4.330  -0.191
  178    H    ALA  24           HN       ALA  24 126.604  -6.072   1.947
  179    HA   ALA  24           HA       ALA  24 123.768  -6.331   1.596
  180   1HB   ALA  24           HB1      ALA  24 125.163  -7.373   3.440
  181   2HB   ALA  24           HB3      ALA  24 125.207  -5.786   4.206
  182   3HB   ALA  24           HB2      ALA  24 123.667  -6.615   3.983
  183    H    GLY  25           HN       GLY  25 122.147  -4.859   1.806
  184   1HA   GLY  25           HA2      GLY  25 121.139  -2.821   2.677
  185   2HA   GLY  25           HA1      GLY  25 122.753  -2.146   2.903
  186    H    ILE  26           HN       ILE  26 123.298  -3.382   0.069
  187    HA   ILE  26           HA       ILE  26 122.351  -0.968  -1.421
  188    HB   ILE  26           HB       ILE  26 124.365  -3.085  -2.247
  189   1HG1  ILE  26          HG12      ILE  26 125.218  -1.950  -0.276
  190   2HG1  ILE  26          HG11      ILE  26 126.068  -1.329  -1.686
  191   1HG2  ILE  26          HG21      ILE  26 123.688  -0.338  -3.334
  192   2HG2  ILE  26          HG23      ILE  26 125.064  -1.307  -3.862
  193   3HG2  ILE  26          HG22      ILE  26 123.421  -1.887  -4.136
  194   1HD1  ILE  26          HD13      ILE  26 124.241   0.530  -1.694
  195   2HD1  ILE  26          HD12      ILE  26 123.934   0.013  -0.036
  196   3HD1  ILE  26          HD11      ILE  26 125.525   0.619  -0.490
  197    H    GLY  27           HN       GLY  27 120.485  -1.284  -2.605
  198   1HA   GLY  27           HA2      GLY  27 119.712  -4.043  -3.347
  199   2HA   GLY  27           HA1      GLY  27 118.692  -2.608  -3.469
  200    H    GLU  28           HN       GLU  28 118.710  -4.181  -5.646
  201    HA   GLU  28           HA       GLU  28 120.739  -3.854  -7.567
  202   1HB   GLU  28           HB2      GLU  28 117.741  -4.112  -7.899
  203   2HB   GLU  28           HB1      GLU  28 118.872  -4.173  -9.251
  204   1HG   GLU  28           HG2      GLU  28 120.026  -6.083  -8.216
  205   2HG   GLU  28           HG1      GLU  28 118.918  -6.019  -6.845
  206    H    VAL  29           HN       VAL  29 118.004  -1.671  -6.846
  207    HA   VAL  29           HA       VAL  29 118.572   0.115  -9.038
  208    HB   VAL  29           HB       VAL  29 117.097   0.558  -6.427
  209   1HG1  VAL  29          HG12      VAL  29 117.473   2.319  -8.855
  210   2HG1  VAL  29          HG11      VAL  29 116.098   2.511  -7.767
  211   3HG1  VAL  29          HG13      VAL  29 117.740   2.727  -7.161
  212   1HG2  VAL  29          HG22      VAL  29 116.249  -0.126  -9.253
  213   2HG2  VAL  29          HG21      VAL  29 115.965  -1.061  -7.786
  214   3HG2  VAL  29          HG23      VAL  29 115.120   0.468  -8.036
  215    H    LEU  30           HN       LEU  30 119.528   0.096  -5.619
  216    HA   LEU  30           HA       LEU  30 120.922   2.605  -5.712
  217   1HB   LEU  30           HB2      LEU  30 121.287   0.222  -3.870
  218   2HB   LEU  30           HB1      LEU  30 121.994   1.816  -3.605
  219    HG   LEU  30           HG       LEU  30 119.018   1.274  -3.863
  220   1HD1  LEU  30          HD13      LEU  30 120.735   1.776  -1.411
  221   2HD1  LEU  30          HD12      LEU  30 118.973   1.705  -1.414
  222   3HD1  LEU  30          HD11      LEU  30 119.912   0.269  -1.817
  223   1HD2  LEU  30          HD23      LEU  30 120.690   3.746  -3.432
  224   2HD2  LEU  30          HD22      LEU  30 119.254   3.531  -4.431
  225   3HD2  LEU  30          HD21      LEU  30 119.095   3.654  -2.684
  226    H    GLY  31           HN       GLY  31 121.927  -0.743  -6.282
  227   1HA   GLY  31           HA2      GLY  31 124.728  -0.263  -6.463
  228   2HA   GLY  31           HA1      GLY  31 123.880  -1.575  -7.284
  229    H    LYS  32           HN       LYS  32 122.134   0.079  -8.862
  230    HA   LYS  32           HA       LYS  32 123.839   0.566 -11.112
  231   1HB   LYS  32           HB2      LYS  32 120.977   1.359 -10.540
  232   2HB   LYS  32           HB1      LYS  32 121.771   1.657 -12.087
  233   1HG   LYS  32           HG2      LYS  32 122.236  -0.755 -12.317
  234   2HG   LYS  32           HG1      LYS  32 121.438  -1.056 -10.773
  235   1HD   LYS  32           HD2      LYS  32 119.332  -0.141 -11.678
  236   2HD   LYS  32           HD1      LYS  32 120.127   0.157 -13.225
  237   1HE   LYS  32           HE2      LYS  32 118.950  -1.938 -13.422
  238   2HE   LYS  32           HE1      LYS  32 120.671  -2.313 -13.315
  239   1HZ   LYS  32           HZ2      LYS  32 119.092  -2.176 -10.846
  240   2HZ   LYS  32           HZ1      LYS  32 118.951  -3.555 -11.828
  241   3HZ   LYS  32           HZ3      LYS  32 120.464  -3.113 -11.201
  242    H    LYS  33           HN       LYS  33 122.381   2.823  -8.739
  243    HA   LYS  33           HA       LYS  33 123.229   5.193 -10.125
  244   1HB   LYS  33           HB2      LYS  33 122.668   4.712  -7.182
  245   2HB   LYS  33           HB1      LYS  33 122.936   6.304  -7.887
  246   1HG   LYS  33           HG2      LYS  33 121.003   5.968  -9.390
  247   2HG   LYS  33           HG1      LYS  33 120.731   4.375  -8.682
  248   1HD   LYS  33           HD2      LYS  33 120.404   5.421  -6.462
  249   2HD   LYS  33           HD1      LYS  33 120.655   7.010  -7.179
  250   1HE   LYS  33           HE2      LYS  33 118.529   5.199  -8.305
  251   2HE   LYS  33           HE1      LYS  33 118.205   6.121  -6.838
  252   1HZ   LYS  33           HZ2      LYS  33 118.824   8.141  -8.019
  253   2HZ   LYS  33           HZ1      LYS  33 119.096   7.246  -9.437
  254   3HZ   LYS  33           HZ3      LYS  33 117.532   7.350  -8.789
  255    H    LEU  34           HN       LEU  34 124.767   3.259  -7.546
  256    HA   LEU  34           HA       LEU  34 127.064   4.947  -7.225
  257   1HB   LEU  34           HB2      LEU  34 126.699   1.976  -6.751
  258   2HB   LEU  34           HB1      LEU  34 128.131   2.875  -6.271
  259    HG   LEU  34           HG       LEU  34 125.330   3.587  -5.368
  260   1HD1  LEU  34          HD13      LEU  34 127.478   1.913  -4.038
  261   2HD1  LEU  34          HD12      LEU  34 126.074   2.560  -3.188
  262   3HD1  LEU  34          HD11      LEU  34 125.855   1.396  -4.494
  263   1HD2  LEU  34          HD23      LEU  34 128.110   4.592  -4.727
  264   2HD2  LEU  34          HD22      LEU  34 126.638   5.513  -5.035
  265   3HD2  LEU  34          HD21      LEU  34 126.846   4.682  -3.500
  266    H    GLU  35           HN       GLU  35 126.373   2.216  -9.344
  267    HA   GLU  35           HA       GLU  35 128.979   1.920 -10.468
  268   1HB   GLU  35           HB2      GLU  35 127.179   0.279 -10.824
  269   2HB   GLU  35           HB1      GLU  35 126.280   1.456 -11.780
  270   1HG   GLU  35           HG2      GLU  35 128.116   1.530 -13.426
  271   2HG   GLU  35           HG1      GLU  35 129.031   0.371 -12.462
  272    H    GLU  36           HN       GLU  36 126.302   4.053 -11.384
  273    HA   GLU  36           HA       GLU  36 127.586   5.145 -13.719
  274   1HB   GLU  36           HB2      GLU  36 125.408   6.190 -11.891
  275   2HB   GLU  36           HB1      GLU  36 125.946   7.058 -13.330
  276   1HG   GLU  36           HG2      GLU  36 125.000   4.181 -13.392
  277   2HG   GLU  36           HG1      GLU  36 123.929   5.555 -13.676
  278    H    ARG  37           HN       ARG  37 128.018   5.583 -10.340
  279    HA   ARG  37           HA       ARG  37 129.334   8.216 -10.659
  280   1HB   ARG  37           HB2      ARG  37 128.888   6.475  -8.224
  281   2HB   ARG  37           HB1      ARG  37 129.604   8.082  -8.187
  282   1HG   ARG  37           HG2      ARG  37 126.895   7.604  -9.436
  283   2HG   ARG  37           HG1      ARG  37 127.060   7.857  -7.701
  284   1HD   ARG  37           HD2      ARG  37 128.299  10.006  -8.222
  285   2HD   ARG  37           HD1      ARG  37 127.849   9.777  -9.911
  286    HE   ARG  37           HE       ARG  37 125.443   9.583  -8.566
  287   1HH1  ARG  37          HH21      ARG  37 128.062  11.820  -8.691
  288   2HH1  ARG  37          HH22      ARG  37 127.066  13.207  -8.397
  289   1HH2  ARG  37          HH11      ARG  37 124.127  11.379  -8.184
  290   2HH2  ARG  37          HH12      ARG  37 124.838  12.957  -8.110
  291    H    GLY  38           HN       GLY  38 130.324   5.134 -11.278
  292   1HA   GLY  38           HA2      GLY  38 132.625   4.758 -11.958
  293   2HA   GLY  38           HA1      GLY  38 133.165   5.893 -10.731
  294    H    PHE  39           HN       PHE  39 130.820   3.824  -9.392
  295    HA   PHE  39           HA       PHE  39 132.994   2.161  -8.162
  296   1HB   PHE  39           HB2      PHE  39 130.171   2.756  -7.258
  297   2HB   PHE  39           HB1      PHE  39 131.280   1.682  -6.413
  298    HD1  PHE  39           HD2      PHE  39 133.243   2.566  -5.249
  299    HD2  PHE  39           HD1      PHE  39 130.512   5.154  -7.289
  300    HE1  PHE  39           HE2      PHE  39 134.247   4.523  -4.101
  301    HE2  PHE  39           HE1      PHE  39 131.503   7.118  -6.148
  302    HZ   PHE  39           HZ       PHE  39 133.375   6.802  -4.551
  303    H    ASP  40           HN       ASP  40 132.872   0.915 -10.292
  304    HA   ASP  40           HA       ASP  40 130.458  -0.687 -10.720
  305   1HB   ASP  40           HB2      ASP  40 131.775  -1.744 -12.526
  306   2HB   ASP  40           HB1      ASP  40 131.842   0.016 -12.631
  307    H    LYS  41           HN       LYS  41 133.213  -0.934  -8.704
  308    HA   LYS  41           HA       LYS  41 132.621  -3.838  -8.214
  309   1HB   LYS  41           HB2      LYS  41 135.338  -2.485  -8.174
  310   2HB   LYS  41           HB1      LYS  41 135.025  -4.179  -7.799
  311   1HG   LYS  41           HG2      LYS  41 134.320  -2.920 -10.461
  312   2HG   LYS  41           HG1      LYS  41 135.853  -3.731 -10.162
  313   1HD   LYS  41           HD2      LYS  41 134.466  -5.763  -9.436
  314   2HD   LYS  41           HD1      LYS  41 133.077  -4.935 -10.140
  315   1HE   LYS  41           HE2      LYS  41 133.961  -6.365 -11.850
  316   2HE   LYS  41           HE1      LYS  41 134.408  -4.714 -12.278
  317   1HZ   LYS  41           HZ1      LYS  41 136.536  -5.234 -10.967
  318   2HZ   LYS  41           HZ3      LYS  41 136.099  -6.860 -11.173
  319   3HZ   LYS  41           HZ2      LYS  41 136.370  -5.876 -12.531
  320    H    ALA  42           HN       ALA  42 132.844  -4.514  -6.039
  321    HA   ALA  42           HA       ALA  42 132.061  -2.585  -4.079
  322   1HB   ALA  42           HB3      ALA  42 131.535  -5.036  -4.023
  323   2HB   ALA  42           HB2      ALA  42 133.214  -5.335  -3.572
  324   3HB   ALA  42           HB1      ALA  42 132.162  -4.407  -2.501
  325    H    TYR  43           HN       TYR  43 135.253  -4.103  -4.680
  326    HA   TYR  43           HA       TYR  43 136.501  -3.132  -2.332
  327   1HB   TYR  43           HB2      TYR  43 138.640  -3.454  -3.436
  328   2HB   TYR  43           HB1      TYR  43 137.562  -4.790  -3.826
  329    HD1  TYR  43           HD1      TYR  43 138.870  -1.540  -5.109
  330    HD2  TYR  43           HD2      TYR  43 137.035  -5.299  -6.075
  331    HE1  TYR  43           HE1      TYR  43 139.204  -1.082  -7.519
  332    HE2  TYR  43           HE2      TYR  43 137.369  -4.841  -8.489
  333    HH   TYR  43           HH       TYR  43 138.204  -1.778  -9.677
  334    H    VAL  44           HN       VAL  44 135.455  -1.329  -5.096
  335    HA   VAL  44           HA       VAL  44 137.293   0.916  -4.599
  336    HB   VAL  44           HB       VAL  44 134.716   0.852  -6.215
  337   1HG1  VAL  44          HG11      VAL  44 135.487   3.122  -5.526
  338   2HG1  VAL  44          HG13      VAL  44 137.053   2.788  -6.263
  339   3HG1  VAL  44          HG12      VAL  44 135.607   2.878  -7.267
  340   1HG2  VAL  44          HG23      VAL  44 136.442  -0.743  -7.042
  341   2HG2  VAL  44          HG22      VAL  44 136.170   0.582  -8.171
  342   3HG2  VAL  44          HG21      VAL  44 137.599   0.584  -7.136
  343    H    VAL  45           HN       VAL  45 134.094  -0.118  -3.736
  344    HA   VAL  45           HA       VAL  45 133.256   2.368  -2.463
  345    HB   VAL  45           HB       VAL  45 132.216  -0.475  -2.231
  346   1HG1  VAL  45          HG12      VAL  45 131.244   2.128  -1.039
  347   2HG1  VAL  45          HG11      VAL  45 130.166   0.756  -1.288
  348   3HG1  VAL  45          HG13      VAL  45 131.556   0.601  -0.215
  349   1HG2  VAL  45          HG22      VAL  45 131.400   1.964  -3.823
  350   2HG2  VAL  45          HG21      VAL  45 131.795   0.354  -4.423
  351   3HG2  VAL  45          HG23      VAL  45 130.293   0.622  -3.538
  352    H    LEU  46           HN       LEU  46 134.726  -0.675  -1.392
  353    HA   LEU  46           HA       LEU  46 134.649  -0.165   1.415
  354   1HB   LEU  46           HB2      LEU  46 135.279  -2.369   0.556
  355   2HB   LEU  46           HB1      LEU  46 136.685  -1.683  -0.256
  356    HG   LEU  46           HG       LEU  46 137.653  -1.051   1.912
  357   1HD1  LEU  46          HD11      LEU  46 134.991  -2.011   2.924
  358   2HD1  LEU  46          HD13      LEU  46 136.410  -2.153   3.963
  359   3HD1  LEU  46          HD12      LEU  46 135.906  -0.571   3.372
  360   1HD2  LEU  46          HD22      LEU  46 137.727  -3.502   0.874
  361   2HD2  LEU  46          HD21      LEU  46 138.448  -3.141   2.437
  362   3HD2  LEU  46          HD23      LEU  46 136.860  -3.898   2.361
  363    H    GLY  47           HN       GLY  47 136.841   0.830  -1.147
  364   1HA   GLY  47           HA2      GLY  47 138.906   1.954   0.449
  365   2HA   GLY  47           HA1      GLY  47 138.507   2.487  -1.186
  366    H    GLN  48           HN       GLN  48 135.828   3.359  -0.705
  367    HA   GLN  48           HA       GLN  48 136.280   6.012   0.239
  368   1HB   GLN  48           HB2      GLN  48 134.392   5.294  -1.256
  369   2HB   GLN  48           HB1      GLN  48 133.637   4.523   0.139
  370   1HG   GLN  48           HG2      GLN  48 132.656   6.723  -0.130
  371   2HG   GLN  48           HG1      GLN  48 133.678   6.754   1.307
  372   1HE2  GLN  48          HE22      GLN  48 135.483   8.413  -1.984
  373   2HE2  GLN  48          HE21      GLN  48 134.778   6.874  -2.102
  374    H    PHE  49           HN       PHE  49 134.813   3.187   1.845
  375    HA   PHE  49           HA       PHE  49 134.157   4.457   4.309
  376   1HB   PHE  49           HB2      PHE  49 133.358   2.206   3.651
  377   2HB   PHE  49           HB1      PHE  49 134.999   1.584   3.794
  378    HD1  PHE  49           HD1      PHE  49 132.365   3.379   5.762
  379    HD2  PHE  49           HD2      PHE  49 135.735   0.717   5.854
  380    HE1  PHE  49           HE1      PHE  49 131.970   2.963   8.174
  381    HE2  PHE  49           HE2      PHE  49 135.342   0.305   8.268
  382    HZ   PHE  49           HZ       PHE  49 133.459   1.427   9.427
  383    H    LEU  50           HN       LEU  50 137.114   2.905   3.166
  384    HA   LEU  50           HA       LEU  50 138.550   3.166   5.663
  385   1HB   LEU  50           HB2      LEU  50 139.507   2.873   2.803
  386   2HB   LEU  50           HB1      LEU  50 140.594   2.866   4.188
  387    HG   LEU  50           HG       LEU  50 138.251   0.965   3.868
  388   1HD1  LEU  50          HD13      LEU  50 141.184   0.630   3.188
  389   2HD1  LEU  50          HD12      LEU  50 140.073  -0.728   3.370
  390   3HD1  LEU  50          HD11      LEU  50 139.805   0.466   2.101
  391   1HD2  LEU  50          HD22      LEU  50 140.436   1.328   5.911
  392   2HD2  LEU  50          HD21      LEU  50 138.736   0.924   6.148
  393   3HD2  LEU  50          HD23      LEU  50 139.860  -0.303   5.576
  394    H    VAL  51           HN       VAL  51 138.261   5.233   2.797
  395    HA   VAL  51           HA       VAL  51 140.194   7.176   3.634
  396    HB   VAL  51           HB       VAL  51 137.857   7.315   1.719
  397   1HG1  VAL  51          HG12      VAL  51 139.889   9.427   2.473
  398   2HG1  VAL  51          HG11      VAL  51 139.045   9.443   0.924
  399   3HG1  VAL  51          HG13      VAL  51 138.132   9.580   2.426
  400   1HG2  VAL  51          HG23      VAL  51 139.897   5.900   1.210
  401   2HG2  VAL  51          HG22      VAL  51 139.577   7.175   0.034
  402   3HG2  VAL  51          HG21      VAL  51 140.848   7.386   1.238
  403    H    LEU  52           HN       LEU  52 136.854   6.676   4.537
  404    HA   LEU  52           HA       LEU  52 136.648   9.378   5.751
  405   1HB   LEU  52           HB2      LEU  52 134.719   7.035   5.787
  406   2HB   LEU  52           HB1      LEU  52 134.383   8.635   6.442
  407    HG   LEU  52           HG       LEU  52 135.044   8.040   3.542
  408   1HD1  LEU  52          HD12      LEU  52 132.808   7.220   4.378
  409   2HD1  LEU  52          HD11      LEU  52 132.414   8.890   4.784
  410   3HD1  LEU  52          HD13      LEU  52 132.699   8.434   3.104
  411   1HD2  LEU  52          HD21      LEU  52 134.544  10.571   5.105
  412   2HD2  LEU  52          HD23      LEU  52 135.724  10.264   3.828
  413   3HD2  LEU  52          HD22      LEU  52 134.026  10.489   3.421
  414    H    LYS  53           HN       LYS  53 138.487   7.015   6.667
  415    HA   LYS  53           HA       LYS  53 139.195   6.120   8.719
  416   1HB   LYS  53           HB2      LYS  53 137.949   8.703   9.708
  417   2HB   LYS  53           HB1      LYS  53 139.089   7.706  10.610
  418   1HG   LYS  53           HG2      LYS  53 140.789   8.053   8.853
  419   2HG   LYS  53           HG1      LYS  53 139.648   9.054   7.951
  420   1HD   LYS  53           HD2      LYS  53 139.525  10.627   9.850
  421   2HD   LYS  53           HD1      LYS  53 140.666   9.628  10.748
  422   1HE   LYS  53           HE2      LYS  53 141.237  10.981   8.096
  423   2HE   LYS  53           HE1      LYS  53 141.806  11.537   9.670
  424   1HZ   LYS  53           HZ2      LYS  53 142.955   9.417   9.945
  425   2HZ   LYS  53           HZ1      LYS  53 142.447   8.932   8.398
  426   3HZ   LYS  53           HZ3      LYS  53 143.502  10.249   8.568
  427    H    LYS  54           HN       LYS  54 136.514   5.343   7.820
  428    HA   LYS  54           HA       LYS  54 134.678   4.142   8.614
  429   1HB   LYS  54           HB2      LYS  54 136.110   4.157  11.284
  430   2HB   LYS  54           HB1      LYS  54 134.924   2.990  10.706
  431   1HG   LYS  54           HG2      LYS  54 136.524   2.440   8.823
  432   2HG   LYS  54           HG1      LYS  54 137.725   3.427   9.649
  433   1HD   LYS  54           HD2      LYS  54 136.319   1.014  10.832
  434   2HD   LYS  54           HD1      LYS  54 137.982   1.046  10.245
  435   1HE   LYS  54           HE2      LYS  54 138.285   1.399  12.537
  436   2HE   LYS  54           HE1      LYS  54 138.241   3.056  11.935
  437   1HZ   LYS  54           HZ2      LYS  54 135.629   2.481  12.330
  438   2HZ   LYS  54           HZ1      LYS  54 136.370   1.659  13.618
  439   3HZ   LYS  54           HZ3      LYS  54 136.617   3.325  13.423
  440    H    ASP  55           HN       ASP  55 134.946   7.210   9.068
  441    HA   ASP  55           HA       ASP  55 133.452   7.785  11.472
  442   1HB   ASP  55           HB2      ASP  55 133.949   9.256   8.888
  443   2HB   ASP  55           HB1      ASP  55 132.866   9.929  10.109
  444    H    GLU  56           HN       GLU  56 131.415   6.996  11.811
  445    HA   GLU  56           HA       GLU  56 129.769   5.871   9.782
  446   1HB   GLU  56           HB2      GLU  56 129.657   5.257  12.168
  447   2HB   GLU  56           HB1      GLU  56 128.996   6.847  12.540
  448   1HG   GLU  56           HG2      GLU  56 127.043   6.383  11.102
  449   2HG   GLU  56           HG1      GLU  56 127.710   4.797  10.709
  450    H    ASP  57           HN       ASP  57 129.601   9.097  11.318
  451    HA   ASP  57           HA       ASP  57 127.118   9.804  10.020
  452   1HB   ASP  57           HB2      ASP  57 129.326  11.480  11.243
  453   2HB   ASP  57           HB1      ASP  57 127.829  12.166  10.617
  454    H    LEU  58           HN       LEU  58 130.511  10.297   9.217
  455    HA   LEU  58           HA       LEU  58 129.932  11.876   6.848
  456   1HB   LEU  58           HB2      LEU  58 132.405  10.251   7.508
  457   2HB   LEU  58           HB1      LEU  58 132.290  11.461   6.236
  458    HG   LEU  58           HG       LEU  58 131.926  11.984   9.205
  459   1HD1  LEU  58          HD11      LEU  58 134.271  11.522   8.515
  460   2HD1  LEU  58          HD13      LEU  58 134.151  12.798   7.307
  461   3HD1  LEU  58          HD12      LEU  58 134.051  13.194   9.023
  462   1HD2  LEU  58          HD22      LEU  58 131.613  13.694   6.739
  463   2HD2  LEU  58          HD21      LEU  58 130.600  13.627   8.183
  464   3HD2  LEU  58          HD23      LEU  58 132.165  14.433   8.243
  465    H    PHE  59           HN       PHE  59 130.491   8.426   7.445
  466    HA   PHE  59           HA       PHE  59 130.435   7.650   4.677
  467   1HB   PHE  59           HB2      PHE  59 131.312   6.115   6.342
  468   2HB   PHE  59           HB1      PHE  59 129.768   6.092   7.193
  469    HD1  PHE  59           HD1      PHE  59 131.340   5.313   3.885
  470    HD2  PHE  59           HD2      PHE  59 128.096   4.534   6.594
  471    HE1  PHE  59           HE1      PHE  59 130.569   3.457   2.429
  472    HE2  PHE  59           HE2      PHE  59 127.325   2.680   5.138
  473    HZ   PHE  59           HZ       PHE  59 128.561   2.142   3.056
  474    H    ARG  60           HN       ARG  60 127.884   7.661   7.189
  475    HA   ARG  60           HA       ARG  60 125.790   6.735   5.511
  476   1HB   ARG  60           HB2      ARG  60 125.746   8.502   7.964
  477   2HB   ARG  60           HB1      ARG  60 124.284   7.891   7.190
  478   1HG   ARG  60           HG2      ARG  60 125.083   5.579   7.500
  479   2HG   ARG  60           HG1      ARG  60 126.542   6.177   8.273
  480   1HD   ARG  60           HD2      ARG  60 124.977   5.541  10.009
  481   2HD   ARG  60           HD1      ARG  60 125.096   7.299   9.993
  482    HE   ARG  60           HE       ARG  60 122.960   6.747   8.304
  483   1HH1  ARG  60          HH21      ARG  60 123.893   5.981  11.533
  484   2HH1  ARG  60          HH22      ARG  60 122.267   5.866  12.117
  485   1HH2  ARG  60          HH11      ARG  60 120.830   6.598   9.047
  486   2HH2  ARG  60          HH12      ARG  60 120.532   6.214  10.710
  487    H    GLU  61           HN       GLU  61 126.780  10.115   6.231
  488    HA   GLU  61           HA       GLU  61 124.731  11.328   4.639
  489   1HB   GLU  61           HB2      GLU  61 126.146  12.579   6.267
  490   2HB   GLU  61           HB1      GLU  61 127.536  12.347   5.206
  491   1HG   GLU  61           HG2      GLU  61 126.371  13.572   3.403
  492   2HG   GLU  61           HG1      GLU  61 124.980  13.804   4.461
  493    H    TRP  62           HN       TRP  62 127.941  10.066   3.880
  494    HA   TRP  62           HA       TRP  62 128.098  11.097   1.220
  495   1HB   TRP  62           HB2      TRP  62 130.099  10.246   2.237
  496   2HB   TRP  62           HB1      TRP  62 129.357   8.671   2.518
  497    HD1  TRP  62           HD1      TRP  62 130.716  10.882  -0.313
  498    HE1  TRP  62           HE1      TRP  62 131.168   9.393  -2.373
  499    HE3  TRP  62           HE3      TRP  62 128.747   6.466   1.342
  500    HZ2  TRP  62           HZ2      TRP  62 130.741   6.676  -3.207
  501    HZ3  TRP  62           HZ3      TRP  62 128.790   4.451  -0.098
  502    HH2  TRP  62           HH2      TRP  62 129.782   4.552  -2.366
  503    H    LEU  63           HN       LEU  63 126.901   7.945   2.414
  504    HA   LEU  63           HA       LEU  63 126.274   7.003  -0.233
  505   1HB   LEU  63           HB2      LEU  63 126.646   5.462   1.648
  506   2HB   LEU  63           HB1      LEU  63 125.219   6.099   2.460
  507    HG   LEU  63           HG       LEU  63 123.808   5.329   0.587
  508   1HD1  LEU  63          HD11      LEU  63 126.485   4.558  -0.554
  509   2HD1  LEU  63          HD13      LEU  63 125.054   3.620  -0.985
  510   3HD1  LEU  63          HD12      LEU  63 125.118   5.341  -1.350
  511   1HD2  LEU  63          HD23      LEU  63 125.642   3.253   1.813
  512   2HD2  LEU  63          HD22      LEU  63 124.097   3.814   2.454
  513   3HD2  LEU  63          HD21      LEU  63 124.143   2.863   0.969
  514    H    LYS  64           HN       LYS  64 124.222   8.289   2.382
  515    HA   LYS  64           HA       LYS  64 121.777   8.199   0.917
  516   1HB   LYS  64           HB2      LYS  64 121.851   8.569   3.358
  517   2HB   LYS  64           HB1      LYS  64 122.575  10.155   3.093
  518   1HG   LYS  64           HG2      LYS  64 120.578  10.887   1.860
  519   2HG   LYS  64           HG1      LYS  64 119.856   9.290   2.056
  520   1HD   LYS  64           HD2      LYS  64 119.916   9.578   4.510
  521   2HD   LYS  64           HD1      LYS  64 120.604  11.189   4.297
  522   1HE   LYS  64           HE2      LYS  64 118.136  11.253   4.650
  523   2HE   LYS  64           HE1      LYS  64 118.608  11.917   3.085
  524   1HZ   LYS  64           HZ2      LYS  64 118.040   9.059   3.206
  525   2HZ   LYS  64           HZ1      LYS  64 116.713  10.111   3.335
  526   3HZ   LYS  64           HZ3      LYS  64 117.718  10.180   1.971
  527    H    ASP  65           HN       ASP  65 124.120  10.848   1.293
  528    HA   ASP  65           HA       ASP  65 122.677  12.663  -0.421
  529   1HB   ASP  65           HB2      ASP  65 124.449  13.303   1.279
  530   2HB   ASP  65           HB1      ASP  65 125.653  12.690   0.145
  531    H    THR  66           HN       THR  66 124.993  10.102  -0.998
  532    HA   THR  66           HA       THR  66 125.587  10.973  -3.719
  533    HB   THR  66           HB       THR  66 126.215   8.406  -2.242
  534    HG1  THR  66           HG1      THR  66 127.370  10.881  -2.543
  535   1HG2  THR  66          HG22      THR  66 126.908   9.355  -5.026
  536   2HG2  THR  66          HG21      THR  66 127.888   8.162  -4.173
  537   3HG2  THR  66          HG23      THR  66 126.199   7.812  -4.546
  538    H    CYS  67           HN       CYS  67 123.314   8.601  -2.283
  539    HA   CYS  67           HA       CYS  67 122.255   8.174  -5.070
  540   1HB   CYS  67           HB2      CYS  67 121.847   5.835  -4.516
  541   2HB   CYS  67           HB1      CYS  67 123.556   6.213  -4.310
  542    HG   CYS  67           HG       CYS  67 122.005   6.546  -1.709
  543    H    GLY  68           HN       GLY  68 121.499   8.480  -1.636
  544   1HA   GLY  68           HA2      GLY  68 119.380   9.534  -0.993
  545   2HA   GLY  68           HA1      GLY  68 118.613   8.777  -2.389
  546    H    ALA  69           HN       ALA  69 120.835   6.741  -0.736
  547    HA   ALA  69           HA       ALA  69 118.967   4.728  -0.152
  548   1HB   ALA  69           HB2      ALA  69 121.564   5.398   1.270
  549   2HB   ALA  69           HB1      ALA  69 120.657   3.906   1.520
  550   3HB   ALA  69           HB3      ALA  69 121.351   4.261  -0.063
  551    H    ASN  70           HN       ASN  70 117.908   4.122   1.866
  552    HA   ASN  70           HA       ASN  70 117.070   6.492   3.413
  553   1HB   ASN  70           HB2      ASN  70 116.142   3.606   3.389
  554   2HB   ASN  70           HB1      ASN  70 115.441   4.862   4.412
  555   1HD2  ASN  70          HD22      ASN  70 114.237   6.701   1.438
  556   2HD2  ASN  70          HD21      ASN  70 115.166   7.043   2.816
  557    H    ALA  71           HN       ALA  71 116.766   6.083   5.837
  558    HA   ALA  71           HA       ALA  71 119.294   5.734   7.076
  559   1HB   ALA  71           HB2      ALA  71 117.426   7.009   8.085
  560   2HB   ALA  71           HB1      ALA  71 116.543   5.502   8.328
  561   3HB   ALA  71           HB3      ALA  71 118.052   5.789   9.195
  562    H    LYS  72           HN       LYS  72 116.643   3.426   6.538
  563    HA   LYS  72           HA       LYS  72 117.765   1.402   8.260
  564   1HB   LYS  72           HB2      LYS  72 115.364   1.509   7.463
  565   2HB   LYS  72           HB1      LYS  72 115.935   0.981   5.881
  566   1HG   LYS  72           HG2      LYS  72 116.867  -1.064   6.890
  567   2HG   LYS  72           HG1      LYS  72 116.311  -0.537   8.479
  568   1HD   LYS  72           HD2      LYS  72 113.980  -0.554   7.680
  569   2HD   LYS  72           HD1      LYS  72 114.525  -1.067   6.084
  570   1HE   LYS  72           HE2      LYS  72 113.867  -3.077   7.159
  571   2HE   LYS  72           HE1      LYS  72 115.624  -3.061   7.293
  572   1HZ   LYS  72           HZ1      LYS  72 114.365  -1.684   9.455
  573   2HZ   LYS  72           HZ3      LYS  72 113.850  -3.297   9.353
  574   3HZ   LYS  72           HZ2      LYS  72 115.505  -2.943   9.493
  575    H    GLN  73           HN       GLN  73 118.003   2.055   4.777
  576    HA   GLN  73           HA       GLN  73 119.556  -0.281   4.177
  577   1HB   GLN  73           HB2      GLN  73 119.237   2.367   2.747
  578   2HB   GLN  73           HB1      GLN  73 120.172   1.022   2.092
  579   1HG   GLN  73           HG2      GLN  73 118.233  -0.405   2.042
  580   2HG   GLN  73           HG1      GLN  73 117.277   0.769   2.945
  581   1HE2  GLN  73          HE22      GLN  73 116.821   1.020  -0.878
  582   2HE2  GLN  73          HE21      GLN  73 116.947  -0.360   0.104
  583    H    SER  74           HN       SER  74 120.475   3.055   5.050
  584    HA   SER  74           HA       SER  74 123.260   2.717   4.589
  585   1HB   SER  74           HB2      SER  74 121.781   4.541   6.501
  586   2HB   SER  74           HB1      SER  74 123.485   4.688   6.090
  587    HG   SER  74           HG       SER  74 121.950   5.989   4.826
  588    H    ARG  75           HN       ARG  75 121.267   2.120   7.511
  589    HA   ARG  75           HA       ARG  75 123.452   1.632   9.267
  590   1HB   ARG  75           HB2      ARG  75 120.616   0.581   9.261
  591   2HB   ARG  75           HB1      ARG  75 121.763   0.226  10.553
  592   1HG   ARG  75           HG2      ARG  75 122.076   2.642  10.944
  593   2HG   ARG  75           HG1      ARG  75 120.930   3.001   9.655
  594   1HD   ARG  75           HD2      ARG  75 120.287   1.410  12.155
  595   2HD   ARG  75           HD1      ARG  75 119.866   3.103  11.900
  596    HE   ARG  75           HE       ARG  75 118.774   1.801   9.706
  597   1HH1  ARG  75          HH21      ARG  75 118.648   1.492  13.137
  598   2HH1  ARG  75          HH22      ARG  75 117.035   0.859  13.154
  599   1HH2  ARG  75          HH11      ARG  75 116.669   0.978   9.709
  600   2HH2  ARG  75          HH12      ARG  75 115.916   0.568  11.213
  601    H    ASP  76           HN       ASP  76 121.790  -0.556   6.993
  602    HA   ASP  76           HA       ASP  76 123.091  -2.929   7.912
  603   1HB   ASP  76           HB2      ASP  76 121.873  -2.191   5.245
  604   2HB   ASP  76           HB1      ASP  76 122.486  -3.805   5.611
  605    H    CYS  77           HN       CYS  77 124.039  -0.563   5.399
  606    HA   CYS  77           HA       CYS  77 126.280  -2.114   4.481
  607   1HB   CYS  77           HB2      CYS  77 125.608   0.827   4.290
  608   2HB   CYS  77           HB1      CYS  77 127.041   0.119   3.544
  609    HG   CYS  77           HG       CYS  77 124.157  -0.851   2.801
  610    H    PHE  78           HN       PHE  78 125.985   0.463   6.967
  611    HA   PHE  78           HA       PHE  78 128.759   0.834   7.403
  612   1HB   PHE  78           HB2      PHE  78 127.046   2.258   8.444
  613   2HB   PHE  78           HB1      PHE  78 126.506   0.902   9.433
  614    HD1  PHE  78           HD2      PHE  78 127.899   0.028  11.253
  615    HD2  PHE  78           HD1      PHE  78 129.153   3.397   8.900
  616    HE1  PHE  78           HE2      PHE  78 129.640   0.557  12.938
  617    HE2  PHE  78           HE1      PHE  78 130.894   3.924  10.585
  618    HZ   PHE  78           HZ       PHE  78 131.137   2.505  12.605
  619    H    GLY  79           HN       GLY  79 126.595  -1.228   9.364
  620   1HA   GLY  79           HA2      GLY  79 128.678  -2.531  10.782
  621   2HA   GLY  79           HA1      GLY  79 127.058  -3.190  10.563
  622    H    CYS  80           HN       CYS  80 127.318  -3.155   7.613
  623    HA   CYS  80           HA       CYS  80 128.442  -5.806   7.308
  624   1HB   CYS  80           HB2      CYS  80 126.593  -4.897   5.888
  625   2HB   CYS  80           HB1      CYS  80 127.755  -3.798   5.146
  626    HG   CYS  80           HG       CYS  80 127.673  -6.870   4.720
  627    H    LEU  81           HN       LEU  81 129.538  -2.578   6.108
  628    HA   LEU  81           HA       LEU  81 132.028  -3.670   5.117
  629   1HB   LEU  81           HB2      LEU  81 131.264  -0.816   5.819
  630   2HB   LEU  81           HB1      LEU  81 132.681  -1.297   4.884
  631    HG   LEU  81           HG       LEU  81 129.808  -1.879   4.103
  632   1HD1  LEU  81          HD13      LEU  81 130.492   0.546   4.021
  633   2HD1  LEU  81          HD12      LEU  81 131.753   0.094   2.875
  634   3HD1  LEU  81          HD11      LEU  81 130.056  -0.133   2.452
  635   1HD2  LEU  81          HD22      LEU  81 132.495  -2.554   2.914
  636   2HD2  LEU  81          HD21      LEU  81 131.043  -3.549   3.028
  637   3HD2  LEU  81          HD23      LEU  81 131.134  -2.261   1.831
  638    H    ARG  82           HN       ARG  82 131.039  -2.024   8.117
  639    HA   ARG  82           HA       ARG  82 133.641  -1.772   9.241
  640   1HB   ARG  82           HB2      ARG  82 131.582  -0.660  10.117
  641   2HB   ARG  82           HB1      ARG  82 131.028  -2.219  10.717
  642   1HG   ARG  82           HG2      ARG  82 133.797  -1.509  11.559
  643   2HG   ARG  82           HG1      ARG  82 132.554  -0.428  12.182
  644   1HD   ARG  82           HD2      ARG  82 132.470  -3.449  12.432
  645   2HD   ARG  82           HD1      ARG  82 133.009  -2.351  13.702
  646    HE   ARG  82           HE       ARG  82 130.494  -1.403  13.043
  647   1HH1  ARG  82          HH21      ARG  82 131.867  -4.436  13.932
  648   2HH1  ARG  82          HH22      ARG  82 130.432  -5.007  14.716
  649   1HH2  ARG  82          HH11      ARG  82 128.611  -2.131  14.061
  650   2HH2  ARG  82          HH12      ARG  82 128.588  -3.702  14.788
  651    H    GLU  83           HN       GLU  83 131.291  -4.438   9.374
  652    HA   GLU  83           HA       GLU  83 132.879  -6.051  11.158
  653   1HB   GLU  83           HB2      GLU  83 130.582  -6.680   9.295
  654   2HB   GLU  83           HB1      GLU  83 131.378  -7.926  10.259
  655   1HG   GLU  83           HG2      GLU  83 130.828  -6.777  12.316
  656   2HG   GLU  83           HG1      GLU  83 130.205  -5.387  11.432
  657    H    TRP  84           HN       TRP  84 132.693  -5.833   7.596
  658    HA   TRP  84           HA       TRP  84 134.309  -8.131   7.064
  659   1HB   TRP  84           HB2      TRP  84 132.962  -6.879   5.347
  660   2HB   TRP  84           HB1      TRP  84 134.154  -5.581   5.429
  661    HD1  TRP  84           HD1      TRP  84 133.671  -9.150   4.219
  662    HE1  TRP  84           HE1      TRP  84 135.649  -9.808   2.705
  663    HE3  TRP  84           HE3      TRP  84 136.702  -5.100   4.923
  664    HZ2  TRP  84           HZ2      TRP  84 138.187  -8.758   1.903
  665    HZ3  TRP  84           HZ3      TRP  84 138.896  -4.962   3.778
  666    HH2  TRP  84           HH2      TRP  84 139.637  -6.781   2.269
  667    H    CYS  85           HN       CYS  85 135.131  -4.697   7.577
  668    HA   CYS  85           HA       CYS  85 137.923  -4.926   7.087
  669   1HB   CYS  85           HB2      CYS  85 136.347  -3.058   8.871
  670   2HB   CYS  85           HB1      CYS  85 138.079  -2.885   8.591
  671    HG   CYS  85           HG       CYS  85 136.783  -3.048   5.918
  672    H    ASP  86           HN       ASP  86 136.051  -5.406  10.066
  673    HA   ASP  86           HA       ASP  86 138.256  -5.729  11.832
  674   1HB   ASP  86           HB2      ASP  86 135.467  -6.908  11.875
  675   2HB   ASP  86           HB1      ASP  86 136.620  -7.107  13.196
  676    H    ALA  87           HN       ALA  87 136.839  -7.895   9.471
  677    HA   ALA  87           HA       ALA  87 138.392 -10.196  10.517
  678   1HB   ALA  87           HB3      ALA  87 136.050 -10.521   9.750
  679   2HB   ALA  87           HB2      ALA  87 136.539 -10.034   8.126
  680   3HB   ALA  87           HB1      ALA  87 137.198 -11.505   8.842
  681    H    PHE  88           HN       PHE  88 138.330  -8.055   7.684
  682    HA   PHE  88           HA       PHE  88 140.724  -9.497   6.596
  683   1HB   PHE  88           HB2      PHE  88 138.683  -7.719   5.282
  684   2HB   PHE  88           HB1      PHE  88 140.101  -8.363   4.461
  685    HD1  PHE  88           HD2      PHE  88 140.387 -10.856   4.258
  686    HD2  PHE  88           HD1      PHE  88 136.753  -9.061   5.683
  687    HE1  PHE  88           HE2      PHE  88 139.169 -12.970   3.819
  688    HE2  PHE  88           HE1      PHE  88 135.535 -11.175   5.241
  689    HZ   PHE  88           HZ       PHE  88 136.742 -13.126   4.304
  690    H    LEU  89           HN       LEU  89 140.005  -6.481   8.147
  691    HA   LEU  89           HA       LEU  89 142.270  -5.140   6.730
  692   1HB   LEU  89           HB2      LEU  89 140.059  -3.931   7.118
  693   2HB   LEU  89           HB1      LEU  89 140.449  -3.949   8.836
  694    HG   LEU  89           HG       LEU  89 142.716  -2.875   8.104
  695   1HD1  LEU  89          HD13      LEU  89 140.979  -2.362   5.666
  696   2HD1  LEU  89          HD12      LEU  89 142.409  -1.407   6.058
  697   3HD1  LEU  89          HD11      LEU  89 142.567  -3.120   5.703
  698   1HD2  LEU  89          HD23      LEU  89 140.103  -1.346   7.919
  699   2HD2  LEU  89          HD22      LEU  89 141.016  -1.672   9.392
  700   3HD2  LEU  89          HD21      LEU  89 141.687  -0.608   8.155
  701   1H    MET   1           HT2      MET   1 166.450  -2.685  -5.439
  702   2H    MET   1           HT1      MET   1 167.304  -4.001  -6.091
  703   3H    MET   1           HT3      MET   1 165.676  -3.757  -6.506
  704    HA   MET   1           HA       MET   1 164.883  -4.610  -4.582
  705   1HB   MET   1           HB2      MET   1 167.646  -5.812  -4.897
  706   2HB   MET   1           HB1      MET   1 166.427  -6.462  -3.800
  707   1HG   MET   1           HG2      MET   1 164.872  -6.741  -5.704
  708   2HG   MET   1           HG1      MET   1 166.108  -6.121  -6.797
  709   1HE   MET   1           HE3      MET   1 168.307  -6.888  -6.988
  710   2HE   MET   1           HE2      MET   1 168.920  -7.700  -5.551
  711   3HE   MET   1           HE1      MET   1 168.785  -8.589  -7.066
  712    H    THR   2           HN       THR   2 167.837  -5.235  -3.015
  713    HA   THR   2           HA       THR   2 168.563  -4.553  -0.884
  714    HB   THR   2           HB       THR   2 168.051  -1.731  -1.829
  715    HG1  THR   2           HG1      THR   2 170.352  -3.055  -2.640
  716   1HG2  THR   2          HG21      THR   2 169.139  -2.237   0.392
  717   2HG2  THR   2          HG23      THR   2 170.453  -3.007  -0.496
  718   3HG2  THR   2          HG22      THR   2 170.141  -1.284  -0.704
  719    H    THR   3           HN       THR   3 165.577  -4.842  -1.350
  720    HA   THR   3           HA       THR   3 164.156  -2.836   0.082
  721    HB   THR   3           HB       THR   3 162.408  -4.533   0.359
  722    HG1  THR   3           HG1      THR   3 164.495  -6.149   0.450
  723   1HG2  THR   3          HG22      THR   3 162.829  -3.517  -1.894
  724   2HG2  THR   3          HG21      THR   3 163.826  -4.916  -2.290
  725   3HG2  THR   3          HG23      THR   3 162.103  -5.122  -1.976
  726    H    SER   4           HN       SER   4 163.797  -2.531   2.276
  727    HA   SER   4           HA       SER   4 165.681  -3.818   4.107
  728   1HB   SER   4           HB2      SER   4 164.716  -2.306   5.789
  729   2HB   SER   4           HB1      SER   4 165.109  -1.419   4.320
  730    HG   SER   4           HG       SER   4 162.913  -1.605   3.721
  731    H    GLN   5           HN       GLN   5 164.781  -4.626   6.262
  732    HA   GLN   5           HA       GLN   5 163.145  -6.917   5.814
  733   1HB   GLN   5           HB2      GLN   5 163.929  -5.480   8.365
  734   2HB   GLN   5           HB1      GLN   5 163.050  -7.009   8.346
  735   1HG   GLN   5           HG2      GLN   5 165.336  -7.621   8.565
  736   2HG   GLN   5           HG1      GLN   5 164.960  -7.901   6.867
  737   1HE2  GLN   5          HE22      GLN   5 166.951  -4.376   7.566
  738   2HE2  GLN   5          HE21      GLN   5 165.600  -4.774   8.514
  739    H    LYS   6           HN       LYS   6 162.260  -3.609   6.407
  740    HA   LYS   6           HA       LYS   6 159.775  -3.964   7.711
  741   1HB   LYS   6           HB2      LYS   6 160.685  -1.887   5.708
  742   2HB   LYS   6           HB1      LYS   6 159.193  -1.774   6.639
  743   1HG   LYS   6           HG2      LYS   6 160.490  -1.862   8.736
  744   2HG   LYS   6           HG1      LYS   6 161.985  -1.971   7.805
  745   1HD   LYS   6           HD2      LYS   6 161.502   0.214   6.764
  746   2HD   LYS   6           HD1      LYS   6 160.009   0.327   7.696
  747   1HE   LYS   6           HE2      LYS   6 161.786   1.607   8.800
  748   2HE   LYS   6           HE1      LYS   6 161.330   0.223   9.794
  749   1HZ   LYS   6           HZ2      LYS   6 163.316  -0.615   8.026
  750   2HZ   LYS   6           HZ1      LYS   6 163.847   0.845   8.718
  751   3HZ   LYS   6           HZ3      LYS   6 163.419  -0.458   9.715
  752    H    HIS   7           HN       HIS   7 160.656  -4.111   4.266
  753    HA   HIS   7           HA       HIS   7 158.030  -4.179   3.203
  754   1HB   HIS   7           HB2      HIS   7 159.945  -3.900   1.743
  755   2HB   HIS   7           HB1      HIS   7 160.581  -5.477   2.207
  756    HD2  HIS   7           HD2      HIS   7 159.371  -7.679   0.917
  757    HE1  HIS   7           HE1      HIS   7 156.704  -5.441  -1.472
  758    HE2  HIS   7           HE2      HIS   7 157.656  -7.751  -1.046
  759    H    ARG   8           HN       ARG   8 160.122  -6.965   4.081
  760    HA   ARG   8           HA       ARG   8 158.066  -8.893   3.525
  761   1HB   ARG   8           HB2      ARG   8 160.636  -9.031   5.120
  762   2HB   ARG   8           HB1      ARG   8 159.583 -10.429   4.864
  763   1HG   ARG   8           HG2      ARG   8 159.798 -10.136   2.416
  764   2HG   ARG   8           HG1      ARG   8 160.861  -8.753   2.679
  765   1HD   ARG   8           HD2      ARG   8 161.394 -11.590   3.609
  766   2HD   ARG   8           HD1      ARG   8 162.174 -10.794   2.240
  767    HE   ARG   8           HE       ARG   8 162.715  -9.087   4.327
  768   1HH1  ARG   8          HH21      ARG   8 163.008 -12.473   3.758
  769   2HH1  ARG   8          HH22      ARG   8 164.393 -12.663   4.780
  770   1HH2  ARG   8          HH11      ARG   8 164.524  -9.312   5.667
  771   2HH2  ARG   8          HH12      ARG   8 165.252 -10.871   5.863
  772    H    ASP   9           HN       ASP   9 158.994  -7.044   6.343
  773    HA   ASP   9           HA       ASP   9 157.443  -8.574   8.244
  774   1HB   ASP   9           HB2      ASP   9 158.522  -5.758   8.293
  775   2HB   ASP   9           HB1      ASP   9 157.679  -6.488   9.652
  776    H    PHE  10           HN       PHE  10 156.796  -5.683   6.267
  777    HA   PHE  10           HA       PHE  10 154.251  -5.098   7.454
  778   1HB   PHE  10           HB2      PHE  10 155.626  -3.536   6.035
  779   2HB   PHE  10           HB1      PHE  10 155.136  -4.477   4.627
  780    HD1  PHE  10           HD1      PHE  10 153.976  -2.237   7.321
  781    HD2  PHE  10           HD2      PHE  10 152.862  -4.390   3.775
  782    HE1  PHE  10           HE1      PHE  10 151.854  -0.957   7.212
  783    HE2  PHE  10           HE2      PHE  10 150.738  -3.111   3.667
  784    HZ   PHE  10           HZ       PHE  10 150.235  -1.395   5.385
  785    H    VAL  11           HN       VAL  11 155.136  -7.023   4.573
  786    HA   VAL  11           HA       VAL  11 152.316  -7.697   4.074
  787    HB   VAL  11           HB       VAL  11 153.208  -9.071   2.249
  788   1HG1  VAL  11          HG13      VAL  11 154.577  -6.379   2.533
  789   2HG1  VAL  11          HG12      VAL  11 154.451  -7.281   1.024
  790   3HG1  VAL  11          HG11      VAL  11 152.995  -6.679   1.815
  791   1HG2  VAL  11          HG21      VAL  11 155.816  -8.506   3.658
  792   2HG2  VAL  11          HG23      VAL  11 155.146 -10.068   3.186
  793   3HG2  VAL  11          HG22      VAL  11 155.776  -8.969   1.957
  794    H    ALA  12           HN       ALA  12 154.038  -8.514   6.571
  795    HA   ALA  12           HA       ALA  12 153.424 -11.454   6.480
  796   1HB   ALA  12           HB2      ALA  12 155.526  -9.895   7.994
  797   2HB   ALA  12           HB1      ALA  12 155.133 -11.577   8.346
  798   3HB   ALA  12           HB3      ALA  12 155.781 -11.135   6.767
  799    H    GLU  13           HN       GLU  13 152.505  -8.488   7.919
  800    HA   GLU  13           HA       GLU  13 150.755  -9.947   9.773
  801   1HB   GLU  13           HB2      GLU  13 151.491  -8.463  11.714
  802   2HB   GLU  13           HB1      GLU  13 152.629  -9.724  11.245
  803   1HG   GLU  13           HG2      GLU  13 154.025  -8.181  10.097
  804   2HG   GLU  13           HG1      GLU  13 152.791  -6.921  10.129
  805    HA   PRO  14           HA       PRO  14 147.788  -6.790   8.771
  806   1HB   PRO  14           HB2      PRO  14 147.653  -6.299  11.740
  807   2HB   PRO  14           HB1      PRO  14 146.328  -6.474  10.569
  808   1HG   PRO  14           HG2      PRO  14 147.018  -8.482  12.180
  809   2HG   PRO  14           HG1      PRO  14 146.504  -8.772  10.507
  810   1HD   PRO  14           HD2      PRO  14 149.228  -8.995  11.690
  811   2HD   PRO  14           HD1      PRO  14 148.549  -9.795  10.254
  812    H    MET  15           HN       MET  15 147.526  -4.409   8.848
  813    HA   MET  15           HA       MET  15 150.123  -3.054   9.297
  814   1HB   MET  15           HB2      MET  15 148.813  -1.099   8.230
  815   2HB   MET  15           HB1      MET  15 149.155  -2.493   7.206
  816   1HG   MET  15           HG2      MET  15 146.945  -3.291   7.334
  817   2HG   MET  15           HG1      MET  15 146.586  -2.348   8.780
  818   1HE   MET  15           HE1      MET  15 147.979  -2.029   5.244
  819   2HE   MET  15           HE3      MET  15 146.301  -2.488   4.932
  820   3HE   MET  15           HE2      MET  15 146.891  -0.900   4.442
  821    H    GLY  16           HN       GLY  16 147.024  -3.385  10.778
  822   1HA   GLY  16           HA2      GLY  16 146.038  -2.325  12.632
  823   2HA   GLY  16           HA1      GLY  16 147.697  -2.211  13.220
  824    H    GLU  17           HN       GLU  17 147.651  -0.141  14.062
  825    HA   GLU  17           HA       GLU  17 146.749   2.096  12.295
  826   1HB   GLU  17           HB2      GLU  17 147.249   1.916  15.277
  827   2HB   GLU  17           HB1      GLU  17 146.874   3.422  14.439
  828   1HG   GLU  17           HG2      GLU  17 144.755   2.449  13.632
  829   2HG   GLU  17           HG1      GLU  17 145.127   0.942  14.472
  830    H    LYS  18           HN       LYS  18 149.410   0.683  12.069
  831    HA   LYS  18           HA       LYS  18 151.471   2.294  13.189
  832   1HB   LYS  18           HB2      LYS  18 151.387   0.670  10.627
  833   2HB   LYS  18           HB1      LYS  18 152.856   1.421  11.248
  834   1HG   LYS  18           HG2      LYS  18 152.524   0.168  13.396
  835   2HG   LYS  18           HG1      LYS  18 151.166  -0.672  12.646
  836   1HD   LYS  18           HD2      LYS  18 152.723  -1.434  10.827
  837   2HD   LYS  18           HD1      LYS  18 154.058  -0.731  11.741
  838   1HE   LYS  18           HE2      LYS  18 152.370  -3.128  12.393
  839   2HE   LYS  18           HE1      LYS  18 154.118  -2.928  12.517
  840   1HZ   LYS  18           HZ2      LYS  18 152.180  -1.484  14.236
  841   2HZ   LYS  18           HZ1      LYS  18 152.906  -2.955  14.677
  842   3HZ   LYS  18           HZ3      LYS  18 153.865  -1.578  14.430
  843    HA   PRO  19           HA       PRO  19 151.007   6.073  10.910
  844   1HB   PRO  19           HB2      PRO  19 153.628   6.938  10.746
  845   2HB   PRO  19           HB1      PRO  19 152.647   7.034  12.221
  846   1HG   PRO  19           HG2      PRO  19 154.679   4.988  11.439
  847   2HG   PRO  19           HG1      PRO  19 154.418   5.771  13.009
  848   1HD   PRO  19           HD2      PRO  19 153.521   3.264  12.512
  849   2HD   PRO  19           HD1      PRO  19 152.618   4.388  13.553
  850    H    VAL  20           HN       VAL  20 151.376   7.057   8.839
  851    HA   VAL  20           HA       VAL  20 151.504   5.306   6.648
  852    HB   VAL  20           HB       VAL  20 150.559   7.552   6.475
  853   1HG1  VAL  20          HG13      VAL  20 152.373   8.559   7.986
  854   2HG1  VAL  20          HG12      VAL  20 153.384   8.630   6.543
  855   3HG1  VAL  20          HG11      VAL  20 151.871   9.535   6.607
  856   1HG2  VAL  20          HG23      VAL  20 151.547   6.373   4.453
  857   2HG2  VAL  20          HG22      VAL  20 151.428   8.127   4.308
  858   3HG2  VAL  20          HG21      VAL  20 152.983   7.376   4.666
  859    H    GLY  21           HN       GLY  21 154.109   7.298   8.037
  860   1HA   GLY  21           HA2      GLY  21 156.123   6.778   6.152
  861   2HA   GLY  21           HA1      GLY  21 156.432   7.100   7.856
  862    H    SER  22           HN       SER  22 154.504   4.441   7.956
  863    HA   SER  22           HA       SER  22 156.811   2.683   8.394
  864   1HB   SER  22           HB2      SER  22 153.834   2.119   8.540
  865   2HB   SER  22           HB1      SER  22 155.108   1.034   9.087
  866    HG   SER  22           HG       SER  22 155.387   2.235  10.804
  867    H    LEU  23           HN       LEU  23 154.597   3.388   5.834
  868    HA   LEU  23           HA       LEU  23 154.648   0.870   4.466
  869   1HB   LEU  23           HB2      LEU  23 154.357   3.676   3.358
  870   2HB   LEU  23           HB1      LEU  23 154.006   2.199   2.466
  871    HG   LEU  23           HG       LEU  23 152.650   3.020   5.053
  872   1HD1  LEU  23          HD11      LEU  23 152.097   4.501   3.134
  873   2HD1  LEU  23          HD13      LEU  23 151.615   3.084   2.201
  874   3HD1  LEU  23          HD12      LEU  23 150.711   3.538   3.646
  875   1HD2  LEU  23          HD23      LEU  23 152.450   0.628   3.228
  876   2HD2  LEU  23          HD22      LEU  23 152.403   0.695   4.990
  877   3HD2  LEU  23          HD21      LEU  23 150.996   1.190   4.054
  878    H    ALA  24           HN       ALA  24 156.134  -0.017   3.106
  879    HA   ALA  24           HA       ALA  24 158.841   0.930   3.153
  880   1HB   ALA  24           HB1      ALA  24 158.079  -1.455   2.743
  881   2HB   ALA  24           HB3      ALA  24 157.638  -0.954   1.110
  882   3HB   ALA  24           HB2      ALA  24 159.320  -0.873   1.634
  883    H    GLY  25           HN       GLY  25 159.933   2.246   1.778
  884   1HA   GLY  25           HA2      GLY  25 160.357   3.291  -0.384
  885   2HA   GLY  25           HA1      GLY  25 158.654   3.083  -0.793
  886    H    ILE  26           HN       ILE  26 158.178   4.059   2.154
  887    HA   ILE  26           HA       ILE  26 158.130   6.961   1.429
  888    HB   ILE  26           HB       ILE  26 156.793   5.524   3.746
  889   1HG1  ILE  26          HG12      ILE  26 155.875   4.646   1.676
  890   2HG1  ILE  26          HG11      ILE  26 154.709   5.769   2.370
  891   1HG2  ILE  26          HG21      ILE  26 156.440   8.283   2.544
  892   2HG2  ILE  26          HG23      ILE  26 155.383   7.588   3.773
  893   3HG2  ILE  26          HG22      ILE  26 157.078   7.902   4.144
  894   1HD1  ILE  26          HD13      ILE  26 155.850   7.550   0.849
  895   2HD1  ILE  26          HD12      ILE  26 156.505   6.162  -0.019
  896   3HD1  ILE  26          HD11      ILE  26 154.762   6.384   0.102
  897    H    GLY  27           HN       GLY  27 159.841   8.144   2.241
  898   1HA   GLY  27           HA2      GLY  27 161.341   7.086   4.562
  899   2HA   GLY  27           HA1      GLY  27 161.839   8.424   3.526
  900    H    GLU  28           HN       GLU  28 162.044   8.888   6.165
  901    HA   GLU  28           HA       GLU  28 159.795   9.803   7.584
  902   1HB   GLU  28           HB2      GLU  28 162.659  10.783   7.592
  903   2HB   GLU  28           HB1      GLU  28 161.450  11.328   8.754
  904   1HG   GLU  28           HG2      GLU  28 161.083   9.006   9.480
  905   2HG   GLU  28           HG1      GLU  28 162.277   8.444   8.308
  906    H    VAL  29           HN       VAL  29 161.777  11.577   5.200
  907    HA   VAL  29           HA       VAL  29 160.415  14.085   5.613
  908    HB   VAL  29           HB       VAL  29 161.987  13.029   3.247
  909   1HG1  VAL  29          HG12      VAL  29 160.786  15.743   3.822
  910   2HG1  VAL  29          HG11      VAL  29 162.155  15.541   2.727
  911   3HG1  VAL  29          HG13      VAL  29 160.615  14.761   2.367
  912   1HG2  VAL  29          HG22      VAL  29 162.651  14.788   5.622
  913   2HG2  VAL  29          HG21      VAL  29 163.393  13.252   5.176
  914   3HG2  VAL  29          HG23      VAL  29 163.679  14.687   4.194
  915    H    LEU  30           HN       LEU  30 159.945  11.423   3.315
  916    HA   LEU  30           HA       LEU  30 157.835  12.702   1.845
  917   1HB   LEU  30           HB2      LEU  30 158.459   9.758   2.216
  918   2HB   LEU  30           HB1      LEU  30 157.329  10.403   1.028
  919    HG   LEU  30           HG       LEU  30 160.269  11.141   1.184
  920   1HD1  LEU  30          HD13      LEU  30 158.800   9.250  -0.679
  921   2HD1  LEU  30          HD12      LEU  30 160.481   9.749  -0.864
  922   3HD1  LEU  30          HD11      LEU  30 159.995   8.795   0.537
  923   1HD2  LEU  30          HD23      LEU  30 157.976  11.949  -0.599
  924   2HD2  LEU  30          HD22      LEU  30 159.273  12.939   0.067
  925   3HD2  LEU  30          HD21      LEU  30 159.600  11.863  -1.285
  926    H    GLY  31           HN       GLY  31 157.864  10.591   4.688
  927   1HA   GLY  31           HA2      GLY  31 155.054  10.168   4.864
  928   2HA   GLY  31           HA1      GLY  31 156.160  10.135   6.237
  929    H    LYS  32           HN       LYS  32 157.094  12.846   5.993
  930    HA   LYS  32           HA       LYS  32 155.059  14.192   7.494
  931   1HB   LYS  32           HB2      LYS  32 157.576  15.198   6.153
  932   2HB   LYS  32           HB1      LYS  32 156.544  16.215   7.160
  933   1HG   LYS  32           HG2      LYS  32 156.833  14.649   9.046
  934   2HG   LYS  32           HG1      LYS  32 157.868  13.633   8.041
  935   1HD   LYS  32           HD2      LYS  32 159.455  15.505   7.775
  936   2HD   LYS  32           HD1      LYS  32 158.423  16.521   8.783
  937   1HE   LYS  32           HE2      LYS  32 160.161  15.644  10.204
  938   2HE   LYS  32           HE1      LYS  32 158.670  14.797  10.616
  939   1HZ   LYS  32           HZ2      LYS  32 160.419  13.668   8.547
  940   2HZ   LYS  32           HZ1      LYS  32 160.862  13.484  10.177
  941   3HZ   LYS  32           HZ3      LYS  32 159.375  12.878   9.629
  942    H    LYS  33           HN       LYS  33 156.022  14.486   4.054
  943    HA   LYS  33           HA       LYS  33 154.309  16.733   3.525
  944   1HB   LYS  33           HB2      LYS  33 155.353  14.561   1.681
  945   2HB   LYS  33           HB1      LYS  33 154.515  16.008   1.125
  946   1HG   LYS  33           HG2      LYS  33 156.253  17.420   2.167
  947   2HG   LYS  33           HG1      LYS  33 157.096  15.971   2.721
  948   1HD   LYS  33           HD2      LYS  33 157.350  15.227   0.374
  949   2HD   LYS  33           HD1      LYS  33 156.530  16.686  -0.173
  950   1HE   LYS  33           HE2      LYS  33 158.960  16.930   1.589
  951   2HE   LYS  33           HE1      LYS  33 159.157  16.621  -0.135
  952   1HZ   LYS  33           HZ2      LYS  33 157.799  18.569  -0.599
  953   2HZ   LYS  33           HZ1      LYS  33 157.646  18.878   1.065
  954   3HZ   LYS  33           HZ3      LYS  33 159.166  18.980   0.321
  955    H    LEU  34           HN       LEU  34 153.784  13.214   3.223
  956    HA   LEU  34           HA       LEU  34 151.133  13.394   2.141
  957   1HB   LEU  34           HB2      LEU  34 152.462  11.230   3.797
  958   2HB   LEU  34           HB1      LEU  34 150.891  11.048   3.030
  959    HG   LEU  34           HG       LEU  34 153.418  11.754   1.517
  960   1HD1  LEU  34          HD13      LEU  34 152.082   9.079   2.009
  961   2HD1  LEU  34          HD12      LEU  34 153.304   9.348   0.766
  962   3HD1  LEU  34          HD11      LEU  34 153.718   9.553   2.469
  963   1HD2  LEU  34          HD23      LEU  34 150.564  11.116   0.743
  964   2HD2  LEU  34          HD22      LEU  34 151.625  12.384   0.132
  965   3HD2  LEU  34          HD21      LEU  34 151.877  10.717  -0.365
  966    H    GLU  35           HN       GLU  35 152.374  13.277   5.439
  967    HA   GLU  35           HA       GLU  35 149.873  13.057   6.794
  968   1HB   GLU  35           HB2      GLU  35 152.036  12.778   7.933
  969   2HB   GLU  35           HB1      GLU  35 152.399  14.486   7.685
  970   1HG   GLU  35           HG2      GLU  35 150.444  15.106   9.057
  971   2HG   GLU  35           HG1      GLU  35 150.062  13.399   9.290
  972    H    GLU  36           HN       GLU  36 151.617  15.910   5.623
  973    HA   GLU  36           HA       GLU  36 149.778  17.844   6.710
  974   1HB   GLU  36           HB2      GLU  36 151.728  17.934   4.393
  975   2HB   GLU  36           HB1      GLU  36 150.776  19.331   4.895
  976   1HG   GLU  36           HG2      GLU  36 152.554  17.777   6.791
  977   2HG   GLU  36           HG1      GLU  36 153.102  19.202   5.906
  978    H    ARG  37           HN       ARG  37 149.651  15.668   4.057
  979    HA   ARG  37           HA       ARG  37 147.550  17.207   2.651
  980   1HB   ARG  37           HB2      ARG  37 148.815  14.523   2.051
  981   2HB   ARG  37           HB1      ARG  37 147.642  15.331   1.015
  982   1HG   ARG  37           HG2      ARG  37 150.190  16.713   1.870
  983   2HG   ARG  37           HG1      ARG  37 150.169  15.631   0.482
  984   1HD   ARG  37           HD2      ARG  37 148.265  17.018  -0.457
  985   2HD   ARG  37           HD1      ARG  37 148.554  18.170   0.844
  986    HE   ARG  37           HE       ARG  37 151.046  17.854  -0.312
  987   1HH1  ARG  37          HH21      ARG  37 147.864  18.604  -1.404
  988   2HH1  ARG  37          HH22      ARG  37 148.404  19.618  -2.699
  989   1HH2  ARG  37          HH11      ARG  37 151.770  19.175  -1.993
  990   2HH2  ARG  37          HH12      ARG  37 150.617  19.943  -3.033
  991    H    GLY  38           HN       GLY  38 147.498  15.314   5.349
  992   1HA   GLY  38           HA2      GLY  38 145.365  14.823   6.397
  993   2HA   GLY  38           HA1      GLY  38 144.656  14.556   4.813
  994    H    PHE  39           HN       PHE  39 147.677  12.998   4.969
  995    HA   PHE  39           HA       PHE  39 146.300  10.391   5.524
  996   1HB   PHE  39           HB2      PHE  39 148.884  11.024   4.090
  997   2HB   PHE  39           HB1      PHE  39 148.280   9.397   4.375
  998    HD1  PHE  39           HD2      PHE  39 146.297   8.570   3.202
  999    HD2  PHE  39           HD1      PHE  39 147.812  12.514   2.510
 1000    HE1  PHE  39           HE2      PHE  39 144.881   8.755   1.172
 1001    HE2  PHE  39           HE1      PHE  39 146.405  12.710   0.479
 1002    HZ   PHE  39           HZ       PHE  39 144.935  10.826  -0.190
 1003    H    ASP  40           HN       ASP  40 146.539  11.075   7.883
 1004    HA   ASP  40           HA       ASP  40 149.263  11.062   8.965
 1005   1HB   ASP  40           HB2      ASP  40 148.131  11.212  11.157
 1006   2HB   ASP  40           HB1      ASP  40 147.506  12.418  10.032
 1007    H    LYS  41           HN       LYS  41 146.994   8.665   8.065
 1008    HA   LYS  41           HA       LYS  41 148.516   6.605   9.634
 1009   1HB   LYS  41           HB2      LYS  41 145.540   6.627   9.042
 1010   2HB   LYS  41           HB1      LYS  41 146.411   5.356   9.897
 1011   1HG   LYS  41           HG2      LYS  41 146.353   8.235  10.833
 1012   2HG   LYS  41           HG1      LYS  41 145.200   7.026  11.385
 1013   1HD   LYS  41           HD2      LYS  41 147.232   5.620  12.076
 1014   2HD   LYS  41           HD1      LYS  41 148.194   7.077  11.824
 1015   1HE   LYS  41           HE2      LYS  41 147.597   7.043  14.146
 1016   2HE   LYS  41           HE1      LYS  41 146.608   8.284  13.377
 1017   1HZ   LYS  41           HZ1      LYS  41 144.929   6.385  13.084
 1018   2HZ   LYS  41           HZ3      LYS  41 145.823   5.595  14.289
 1019   3HZ   LYS  41           HZ2      LYS  41 145.091   7.092  14.620
 1020    H    ALA  42           HN       ALA  42 148.783   4.594   8.579
 1021    HA   ALA  42           HA       ALA  42 149.162   4.748   5.748
 1022   1HB   ALA  42           HB3      ALA  42 150.432   3.268   7.322
 1023   2HB   ALA  42           HB2      ALA  42 149.003   2.241   7.432
 1024   3HB   ALA  42           HB1      ALA  42 149.832   2.434   5.887
 1025    H    TYR  43           HN       TYR  43 146.552   3.186   7.649
 1026    HA   TYR  43           HA       TYR  43 145.363   1.816   5.474
 1027   1HB   TYR  43           HB2      TYR  43 143.313   1.712   6.770
 1028   2HB   TYR  43           HB1      TYR  43 144.697   1.437   7.822
 1029    HD1  TYR  43           HD1      TYR  43 142.291   4.046   6.679
 1030    HD2  TYR  43           HD2      TYR  43 145.077   2.815   9.705
 1031    HE1  TYR  43           HE1      TYR  43 141.533   5.905   8.130
 1032    HE2  TYR  43           HE2      TYR  43 144.320   4.677  11.159
 1033    HH   TYR  43           HH       TYR  43 142.437   7.248  10.014
 1034    H    VAL  44           HN       VAL  44 145.442   5.230   6.069
 1035    HA   VAL  44           HA       VAL  44 143.075   5.794   4.415
 1036    HB   VAL  44           HB       VAL  44 145.322   7.660   5.268
 1037   1HG1  VAL  44          HG11      VAL  44 143.975   8.436   3.318
 1038   2HG1  VAL  44          HG13      VAL  44 142.512   8.244   4.282
 1039   3HG1  VAL  44          HG12      VAL  44 143.723   9.440   4.744
 1040   1HG2  VAL  44          HG23      VAL  44 144.090   6.654   7.187
 1041   2HG2  VAL  44          HG22      VAL  44 143.796   8.386   7.043
 1042   3HG2  VAL  44          HG21      VAL  44 142.576   7.235   6.495
 1043    H    VAL  45           HN       VAL  45 146.516   5.501   4.079
 1044    HA   VAL  45           HA       VAL  45 146.689   6.514   1.349
 1045    HB   VAL  45           HB       VAL  45 148.586   4.810   2.998
 1046   1HG1  VAL  45          HG12      VAL  45 148.836   5.993   0.228
 1047   2HG1  VAL  45          HG11      VAL  45 150.249   5.596   1.204
 1048   3HG1  VAL  45          HG13      VAL  45 149.119   4.327   0.731
 1049   1HG2  VAL  45          HG22      VAL  45 148.395   7.758   2.348
 1050   2HG2  VAL  45          HG21      VAL  45 148.453   6.996   3.936
 1051   3HG2  VAL  45          HG23      VAL  45 149.893   7.023   2.917
 1052    H    LEU  46           HN       LEU  46 146.385   3.330   2.875
 1053    HA   LEU  46           HA       LEU  46 146.646   1.750   0.511
 1054   1HB   LEU  46           HB2      LEU  46 146.632   0.706   2.726
 1055   2HB   LEU  46           HB1      LEU  46 144.992   1.283   3.019
 1056    HG   LEU  46           HG       LEU  46 144.153  -0.097   1.170
 1057   1HD1  LEU  46          HD11      LEU  46 147.085  -0.602   0.748
 1058   2HD1  LEU  46          HD13      LEU  46 145.921  -1.849   0.294
 1059   3HD1  LEU  46          HD12      LEU  46 145.828  -0.250  -0.438
 1060   1HD2  LEU  46          HD22      LEU  46 144.723  -1.011   3.605
 1061   2HD2  LEU  46          HD21      LEU  46 144.122  -2.073   2.338
 1062   3HD2  LEU  46          HD23      LEU  46 145.847  -2.028   2.698
 1063    H    GLY  47           HN       GLY  47 143.950   3.493   1.951
 1064   1HA   GLY  47           HA2      GLY  47 141.853   2.498   0.314
 1065   2HA   GLY  47           HA1      GLY  47 141.862   4.097   1.059
 1066    H    GLN  48           HN       GLN  48 144.168   5.163  -0.237
 1067    HA   GLN  48           HA       GLN  48 143.036   6.112  -2.675
 1068   1HB   GLN  48           HB2      GLN  48 144.854   7.251  -1.371
 1069   2HB   GLN  48           HB1      GLN  48 145.978   6.017  -1.938
 1070   1HG   GLN  48           HG2      GLN  48 146.181   7.946  -3.390
 1071   2HG   GLN  48           HG1      GLN  48 145.386   6.660  -4.300
 1072   1HE2  GLN  48          HE22      GLN  48 142.763   9.464  -2.850
 1073   2HE2  GLN  48          HE21      GLN  48 143.894   8.753  -1.801
 1074    H    PHE  49           HN       PHE  49 145.496   3.602  -2.077
 1075    HA   PHE  49           HA       PHE  49 146.020   2.937  -4.797
 1076   1HB   PHE  49           HB2      PHE  49 147.398   2.162  -2.892
 1077   2HB   PHE  49           HB1      PHE  49 146.066   1.151  -2.341
 1078    HD1  PHE  49           HD1      PHE  49 148.227   1.780  -5.337
 1079    HD2  PHE  49           HD2      PHE  49 145.892  -1.066  -3.118
 1080    HE1  PHE  49           HE1      PHE  49 149.024  -0.036  -6.826
 1081    HE2  PHE  49           HE2      PHE  49 146.688  -2.879  -4.611
 1082    HZ   PHE  49           HZ       PHE  49 148.254  -2.365  -6.464
 1083    H    LEU  50           HN       LEU  50 143.576   1.798  -2.518
 1084    HA   LEU  50           HA       LEU  50 142.453  -0.194  -4.287
 1085   1HB   LEU  50           HB2      LEU  50 141.289   1.292  -1.917
 1086   2HB   LEU  50           HB1      LEU  50 140.438  -0.002  -2.753
 1087    HG   LEU  50           HG       LEU  50 143.200  -0.307  -1.533
 1088   1HD1  LEU  50          HD13      LEU  50 140.457  -0.958  -0.421
 1089   2HD1  LEU  50          HD12      LEU  50 141.951  -1.636   0.231
 1090   3HD1  LEU  50          HD11      LEU  50 141.676   0.106   0.282
 1091   1HD2  LEU  50          HD22      LEU  50 141.283  -2.150  -2.946
 1092   2HD2  LEU  50          HD21      LEU  50 143.039  -2.057  -3.065
 1093   3HD2  LEU  50          HD23      LEU  50 142.291  -2.811  -1.663
 1094    H    VAL  51           HN       VAL  51 141.721   3.227  -3.699
 1095    HA   VAL  51           HA       VAL  51 139.399   3.332  -5.377
 1096    HB   VAL  51           HB       VAL  51 141.327   5.459  -4.419
 1097   1HG1  VAL  51          HG12      VAL  51 138.845   5.704  -6.133
 1098   2HG1  VAL  51          HG11      VAL  51 139.443   7.040  -5.151
 1099   3HG1  VAL  51          HG13      VAL  51 140.446   6.375  -6.441
 1100   1HG2  VAL  51          HG23      VAL  51 139.782   4.256  -2.809
 1101   2HG2  VAL  51          HG22      VAL  51 139.543   6.001  -2.886
 1102   3HG2  VAL  51          HG21      VAL  51 138.426   4.919  -3.721
 1103    H    LEU  52           HN       LEU  52 142.811   3.404  -6.124
 1104    HA   LEU  52           HA       LEU  52 142.317   4.405  -8.876
 1105   1HB   LEU  52           HB2      LEU  52 144.868   3.437  -7.549
 1106   2HB   LEU  52           HB1      LEU  52 144.767   4.137  -9.162
 1107    HG   LEU  52           HG       LEU  52 143.971   5.545  -6.594
 1108   1HD1  LEU  52          HD12      LEU  52 146.439   5.117  -6.928
 1109   2HD1  LEU  52          HD11      LEU  52 146.337   6.054  -8.418
 1110   3HD1  LEU  52          HD13      LEU  52 146.005   6.826  -6.869
 1111   1HD2  LEU  52          HD21      LEU  52 143.847   6.280  -9.517
 1112   2HD2  LEU  52          HD23      LEU  52 142.675   6.598  -8.238
 1113   3HD2  LEU  52          HD22      LEU  52 144.154   7.547  -8.329
 1114    H    LYS  53           HN       LYS  53 141.431   1.660  -7.663
 1115    HA   LYS  53           HA       LYS  53 141.301  -0.561  -8.413
 1116   1HB   LYS  53           HB2      LYS  53 141.789   0.835 -11.063
 1117   2HB   LYS  53           HB1      LYS  53 141.137  -0.792 -10.867
 1118   1HG   LYS  53           HG2      LYS  53 139.212   0.127  -9.621
 1119   2HG   LYS  53           HG1      LYS  53 139.861   1.755  -9.820
 1120   1HD   LYS  53           HD2      LYS  53 139.721   1.515 -12.273
 1121   2HD   LYS  53           HD1      LYS  53 139.068  -0.111 -12.075
 1122   1HE   LYS  53           HE2      LYS  53 137.782   2.432 -11.039
 1123   2HE   LYS  53           HE1      LYS  53 137.265   1.531 -12.465
 1124   1HZ   LYS  53           HZ2      LYS  53 136.880  -0.398 -11.045
 1125   2HZ   LYS  53           HZ1      LYS  53 137.322   0.509  -9.678
 1126   3HZ   LYS  53           HZ3      LYS  53 135.935   0.929 -10.561
 1127    H    LYS  54           HN       LYS  54 143.957   0.374  -7.598
 1128    HA   LYS  54           HA       LYS  54 146.160  -0.398  -7.586
 1129   1HB   LYS  54           HB2      LYS  54 145.135  -2.669  -9.311
 1130   2HB   LYS  54           HB1      LYS  54 146.545  -2.671  -8.254
 1131   1HG   LYS  54           HG2      LYS  54 144.977  -2.225  -6.318
 1132   2HG   LYS  54           HG1      LYS  54 143.639  -2.517  -7.426
 1133   1HD   LYS  54           HD2      LYS  54 145.863  -4.482  -6.795
 1134   2HD   LYS  54           HD1      LYS  54 144.213  -4.567  -6.179
 1135   1HE   LYS  54           HE2      LYS  54 144.106  -6.012  -8.014
 1136   2HE   LYS  54           HE1      LYS  54 143.554  -4.498  -8.732
 1137   1HZ   LYS  54           HZ2      LYS  54 146.241  -4.340  -8.967
 1138   2HZ   LYS  54           HZ1      LYS  54 145.961  -5.995  -9.223
 1139   3HZ   LYS  54           HZ3      LYS  54 145.182  -4.844 -10.196
 1140    H    ASP  55           HN       ASP  55 145.003   1.214  -9.985
 1141    HA   ASP  55           HA       ASP  55 146.528   0.399 -12.296
 1142   1HB   ASP  55           HB2      ASP  55 145.279   2.990 -11.390
 1143   2HB   ASP  55           HB1      ASP  55 146.241   2.927 -12.869
 1144    H    GLU  56           HN       GLU  56 148.737   0.273 -12.269
 1145    HA   GLU  56           HA       GLU  56 150.385   1.440 -10.266
 1146   1HB   GLU  56           HB2      GLU  56 150.978  -0.573 -11.560
 1147   2HB   GLU  56           HB1      GLU  56 151.150   0.414 -13.010
 1148   1HG   GLU  56           HG2      GLU  56 152.957   1.705 -11.926
 1149   2HG   GLU  56           HG1      GLU  56 152.777   0.729 -10.467
 1150    H    ASP  57           HN       ASP  57 149.733   2.548 -13.606
 1151    HA   ASP  57           HA       ASP  57 151.688   4.671 -13.498
 1152   1HB   ASP  57           HB2      ASP  57 149.233   4.248 -15.225
 1153   2HB   ASP  57           HB1      ASP  57 150.354   5.590 -15.452
 1154    H    LEU  58           HN       LEU  58 148.242   4.506 -12.808
 1155    HA   LEU  58           HA       LEU  58 147.997   7.351 -12.278
 1156   1HB   LEU  58           HB2      LEU  58 146.259   5.069 -11.303
 1157   2HB   LEU  58           HB1      LEU  58 145.831   6.774 -11.241
 1158    HG   LEU  58           HG       LEU  58 146.376   5.184 -13.769
 1159   1HD1  LEU  58          HD11      LEU  58 144.229   4.636 -12.641
 1160   2HD1  LEU  58          HD13      LEU  58 143.795   6.343 -12.674
 1161   3HD1  LEU  58          HD12      LEU  58 143.975   5.448 -14.183
 1162   1HD2  LEU  58          HD22      LEU  58 145.839   8.102 -13.224
 1163   2HD2  LEU  58          HD21      LEU  58 146.986   7.373 -14.348
 1164   3HD2  LEU  58          HD23      LEU  58 145.266   7.383 -14.730
 1165    H    PHE  59           HN       PHE  59 148.624   4.506 -10.260
 1166    HA   PHE  59           HA       PHE  59 148.575   5.920  -7.756
 1167   1HB   PHE  59           HB2      PHE  59 148.435   3.495  -7.775
 1168   2HB   PHE  59           HB1      PHE  59 150.002   3.372  -8.574
 1169    HD1  PHE  59           HD1      PHE  59 148.355   4.657  -5.466
 1170    HD2  PHE  59           HD2      PHE  59 151.988   3.272  -7.299
 1171    HE1  PHE  59           HE1      PHE  59 149.483   4.679  -3.255
 1172    HE2  PHE  59           HE2      PHE  59 153.113   3.297  -5.089
 1173    HZ   PHE  59           HZ       PHE  59 151.860   4.001  -3.067
 1174    H    ARG  60           HN       ARG  60 151.282   4.982  -9.901
 1175    HA   ARG  60           HA       ARG  60 153.337   6.172  -8.347
 1176   1HB   ARG  60           HB2      ARG  60 153.131   5.654 -11.320
 1177   2HB   ARG  60           HB1      ARG  60 154.603   6.236 -10.541
 1178   1HG   ARG  60           HG2      ARG  60 154.612   4.260  -9.068
 1179   2HG   ARG  60           HG1      ARG  60 153.145   3.671  -9.835
 1180   1HD   ARG  60           HD2      ARG  60 155.034   2.538 -10.847
 1181   2HD   ARG  60           HD1      ARG  60 154.370   3.666 -12.029
 1182    HE   ARG  60           HE       ARG  60 156.346   5.125 -10.729
 1183   1HH1  ARG  60          HH21      ARG  60 156.106   2.109 -12.381
 1184   2HH1  ARG  60          HH22      ARG  60 157.745   2.131 -12.939
 1185   1HH2  ARG  60          HH11      ARG  60 158.490   5.172 -11.448
 1186   2HH2  ARG  60          HH12      ARG  60 159.095   3.865 -12.411
 1187    H    GLU  61           HN       GLU  61 151.446   7.590 -11.057
 1188    HA   GLU  61           HA       GLU  61 152.798  10.113 -11.025
 1189   1HB   GLU  61           HB2      GLU  61 151.277   9.377 -12.858
 1190   2HB   GLU  61           HB1      GLU  61 149.909   9.527 -11.755
 1191   1HG   GLU  61           HG2      GLU  61 150.399  11.934 -11.468
 1192   2HG   GLU  61           HG1      GLU  61 151.768  11.783 -12.569
 1193    H    TRP  62           HN       TRP  62 150.078   8.820  -9.185
 1194    HA   TRP  62           HA       TRP  62 149.278  11.283  -7.974
 1195   1HB   TRP  62           HB2      TRP  62 147.783   9.408  -7.846
 1196   2HB   TRP  62           HB1      TRP  62 149.008   8.410  -7.063
 1197    HD1  TRP  62           HD1      TRP  62 146.689  11.394  -6.380
 1198    HE1  TRP  62           HE1      TRP  62 146.472  11.697  -3.828
 1199    HE3  TRP  62           HE3      TRP  62 150.127   7.964  -4.790
 1200    HZ2  TRP  62           HZ2      TRP  62 147.621  10.625  -1.421
 1201    HZ3  TRP  62           HZ3      TRP  62 150.539   7.624  -2.373
 1202    HH2  TRP  62           HH2      TRP  62 149.293   8.948  -0.690
 1203    H    LEU  63           HN       LEU  63 151.538   8.762  -6.824
 1204    HA   LEU  63           HA       LEU  63 152.093  10.162  -4.370
 1205   1HB   LEU  63           HB2      LEU  63 152.456   7.740  -4.600
 1206   2HB   LEU  63           HB1      LEU  63 153.701   8.034  -5.810
 1207    HG   LEU  63           HG       LEU  63 155.040   9.257  -4.135
 1208   1HD1  LEU  63          HD11      LEU  63 152.619   8.717  -2.430
 1209   2HD1  LEU  63          HD13      LEU  63 154.206   8.837  -1.670
 1210   3HD1  LEU  63          HD12      LEU  63 153.564  10.199  -2.583
 1211   1HD2  LEU  63          HD23      LEU  63 154.112   6.489  -3.334
 1212   2HD2  LEU  63          HD22      LEU  63 155.470   6.888  -4.384
 1213   3HD2  LEU  63          HD21      LEU  63 155.541   7.276  -2.666
 1214    H    LYS  64           HN       LYS  64 153.951   9.834  -7.397
 1215    HA   LYS  64           HA       LYS  64 156.099  11.536  -6.615
 1216   1HB   LYS  64           HB2      LYS  64 156.215  10.073  -8.602
 1217   2HB   LYS  64           HB1      LYS  64 155.004  11.071  -9.405
 1218   1HG   LYS  64           HG2      LYS  64 156.504  13.017  -9.298
 1219   2HG   LYS  64           HG1      LYS  64 157.708  12.057  -8.437
 1220   1HD   LYS  64           HD2      LYS  64 157.864  10.535 -10.378
 1221   2HD   LYS  64           HD1      LYS  64 156.688  11.526 -11.242
 1222   1HE   LYS  64           HE2      LYS  64 159.035  12.083 -11.869
 1223   2HE   LYS  64           HE1      LYS  64 158.191  13.453 -11.145
 1224   1HZ   LYS  64           HZ2      LYS  64 159.632  11.670  -9.342
 1225   2HZ   LYS  64           HZ1      LYS  64 160.569  12.679 -10.336
 1226   3HZ   LYS  64           HZ3      LYS  64 159.434  13.355  -9.274
 1227    H    ASP  65           HN       ASP  65 153.111  12.296  -8.391
 1228    HA   ASP  65           HA       ASP  65 153.691  15.110  -8.609
 1229   1HB   ASP  65           HB2      ASP  65 152.031  13.813 -10.023
 1230   2HB   ASP  65           HB1      ASP  65 150.950  13.825  -8.630
 1231    H    THR  66           HN       THR  66 152.237  13.116  -6.127
 1232    HA   THR  66           HA       THR  66 151.070  15.379  -4.704
 1233    HB   THR  66           HB       THR  66 151.463  12.486  -3.907
 1234    HG1  THR  66           HG1      THR  66 149.564  13.960  -5.237
 1235   1HG2  THR  66          HG22      THR  66 150.173  14.815  -2.480
 1236   2HG2  THR  66          HG21      THR  66 149.728  13.145  -2.134
 1237   3HG2  THR  66          HG23      THR  66 151.381  13.691  -1.857
 1238    H    CYS  67           HN       CYS  67 154.129  13.533  -4.402
 1239    HA   CYS  67           HA       CYS  67 154.915  15.499  -2.262
 1240   1HB   CYS  67           HB2      CYS  67 156.101  13.709  -1.106
 1241   2HB   CYS  67           HB1      CYS  67 154.398  13.290  -1.282
 1242    HG   CYS  67           HG       CYS  67 156.077  12.191  -3.574
 1243    H    GLY  68           HN       GLY  68 155.962  13.562  -5.023
 1244   1HA   GLY  68           HA2      GLY  68 157.705  14.467  -6.491
 1245   2HA   GLY  68           HA1      GLY  68 158.491  15.169  -5.077
 1246    H    ALA  69           HN       ALA  69 157.237  12.010  -4.566
 1247    HA   ALA  69           HA       ALA  69 159.697  10.862  -3.845
 1248   1HB   ALA  69           HB2      ALA  69 157.218   9.524  -4.973
 1249   2HB   ALA  69           HB1      ALA  69 158.568   8.651  -4.248
 1250   3HB   ALA  69           HB3      ALA  69 157.608   9.761  -3.270
 1251    H    ASN  70           HN       ASN  70 161.131   9.395  -5.011
 1252    HA   ASN  70           HA       ASN  70 161.373  10.142  -7.857
 1253   1HB   ASN  70           HB2      ASN  70 163.146   8.553  -5.983
 1254   2HB   ASN  70           HB1      ASN  70 163.539   8.885  -7.670
 1255   1HD2  ASN  70          HD21      ASN  70 162.921  11.500  -8.069
 1256   2HD2  ASN  70          HD22      ASN  70 163.732  12.511  -6.974
 1257    H    ALA  71           HN       ALA  71 162.085   8.298  -9.349
 1258    HA   ALA  71           HA       ALA  71 159.963   6.438  -9.651
 1259   1HB   ALA  71           HB2      ALA  71 161.450   7.153 -11.500
 1260   2HB   ALA  71           HB1      ALA  71 162.782   6.266 -10.756
 1261   3HB   ALA  71           HB3      ALA  71 161.378   5.395 -11.370
 1262    H    LYS  72           HN       LYS  72 163.115   6.111  -8.035
 1263    HA   LYS  72           HA       LYS  72 162.903   3.251  -7.725
 1264   1HB   LYS  72           HB2      LYS  72 165.033   4.609  -7.551
 1265   2HB   LYS  72           HB1      LYS  72 164.465   5.177  -5.982
 1266   1HG   LYS  72           HG2      LYS  72 164.350   2.852  -5.172
 1267   2HG   LYS  72           HG1      LYS  72 164.907   2.274  -6.743
 1268   1HD   LYS  72           HD2      LYS  72 167.009   3.530  -6.473
 1269   2HD   LYS  72           HD1      LYS  72 166.458   4.126  -4.908
 1270   1HE   LYS  72           HE2      LYS  72 167.838   2.270  -4.384
 1271   2HE   LYS  72           HE1      LYS  72 166.194   1.648  -4.252
 1272   1HZ   LYS  72           HZ1      LYS  72 167.214   1.446  -6.912
 1273   2HZ   LYS  72           HZ3      LYS  72 168.195   0.619  -5.801
 1274   3HZ   LYS  72           HZ2      LYS  72 166.542   0.243  -5.917
 1275    H    GLN  73           HN       GLN  73 162.045   6.005  -5.655
 1276    HA   GLN  73           HA       GLN  73 161.237   4.411  -3.410
 1277   1HB   GLN  73           HB2      GLN  73 160.538   7.232  -4.255
 1278   2HB   GLN  73           HB1      GLN  73 159.994   6.516  -2.737
 1279   1HG   GLN  73           HG2      GLN  73 162.260   6.209  -1.980
 1280   2HG   GLN  73           HG1      GLN  73 162.906   6.649  -3.561
 1281   1HE2  GLN  73          HE22      GLN  73 162.788   9.592  -1.069
 1282   2HE2  GLN  73          HE21      GLN  73 163.221   7.972  -0.803
 1283    H    SER  74           HN       SER  74 159.440   5.714  -6.203
 1284    HA   SER  74           HA       SER  74 156.863   4.956  -5.272
 1285   1HB   SER  74           HB2      SER  74 157.923   5.288  -8.089
 1286   2HB   SER  74           HB1      SER  74 156.220   5.146  -7.666
 1287    HG   SER  74           HG       SER  74 157.108   7.341  -7.864
 1288    H    ARG  75           HN       ARG  75 159.288   3.161  -7.211
 1289    HA   ARG  75           HA       ARG  75 157.598   0.958  -7.837
 1290   1HB   ARG  75           HB2      ARG  75 160.596   1.145  -7.492
 1291   2HB   ARG  75           HB1      ARG  75 159.786  -0.332  -8.016
 1292   1HG   ARG  75           HG2      ARG  75 158.784   0.887  -9.913
 1293   2HG   ARG  75           HG1      ARG  75 159.593   2.364  -9.396
 1294   1HD   ARG  75           HD2      ARG  75 161.003  -0.206 -10.173
 1295   2HD   ARG  75           HD1      ARG  75 160.839   1.211 -11.210
 1296    HE   ARG  75           HE       ARG  75 162.005   2.202  -8.895
 1297   1HH1  ARG  75          HH21      ARG  75 162.641  -0.326 -11.150
 1298   2HH1  ARG  75          HH22      ARG  75 164.360  -0.257 -10.944
 1299   1HH2  ARG  75          HH11      ARG  75 164.245   2.307  -8.614
 1300   2HH2  ARG  75          HH12      ARG  75 165.268   1.234  -9.509
 1301    H    ASP  76           HN       ASP  76 159.564   1.603  -4.931
 1302    HA   ASP  76           HA       ASP  76 159.193  -0.988  -3.783
 1303   1HB   ASP  76           HB2      ASP  76 159.782   1.708  -2.549
 1304   2HB   ASP  76           HB1      ASP  76 159.755   0.210  -1.619
 1305    H    CYS  77           HN       CYS  77 157.253   2.005  -3.487
 1306    HA   CYS  77           HA       CYS  77 155.513   0.932  -1.465
 1307   1HB   CYS  77           HB2      CYS  77 155.204   3.199  -3.440
 1308   2HB   CYS  77           HB1      CYS  77 153.985   2.809  -2.228
 1309    HG   CYS  77           HG       CYS  77 156.914   3.576  -1.423
 1310    H    PHE  78           HN       PHE  78 155.295   0.999  -5.050
 1311    HA   PHE  78           HA       PHE  78 152.620   0.090  -5.244
 1312   1HB   PHE  78           HB2      PHE  78 153.917   0.833  -7.197
 1313   2HB   PHE  78           HB1      PHE  78 154.971  -0.574  -7.045
 1314    HD1  PHE  78           HD2      PHE  78 154.154  -2.829  -7.555
 1315    HD2  PHE  78           HD1      PHE  78 151.631   0.617  -8.020
 1316    HE1  PHE  78           HE2      PHE  78 152.556  -4.179  -8.886
 1317    HE2  PHE  78           HE1      PHE  78 150.032  -0.735  -9.350
 1318    HZ   PHE  78           HZ       PHE  78 150.495  -3.133  -9.784
 1319    H    GLY  79           HN       GLY  79 155.545  -1.951  -5.514
 1320   1HA   GLY  79           HA2      GLY  79 154.160  -4.423  -5.353
 1321   2HA   GLY  79           HA1      GLY  79 155.865  -4.208  -4.962
 1322    H    CYS  80           HN       CYS  80 155.245  -2.229  -2.844
 1323    HA   CYS  80           HA       CYS  80 154.977  -4.103  -0.654
 1324   1HB   CYS  80           HB2      CYS  80 156.261  -1.960  -0.513
 1325   2HB   CYS  80           HB1      CYS  80 154.732  -1.085  -0.582
 1326    HG   CYS  80           HG       CYS  80 155.718  -2.781   1.821
 1327    H    LEU  81           HN       LEU  81 152.791  -1.496  -1.870
 1328    HA   LEU  81           HA       LEU  81 150.662  -2.295  -0.078
 1329   1HB   LEU  81           HB2      LEU  81 150.577  -0.671  -2.642
 1330   2HB   LEU  81           HB1      LEU  81 149.277  -0.777  -1.452
 1331    HG   LEU  81           HG       LEU  81 152.071   0.261  -0.882
 1332   1HD1  LEU  81          HD13      LEU  81 150.662   1.700  -2.398
 1333   2HD1  LEU  81          HD12      LEU  81 149.471   1.804  -1.100
 1334   3HD1  LEU  81          HD11      LEU  81 151.088   2.469  -0.869
 1335   1HD2  LEU  81          HD22      LEU  81 149.604  -0.185   0.793
 1336   2HD2  LEU  81          HD21      LEU  81 151.297  -0.474   1.198
 1337   3HD2  LEU  81          HD23      LEU  81 150.664   1.169   1.181
 1338    H    ARG  82           HN       ARG  82 151.454  -2.980  -3.480
 1339    HA   ARG  82           HA       ARG  82 149.060  -4.388  -4.108
 1340   1HB   ARG  82           HB2      ARG  82 150.762  -3.630  -5.773
 1341   2HB   ARG  82           HB1      ARG  82 151.843  -4.897  -5.203
 1342   1HG   ARG  82           HG2      ARG  82 149.117  -5.862  -5.920
 1343   2HG   ARG  82           HG1      ARG  82 150.027  -5.202  -7.275
 1344   1HD   ARG  82           HD2      ARG  82 151.081  -7.327  -5.385
 1345   2HD   ARG  82           HD1      ARG  82 150.386  -7.652  -6.974
 1346    HE   ARG  82           HE       ARG  82 152.377  -5.800  -7.496
 1347   1HH1  ARG  82          HH21      ARG  82 152.141  -8.822  -5.858
 1348   2HH1  ARG  82          HH22      ARG  82 153.766  -9.297  -6.219
 1349   1HH2  ARG  82          HH11      ARG  82 154.503  -6.402  -7.980
 1350   2HH2  ARG  82          HH12      ARG  82 155.104  -7.927  -7.422
 1351    H    GLU  83           HN       GLU  83 152.120  -5.504  -2.684
 1352    HA   GLU  83           HA       GLU  83 151.348  -8.282  -2.635
 1353   1HB   GLU  83           HB2      GLU  83 153.480  -6.706  -1.182
 1354   2HB   GLU  83           HB1      GLU  83 153.237  -8.433  -0.907
 1355   1HG   GLU  83           HG2      GLU  83 153.649  -8.928  -3.239
 1356   2HG   GLU  83           HG1      GLU  83 153.691  -7.215  -3.647
 1357    H    TRP  84           HN       TRP  84 151.018  -5.625  -0.268
 1358    HA   TRP  84           HA       TRP  84 150.148  -7.262   1.910
 1359   1HB   TRP  84           HB2      TRP  84 150.814  -4.842   2.090
 1360   2HB   TRP  84           HB1      TRP  84 149.294  -4.415   1.301
 1361    HD1  TRP  84           HD1      TRP  84 150.717  -5.775   4.552
 1362    HE1  TRP  84           HE1      TRP  84 148.872  -5.771   6.350
 1363    HE3  TRP  84           HE3      TRP  84 146.685  -4.533   1.675
 1364    HZ2  TRP  84           HZ2      TRP  84 146.058  -5.311   6.542
 1365    HZ3  TRP  84           HZ3      TRP  84 144.435  -4.330   2.692
 1366    HH2  TRP  84           HH2      TRP  84 144.122  -4.714   5.118
 1367    H    CYS  85           HN       CYS  85 148.365  -5.618  -0.706
 1368    HA   CYS  85           HA       CYS  85 145.744  -6.288   0.176
 1369   1HB   CYS  85           HB2      CYS  85 146.867  -5.807  -2.594
 1370   2HB   CYS  85           HB1      CYS  85 145.147  -6.033  -2.280
 1371    HG   CYS  85           HG       CYS  85 146.090  -3.900  -0.434
 1372    H    ASP  86           HN       ASP  86 148.027  -8.082  -1.872
 1373    HA   ASP  86           HA       ASP  86 146.266 -10.189  -2.613
 1374   1HB   ASP  86           HB2      ASP  86 149.267 -10.138  -2.210
 1375   2HB   ASP  86           HB1      ASP  86 148.404 -11.531  -2.861
 1376    H    ALA  87           HN       ALA  87 147.985  -9.543   0.370
 1377    HA   ALA  87           HA       ALA  87 147.372 -12.254   1.411
 1378   1HB   ALA  87           HB3      ALA  87 149.585 -11.217   1.867
 1379   2HB   ALA  87           HB2      ALA  87 148.772  -9.930   2.758
 1380   3HB   ALA  87           HB1      ALA  87 148.699 -11.590   3.348
 1381    H    PHE  88           HN       PHE  88 146.415  -8.877   1.958
 1382    HA   PHE  88           HA       PHE  88 144.474  -9.809   4.045
 1383   1HB   PHE  88           HB2      PHE  88 145.679  -7.109   3.483
 1384   2HB   PHE  88           HB1      PHE  88 144.444  -7.400   4.704
 1385    HD1  PHE  88           HD2      PHE  88 144.928  -8.983   6.601
 1386    HD2  PHE  88           HD1      PHE  88 147.966  -7.672   3.861
 1387    HE1  PHE  88           HE2      PHE  88 146.681  -9.692   8.204
 1388    HE2  PHE  88           HE1      PHE  88 149.719  -8.379   5.467
 1389    HZ   PHE  88           HZ       PHE  88 149.074  -9.382   7.640
 1390    H    LEU  89           HN       LEU  89 144.403  -8.677   0.770
 1391    HA   LEU  89           HA       LEU  89 141.674  -7.522   1.162
 1392   1HB   LEU  89           HB2      LEU  89 143.428  -6.313  -0.239
 1393   2HB   LEU  89           HB1      LEU  89 143.278  -7.629  -1.403
 1394    HG   LEU  89           HG       LEU  89 140.715  -7.119  -1.312
 1395   1HD1  LEU  89          HD13      LEU  89 141.893  -4.569  -0.160
 1396   2HD1  LEU  89          HD12      LEU  89 140.297  -4.655  -0.900
 1397   3HD1  LEU  89          HD11      LEU  89 140.640  -5.580   0.554
 1398   1HD2  LEU  89          HD23      LEU  89 142.679  -5.187  -2.583
 1399   2HD2  LEU  89          HD22      LEU  89 142.102  -6.697  -3.287
 1400   3HD2  LEU  89          HD21      LEU  89 140.984  -5.354  -3.045
   
  No H/Q in entry =        1400
  Start of MODEL    9
    1   1H    MET   1           HT2      MET   1 113.498 -10.610  11.194
    2   2H    MET   1           HT1      MET   1 113.657 -12.021  10.262
    3   3H    MET   1           HT3      MET   1 112.445 -11.919  11.443
    4    HA   MET   1           HA       MET   1 113.858 -12.290  13.167
    5   1HB   MET   1           HB2      MET   1 115.190 -13.542  10.745
    6   2HB   MET   1           HB1      MET   1 115.596 -13.955  12.411
    7   1HG   MET   1           HG2      MET   1 113.261 -14.624  12.824
    8   2HG   MET   1           HG1      MET   1 112.845 -14.210  11.161
    9   1HE   MET   1           HE1      MET   1 112.212 -16.889  12.491
   10   2HE   MET   1           HE3      MET   1 111.851 -16.623  10.780
   11   3HE   MET   1           HE2      MET   1 112.675 -18.093  11.291
   12    H    THR   2           HN       THR   2 116.839 -12.754  11.928
   13    HA   THR   2           HA       THR   2 117.804 -10.147  12.959
   14    HB   THR   2           HB       THR   2 120.023 -11.199  12.891
   15    HG1  THR   2           HG1      THR   2 119.668 -12.455  11.021
   16   1HG2  THR   2          HG21      THR   2 118.534 -11.619  14.830
   17   2HG2  THR   2          HG23      THR   2 117.921 -13.064  14.027
   18   3HG2  THR   2          HG22      THR   2 119.611 -12.981  14.522
   19    H    THR   3           HN       THR   3 120.238 -10.128  11.413
   20    HA   THR   3           HA       THR   3 119.316  -8.667   9.102
   21    HB   THR   3           HB       THR   3 121.729  -8.575   8.494
   22    HG1  THR   3           HG1      THR   3 121.748 -10.713  10.173
   23   1HG2  THR   3          HG22      THR   3 121.099  -8.109  11.422
   24   2HG2  THR   3          HG21      THR   3 122.502  -7.451  10.581
   25   3HG2  THR   3          HG23      THR   3 120.877  -6.955  10.107
   26    H    SER   4           HN       SER   4 119.856  -9.261   6.839
   27    HA   SER   4           HA       SER   4 118.919 -11.850   6.144
   28   1HB   SER   4           HB2      SER   4 118.822 -10.093   4.502
   29   2HB   SER   4           HB1      SER   4 120.562  -9.836   4.588
   30    HG   SER   4           HG       SER   4 120.149 -12.395   4.061
   31    H    GLN   5           HN       GLN   5 120.145 -13.581   5.107
   32    HA   GLN   5           HA       GLN   5 122.376 -14.421   6.679
   33   1HB   GLN   5           HB2      GLN   5 121.259 -15.425   4.050
   34   2HB   GLN   5           HB1      GLN   5 122.559 -16.236   4.924
   35   1HG   GLN   5           HG2      GLN   5 121.136 -16.551   6.867
   36   2HG   GLN   5           HG1      GLN   5 119.851 -15.596   6.125
   37   1HE2  GLN   5          HE22      GLN   5 119.165 -19.249   5.530
   38   2HE2  GLN   5          HE21      GLN   5 119.410 -18.316   6.927
   39    H    LYS   6           HN       LYS   6 122.200 -12.492   3.791
   40    HA   LYS   6           HA       LYS   6 124.787 -13.031   2.723
   41   1HB   LYS   6           HB2      LYS   6 123.002 -10.595   2.593
   42   2HB   LYS   6           HB1      LYS   6 124.511 -10.736   1.688
   43   1HG   LYS   6           HG2      LYS   6 123.675 -12.793   0.607
   44   2HG   LYS   6           HG1      LYS   6 122.165 -12.652   1.505
   45   1HD   LYS   6           HD2      LYS   6 121.735 -10.464   0.434
   46   2HD   LYS   6           HD1      LYS   6 123.239 -10.621  -0.475
   47   1HE   LYS   6           HE2      LYS   6 122.422 -12.497  -1.702
   48   2HE   LYS   6           HE1      LYS   6 121.056 -12.708  -0.606
   49   1HZ   LYS   6           HZ3      LYS   6 120.503 -10.300  -1.351
   50   2HZ   LYS   6           HZ2      LYS   6 121.463 -10.688  -2.699
   51   3HZ   LYS   6           HZ1      LYS   6 120.082 -11.610  -2.342
   52    H    HIS   7           HN       HIS   7 123.669 -10.762   5.223
   53    HA   HIS   7           HA       HIS   7 126.065  -9.261   5.465
   54   1HB   HIS   7           HB2      HIS   7 124.076  -8.501   6.595
   55   2HB   HIS   7           HB1      HIS   7 123.958  -9.999   7.515
   56    HD2  HIS   7           HD2      HIS   7 125.473 -10.046   9.871
   57    HE1  HIS   7           HE1      HIS   7 127.459  -6.361   9.313
   58    HE2  HIS   7           HE2      HIS   7 127.043  -8.260  10.941
   59    H    ARG   8           HN       ARG   8 125.076 -12.191   7.266
   60    HA   ARG   8           HA       ARG   8 127.540 -12.386   8.722
   61   1HB   ARG   8           HB2      ARG   8 125.339 -14.376   8.101
   62   2HB   ARG   8           HB1      ARG   8 126.704 -14.745   9.159
   63   1HG   ARG   8           HG2      ARG   8 126.103 -12.848  10.604
   64   2HG   ARG   8           HG1      ARG   8 124.741 -12.466   9.556
   65   1HD   ARG   8           HD2      ARG   8 123.994 -14.913   9.988
   66   2HD   ARG   8           HD1      ARG   8 125.119 -14.876  11.343
   67    HE   ARG   8           HE       ARG   8 122.489 -13.763  11.312
   68   1HH1  ARG   8          HH21      ARG   8 125.700 -12.924  12.269
   69   2HH1  ARG   8          HH22      ARG   8 125.185 -11.618  13.281
   70   1HH2  ARG   8          HH11      ARG   8 121.819 -12.082  12.636
   71   2HH2  ARG   8          HH12      ARG   8 122.999 -11.142  13.487
   72    H    ASP   9           HN       ASP   9 126.428 -13.601   5.623
   73    HA   ASP   9           HA       ASP   9 128.581 -15.495   5.242
   74   1HB   ASP   9           HB2      ASP   9 126.713 -14.125   3.299
   75   2HB   ASP   9           HB1      ASP   9 127.864 -15.373   2.830
   76    H    PHE  10           HN       PHE  10 128.073 -12.102   4.309
   77    HA   PHE  10           HA       PHE  10 130.422 -11.864   2.676
   78   1HB   PHE  10           HB2      PHE  10 128.476 -10.248   2.767
   79   2HB   PHE  10           HB1      PHE  10 129.115  -9.667   4.302
   80    HD1  PHE  10           HD2      PHE  10 131.215  -8.406   4.406
   81    HD2  PHE  10           HD1      PHE  10 129.646  -9.817   0.664
   82    HE1  PHE  10           HE2      PHE  10 132.770  -6.907   3.186
   83    HE2  PHE  10           HE1      PHE  10 131.199  -8.316  -0.555
   84    HZ   PHE  10           HZ       PHE  10 132.759  -6.857   0.708
   85    H    VAL  11           HN       VAL  11 129.879 -11.220   6.149
   86    HA   VAL  11           HA       VAL  11 132.681 -10.422   6.526
   87    HB   VAL  11           HB       VAL  11 132.062 -10.222   8.892
   88   1HG1  VAL  11          HG13      VAL  11 130.100  -9.142   6.860
   89   2HG1  VAL  11          HG12      VAL  11 130.023  -8.689   8.561
   90   3HG1  VAL  11          HG11      VAL  11 131.459  -8.308   7.614
   91   1HG2  VAL  11          HG23      VAL  11 129.590 -11.674   7.941
   92   2HG2  VAL  11          HG22      VAL  11 130.666 -12.107   9.269
   93   3HG2  VAL  11          HG21      VAL  11 129.586 -10.721   9.426
   94    H    ALA  12           HN       ALA  12 131.679 -13.263   5.675
   95    HA   ALA  12           HA       ALA  12 133.189 -14.814   7.762
   96   1HB   ALA  12           HB3      ALA  12 130.975 -15.669   5.880
   97   2HB   ALA  12           HB2      ALA  12 131.903 -16.782   6.886
   98   3HB   ALA  12           HB1      ALA  12 130.888 -15.551   7.638
   99    H    GLU  13           HN       GLU  13 133.341 -13.660   4.564
  100    HA   GLU  13           HA       GLU  13 135.689 -15.341   4.069
  101   1HB   GLU  13           HB2      GLU  13 134.735 -15.929   1.724
  102   2HB   GLU  13           HB1      GLU  13 134.174 -16.866   3.108
  103   1HG   GLU  13           HG2      GLU  13 132.159 -15.504   3.268
  104   2HG   GLU  13           HG1      GLU  13 132.732 -14.450   1.975
  105    HA   PRO  14           HA       PRO  14 137.316 -11.713   2.071
  106   1HB   PRO  14           HB2      PRO  14 137.784 -13.452  -0.336
  107   2HB   PRO  14           HB1      PRO  14 138.898 -12.337   0.481
  108   1HG   PRO  14           HG2      PRO  14 139.059 -14.983   0.832
  109   2HG   PRO  14           HG1      PRO  14 139.404 -13.844   2.145
  110   1HD   PRO  14           HD2      PRO  14 137.051 -15.637   1.794
  111   2HD   PRO  14           HD1      PRO  14 137.745 -14.952   3.281
  112    H    MET  15           HN       MET  15 136.862 -10.234   0.229
  113    HA   MET  15           HA       MET  15 134.081 -10.587  -0.757
  114   1HB   MET  15           HB2      MET  15 134.535  -8.138  -1.532
  115   2HB   MET  15           HB1      MET  15 134.351  -8.461   0.189
  116   1HG   MET  15           HG2      MET  15 136.665  -8.305   0.601
  117   2HG   MET  15           HG1      MET  15 137.076  -8.532  -1.099
  118   1HE   MET  15           HE2      MET  15 135.030  -6.540   1.315
  119   2HE   MET  15           HE1      MET  15 136.561  -5.748   1.674
  120   3HE   MET  15           HE3      MET  15 135.254  -4.843   0.899
  121    H    GLY  16           HN       GLY  16 137.355 -10.677  -1.915
  122   1HA   GLY  16           HA2      GLY  16 138.234 -10.980  -4.075
  123   2HA   GLY  16           HA1      GLY  16 136.718 -11.817  -4.413
  124    H    GLU  17           HN       GLU  17 136.247 -10.981  -6.431
  125    HA   GLU  17           HA       GLU  17 136.188  -8.008  -6.772
  126   1HB   GLU  17           HB2      GLU  17 136.173 -10.292  -8.765
  127   2HB   GLU  17           HB1      GLU  17 135.981  -8.596  -9.211
  128   1HG   GLU  17           HG2      GLU  17 138.164  -8.072  -8.198
  129   2HG   GLU  17           HG1      GLU  17 138.362  -9.766  -7.744
  130    H    LYS  18           HN       LYS  18 134.089  -9.582  -5.339
  131    HA   LYS  18           HA       LYS  18 131.817 -10.013  -6.970
  132   1HB   LYS  18           HB2      LYS  18 132.050  -9.146  -4.077
  133   2HB   LYS  18           HB1      LYS  18 130.506  -9.537  -4.833
  134   1HG   LYS  18           HG2      LYS  18 131.398 -11.784  -5.429
  135   2HG   LYS  18           HG1      LYS  18 132.895 -11.389  -4.584
  136   1HD   LYS  18           HD2      LYS  18 131.772 -11.240  -2.474
  137   2HD   LYS  18           HD1      LYS  18 130.184 -11.278  -3.243
  138   1HE   LYS  18           HE2      LYS  18 130.475 -13.567  -3.917
  139   2HE   LYS  18           HE1      LYS  18 132.174 -13.549  -3.446
  140   1HZ   LYS  18           HZ3      LYS  18 130.425 -12.778  -1.316
  141   2HZ   LYS  18           HZ2      LYS  18 130.095 -14.345  -1.886
  142   3HZ   LYS  18           HZ1      LYS  18 131.652 -13.947  -1.335
  143    HA   PRO  19           HA       PRO  19 130.738  -5.922  -8.282
  144   1HB   PRO  19           HB2      PRO  19 127.975  -6.118  -8.423
  145   2HB   PRO  19           HB1      PRO  19 129.084  -6.797  -9.630
  146   1HG   PRO  19           HG2      PRO  19 127.702  -8.159  -7.361
  147   2HG   PRO  19           HG1      PRO  19 127.976  -8.727  -9.019
  148   1HD   PRO  19           HD2      PRO  19 129.500  -9.583  -6.941
  149   2HD   PRO  19           HD1      PRO  19 130.168  -9.385  -8.576
  150    H    VAL  20           HN       VAL  20 129.820  -3.924  -7.568
  151    HA   VAL  20           HA       VAL  20 129.928  -3.406  -4.817
  152    HB   VAL  20           HB       VAL  20 130.091  -1.592  -6.402
  153   1HG1  VAL  20          HG11      VAL  20 128.523  -2.648  -8.083
  154   2HG1  VAL  20          HG13      VAL  20 127.179  -2.074  -7.096
  155   3HG1  VAL  20          HG12      VAL  20 128.278  -0.919  -7.847
  156   1HG2  VAL  20          HG21      VAL  20 128.961  -1.232  -4.109
  157   2HG2  VAL  20          HG23      VAL  20 128.723   0.025  -5.324
  158   3HG2  VAL  20          HG22      VAL  20 127.446  -1.148  -5.005
  159    H    GLY  21           HN       GLY  21 127.066  -4.074  -6.808
  160   1HA   GLY  21           HA2      GLY  21 125.104  -3.666  -4.800
  161   2HA   GLY  21           HA1      GLY  21 124.890  -4.707  -6.205
  162    H    SER  22           HN       SER  22 127.579  -5.921  -4.735
  163    HA   SER  22           HA       SER  22 126.050  -8.125  -3.547
  164   1HB   SER  22           HB2      SER  22 128.137  -9.237  -3.390
  165   2HB   SER  22           HB1      SER  22 128.262  -8.293  -4.870
  166    HG   SER  22           HG       SER  22 129.008  -6.713  -2.923
  167    H    LEU  23           HN       LEU  23 127.766  -5.285  -2.527
  168    HA   LEU  23           HA       LEU  23 128.261  -5.966   0.195
  169   1HB   LEU  23           HB2      LEU  23 127.655  -3.295  -1.103
  170   2HB   LEU  23           HB1      LEU  23 128.201  -3.470   0.563
  171    HG   LEU  23           HG       LEU  23 129.723  -4.552  -1.827
  172   1HD1  LEU  23          HD12      LEU  23 129.504  -2.059  -1.858
  173   2HD1  LEU  23          HD11      LEU  23 130.248  -2.010  -0.258
  174   3HD1  LEU  23          HD13      LEU  23 131.167  -2.605  -1.641
  175   1HD2  LEU  23          HD23      LEU  23 130.233  -4.396   1.145
  176   2HD2  LEU  23          HD22      LEU  23 130.546  -5.723   0.030
  177   3HD2  LEU  23          HD21      LEU  23 131.602  -4.317   0.037
  178    H    ALA  24           HN       ALA  24 126.973  -5.937   1.986
  179    HA   ALA  24           HA       ALA  24 124.140  -6.199   1.662
  180   1HB   ALA  24           HB1      ALA  24 125.842  -5.719   4.116
  181   2HB   ALA  24           HB3      ALA  24 124.110  -6.038   4.184
  182   3HB   ALA  24           HB2      ALA  24 125.208  -7.259   3.541
  183    H    GLY  25           HN       GLY  25 122.514  -4.746   1.818
  184   1HA   GLY  25           HA2      GLY  25 121.482  -2.688   2.603
  185   2HA   GLY  25           HA1      GLY  25 123.084  -1.979   2.783
  186    H    ILE  26           HN       ILE  26 123.716  -3.231   0.007
  187    HA   ILE  26           HA       ILE  26 122.597  -0.940  -1.558
  188    HB   ILE  26           HB       ILE  26 124.783  -2.897  -2.335
  189   1HG1  ILE  26          HG12      ILE  26 125.555  -1.690  -0.383
  190   2HG1  ILE  26          HG11      ILE  26 126.322  -0.969  -1.794
  191   1HG2  ILE  26          HG22      ILE  26 123.661  -1.725  -4.201
  192   2HG2  ILE  26          HG21      ILE  26 124.000  -0.178  -3.426
  193   3HG2  ILE  26          HG23      ILE  26 125.328  -1.180  -4.011
  194   1HD1  ILE  26          HD13      ILE  26 124.289   0.676  -1.761
  195   2HD1  ILE  26          HD12      ILE  26 124.088   0.127  -0.098
  196   3HD1  ILE  26          HD11      ILE  26 125.588   0.910  -0.593
  197    H    GLY  27           HN       GLY  27 120.819  -1.401  -2.816
  198   1HA   GLY  27           HA2      GLY  27 120.218  -4.229  -3.449
  199   2HA   GLY  27           HA1      GLY  27 119.123  -2.860  -3.651
  200    H    GLU  28           HN       GLU  28 119.196  -4.453  -5.768
  201    HA   GLU  28           HA       GLU  28 121.263  -4.137  -7.668
  202   1HB   GLU  28           HB2      GLU  28 118.280  -4.516  -8.059
  203   2HB   GLU  28           HB1      GLU  28 119.448  -4.589  -9.376
  204   1HG   GLU  28           HG2      GLU  28 119.164  -6.847  -8.721
  205   2HG   GLU  28           HG1      GLU  28 120.678  -6.361  -7.961
  206    H    VAL  29           HN       VAL  29 118.431  -2.043  -7.071
  207    HA   VAL  29           HA       VAL  29 118.939  -0.323  -9.322
  208    HB   VAL  29           HB       VAL  29 117.446   0.150  -6.726
  209   1HG1  VAL  29          HG11      VAL  29 117.803   1.884  -9.175
  210   2HG1  VAL  29          HG13      VAL  29 116.391   2.043  -8.130
  211   3HG1  VAL  29          HG12      VAL  29 118.006   2.327  -7.481
  212   1HG2  VAL  29          HG21      VAL  29 116.506  -1.580  -8.224
  213   2HG2  VAL  29          HG23      VAL  29 115.463  -0.159  -8.165
  214   3HG2  VAL  29          HG22      VAL  29 116.512  -0.427  -9.558
  215    H    LEU  30           HN       LEU  30 119.843  -0.104  -5.893
  216    HA   LEU  30           HA       LEU  30 121.185   2.419  -6.105
  217   1HB   LEU  30           HB2      LEU  30 121.651   0.141  -4.157
  218   2HB   LEU  30           HB1      LEU  30 122.268   1.780  -3.962
  219    HG   LEU  30           HG       LEU  30 119.323   1.083  -4.203
  220   1HD1  LEU  30          HD11      LEU  30 120.395   0.192  -2.124
  221   2HD1  LEU  30          HD13      LEU  30 120.913   1.830  -1.729
  222   3HD1  LEU  30          HD12      LEU  30 119.195   1.441  -1.797
  223   1HD2  LEU  30          HD22      LEU  30 120.873   3.638  -3.765
  224   2HD2  LEU  30          HD21      LEU  30 119.502   3.342  -4.835
  225   3HD2  LEU  30          HD23      LEU  30 119.250   3.476  -3.097
  226    H    GLY  31           HN       GLY  31 122.268  -0.907  -6.564
  227   1HA   GLY  31           HA2      GLY  31 125.067  -0.392  -6.723
  228   2HA   GLY  31           HA1      GLY  31 124.249  -1.742  -7.509
  229    H    LYS  32           HN       LYS  32 122.520  -0.230  -9.201
  230    HA   LYS  32           HA       LYS  32 124.236   0.213 -11.438
  231   1HB   LYS  32           HB2      LYS  32 121.854  -0.378 -11.661
  232   2HB   LYS  32           HB1      LYS  32 121.398   1.183 -10.982
  233   1HG   LYS  32           HG2      LYS  32 122.505   2.331 -12.875
  234   2HG   LYS  32           HG1      LYS  32 122.959   0.767 -13.552
  235   1HD   LYS  32           HD2      LYS  32 120.600   0.150 -13.778
  236   2HD   LYS  32           HD1      LYS  32 120.111   1.670 -13.028
  237   1HE   LYS  32           HE2      LYS  32 121.440   2.822 -14.916
  238   2HE   LYS  32           HE1      LYS  32 121.426   1.248 -15.714
  239   1HZ   LYS  32           HZ2      LYS  32 118.896   1.382 -15.154
  240   2HZ   LYS  32           HZ1      LYS  32 119.193   3.054 -15.117
  241   3HZ   LYS  32           HZ3      LYS  32 119.516   2.167 -16.527
  242    H    LYS  33           HN       LYS  33 122.761   2.540  -9.151
  243    HA   LYS  33           HA       LYS  33 123.627   4.866 -10.601
  244   1HB   LYS  33           HB2      LYS  33 122.977   4.440  -7.674
  245   2HB   LYS  33           HB1      LYS  33 123.321   6.023  -8.373
  246   1HG   LYS  33           HG2      LYS  33 121.460   5.727  -9.967
  247   2HG   LYS  33           HG1      LYS  33 121.113   4.147  -9.265
  248   1HD   LYS  33           HD2      LYS  33 120.674   5.202  -7.083
  249   2HD   LYS  33           HD1      LYS  33 121.020   6.787  -7.776
  250   1HE   LYS  33           HE2      LYS  33 118.599   6.415  -7.732
  251   2HE   LYS  33           HE1      LYS  33 119.166   6.447  -9.402
  252   1HZ   LYS  33           HZ3      LYS  33 119.079   3.876  -8.002
  253   2HZ   LYS  33           HZ2      LYS  33 117.615   4.544  -8.550
  254   3HZ   LYS  33           HZ1      LYS  33 118.869   4.214  -9.650
  255    H    LEU  34           HN       LEU  34 125.089   3.135  -7.829
  256    HA   LEU  34           HA       LEU  34 127.395   4.805  -7.621
  257   1HB   LEU  34           HB2      LEU  34 127.083   1.851  -6.996
  258   2HB   LEU  34           HB1      LEU  34 128.434   2.850  -6.477
  259    HG   LEU  34           HG       LEU  34 125.546   3.432  -5.779
  260   1HD1  LEU  34          HD12      LEU  34 126.321   1.294  -4.793
  261   2HD1  LEU  34          HD11      LEU  34 127.714   2.127  -4.105
  262   3HD1  LEU  34          HD13      LEU  34 126.087   2.530  -3.557
  263   1HD2  LEU  34          HD22      LEU  34 128.212   4.669  -5.061
  264   2HD2  LEU  34          HD21      LEU  34 126.703   5.462  -5.516
  265   3HD2  LEU  34          HD23      LEU  34 126.875   4.751  -3.914
  266    H    GLU  35           HN       GLU  35 126.689   1.951  -9.567
  267    HA   GLU  35           HA       GLU  35 129.288   1.598 -10.695
  268   1HB   GLU  35           HB2      GLU  35 127.455  -0.056 -10.922
  269   2HB   GLU  35           HB1      GLU  35 126.595   1.057 -11.985
  270   1HG   GLU  35           HG2      GLU  35 128.401   0.974 -13.614
  271   2HG   GLU  35           HG1      GLU  35 129.377  -0.018 -12.530
  272    H    GLU  36           HN       GLU  36 126.572   3.652 -11.706
  273    HA   GLU  36           HA       GLU  36 127.834   4.614 -14.114
  274   1HB   GLU  36           HB2      GLU  36 125.379   4.806 -13.628
  275   2HB   GLU  36           HB1      GLU  36 125.756   6.016 -12.401
  276   1HG   GLU  36           HG2      GLU  36 126.808   7.442 -14.109
  277   2HG   GLU  36           HG1      GLU  36 126.462   6.230 -15.343
  278    H    ARG  37           HN       ARG  37 128.216   5.312 -10.763
  279    HA   ARG  37           HA       ARG  37 129.507   7.928 -11.269
  280   1HB   ARG  37           HB2      ARG  37 129.013   6.348  -8.735
  281   2HB   ARG  37           HB1      ARG  37 129.861   7.893  -8.770
  282   1HG   ARG  37           HG2      ARG  37 127.868   8.913  -9.870
  283   2HG   ARG  37           HG1      ARG  37 127.017   7.381  -9.688
  284   1HD   ARG  37           HD2      ARG  37 127.482   7.516  -7.216
  285   2HD   ARG  37           HD1      ARG  37 128.100   9.142  -7.470
  286    HE   ARG  37           HE       ARG  37 125.337   8.362  -7.230
  287   1HH1  ARG  37          HH21      ARG  37 127.383  10.425  -9.096
  288   2HH1  ARG  37          HH22      ARG  37 126.075  11.399  -9.672
  289   1HH2  ARG  37          HH11      ARG  37 123.643   9.632  -7.959
  290   2HH2  ARG  37          HH12      ARG  37 123.966  10.958  -9.025
  291    H    GLY  38           HN       GLY  38 130.541   4.826 -11.697
  292   1HA   GLY  38           HA2      GLY  38 132.841   4.439 -12.357
  293   2HA   GLY  38           HA1      GLY  38 133.370   5.650 -11.200
  294    H    PHE  39           HN       PHE  39 131.056   3.658  -9.723
  295    HA   PHE  39           HA       PHE  39 133.245   2.079  -8.409
  296   1HB   PHE  39           HB2      PHE  39 130.428   2.719  -7.522
  297   2HB   PHE  39           HB1      PHE  39 131.562   1.732  -6.609
  298    HD1  PHE  39           HD2      PHE  39 133.551   2.736  -5.570
  299    HD2  PHE  39           HD1      PHE  39 130.705   5.121  -7.717
  300    HE1  PHE  39           HE2      PHE  39 134.537   4.790  -4.590
  301    HE2  PHE  39           HE1      PHE  39 131.686   7.179  -6.738
  302    HZ   PHE  39           HZ       PHE  39 133.605   7.013  -5.173
  303    H    ASP  40           HN       ASP  40 133.134   0.652 -10.419
  304    HA   ASP  40           HA       ASP  40 130.695  -0.949 -10.734
  305   1HB   ASP  40           HB2      ASP  40 131.955  -2.116 -12.493
  306   2HB   ASP  40           HB1      ASP  40 132.073  -0.367 -12.690
  307    H    LYS  41           HN       LYS  41 133.409  -1.131  -8.674
  308    HA   LYS  41           HA       LYS  41 132.779  -4.009  -8.086
  309   1HB   LYS  41           HB2      LYS  41 135.528  -2.719  -8.031
  310   2HB   LYS  41           HB1      LYS  41 135.158  -4.393  -7.626
  311   1HG   LYS  41           HG2      LYS  41 134.536  -3.195 -10.335
  312   2HG   LYS  41           HG1      LYS  41 136.062  -3.998  -9.980
  313   1HD   LYS  41           HD2      LYS  41 134.695  -6.019  -9.250
  314   2HD   LYS  41           HD1      LYS  41 133.287  -5.211  -9.937
  315   1HE   LYS  41           HE2      LYS  41 135.822  -5.766 -11.493
  316   2HE   LYS  41           HE1      LYS  41 134.397  -6.805 -11.524
  317   1HZ   LYS  41           HZ2      LYS  41 133.938  -3.972 -11.992
  318   2HZ   LYS  41           HZ1      LYS  41 134.767  -4.805 -13.219
  319   3HZ   LYS  41           HZ3      LYS  41 133.229  -5.326 -12.732
  320    H    ALA  42           HN       ALA  42 133.000  -4.604  -5.890
  321    HA   ALA  42           HA       ALA  42 132.187  -2.608  -4.014
  322   1HB   ALA  42           HB1      ALA  42 133.194  -5.436  -3.676
  323   2HB   ALA  42           HB3      ALA  42 132.669  -4.446  -2.314
  324   3HB   ALA  42           HB2      ALA  42 131.529  -4.858  -3.594
  325    H    TYR  43           HN       TYR  43 135.389  -4.094  -4.593
  326    HA   TYR  43           HA       TYR  43 136.650  -3.026  -2.299
  327   1HB   TYR  43           HB2      TYR  43 138.778  -3.369  -3.428
  328   2HB   TYR  43           HB1      TYR  43 137.705  -4.730  -3.729
  329    HD1  TYR  43           HD1      TYR  43 138.955  -1.537  -5.205
  330    HD2  TYR  43           HD2      TYR  43 137.143  -5.362  -5.945
  331    HE1  TYR  43           HE1      TYR  43 139.254  -1.209  -7.642
  332    HE2  TYR  43           HE2      TYR  43 137.439  -5.027  -8.384
  333    HH   TYR  43           HH       TYR  43 138.983  -3.684  -9.878
  334    H    VAL  44           HN       VAL  44 135.587  -1.311  -5.130
  335    HA   VAL  44           HA       VAL  44 137.423   0.950  -4.689
  336    HB   VAL  44           HB       VAL  44 134.847   0.907  -6.299
  337   1HG1  VAL  44          HG11      VAL  44 135.845   3.145  -5.672
  338   2HG1  VAL  44          HG13      VAL  44 137.301   2.671  -6.547
  339   3HG1  VAL  44          HG12      VAL  44 135.773   2.849  -7.408
  340   1HG2  VAL  44          HG22      VAL  44 136.548  -0.827  -6.993
  341   2HG2  VAL  44          HG21      VAL  44 136.188   0.374  -8.230
  342   3HG2  VAL  44          HG23      VAL  44 137.679   0.491  -7.295
  343    H    VAL  45           HN       VAL  45 134.211  -0.040  -3.856
  344    HA   VAL  45           HA       VAL  45 133.397   2.487  -2.624
  345    HB   VAL  45           HB       VAL  45 132.256  -0.314  -2.335
  346   1HG1  VAL  45          HG13      VAL  45 131.200   2.407  -1.520
  347   2HG1  VAL  45          HG12      VAL  45 130.212   0.948  -1.578
  348   3HG1  VAL  45          HG11      VAL  45 131.571   1.050  -0.458
  349   1HG2  VAL  45          HG23      VAL  45 132.236   0.663  -4.646
  350   2HG2  VAL  45          HG22      VAL  45 130.623   0.399  -3.986
  351   3HG2  VAL  45          HG21      VAL  45 131.307   2.023  -4.018
  352    H    LEU  46           HN       LEU  46 134.763  -0.593  -1.579
  353    HA   LEU  46           HA       LEU  46 134.653  -0.161   1.242
  354   1HB   LEU  46           HB2      LEU  46 135.280  -2.333   0.155
  355   2HB   LEU  46           HB1      LEU  46 136.783  -1.598  -0.386
  356    HG   LEU  46           HG       LEU  46 137.227  -1.084   2.106
  357   1HD1  LEU  46          HD13      LEU  46 134.929  -3.031   2.324
  358   2HD1  LEU  46          HD12      LEU  46 136.107  -2.812   3.615
  359   3HD1  LEU  46          HD11      LEU  46 135.101  -1.460   3.105
  360   1HD2  LEU  46          HD21      LEU  46 137.341  -3.759   0.758
  361   2HD2  LEU  46          HD23      LEU  46 138.654  -2.695   1.256
  362   3HD2  LEU  46          HD22      LEU  46 137.797  -3.656   2.457
  363    H    GLY  47           HN       GLY  47 136.884   0.822  -1.291
  364   1HA   GLY  47           HA2      GLY  47 138.966   1.924   0.297
  365   2HA   GLY  47           HA1      GLY  47 138.571   2.453  -1.337
  366    H    GLN  48           HN       GLN  48 135.935   3.407  -0.895
  367    HA   GLN  48           HA       GLN  48 136.454   6.036   0.087
  368   1HB   GLN  48           HB2      GLN  48 134.572   5.398  -1.455
  369   2HB   GLN  48           HB1      GLN  48 133.765   4.637  -0.084
  370   1HG   GLN  48           HG2      GLN  48 132.870   6.878  -0.355
  371   2HG   GLN  48           HG1      GLN  48 133.845   6.842   1.113
  372   1HE2  GLN  48          HE22      GLN  48 135.720   9.577  -0.067
  373   2HE2  GLN  48          HE21      GLN  48 134.894   8.846   1.224
  374    H    PHE  49           HN       PHE  49 134.878   3.224   1.604
  375    HA   PHE  49           HA       PHE  49 134.215   4.458   4.086
  376   1HB   PHE  49           HB2      PHE  49 133.375   2.235   3.360
  377   2HB   PHE  49           HB1      PHE  49 135.000   1.575   3.536
  378    HD1  PHE  49           HD1      PHE  49 132.584   3.646   5.540
  379    HD2  PHE  49           HD2      PHE  49 135.435   0.429   5.530
  380    HE1  PHE  49           HE1      PHE  49 132.126   3.232   7.939
  381    HE2  PHE  49           HE2      PHE  49 134.977   0.018   7.931
  382    HZ   PHE  49           HZ       PHE  49 133.322   1.419   9.137
  383    H    LEU  50           HN       LEU  50 137.144   2.852   2.949
  384    HA   LEU  50           HA       LEU  50 138.558   3.027   5.471
  385   1HB   LEU  50           HB2      LEU  50 139.548   2.780   2.612
  386   2HB   LEU  50           HB1      LEU  50 140.615   2.713   4.012
  387    HG   LEU  50           HG       LEU  50 138.239   0.864   3.623
  388   1HD1  LEU  50          HD13      LEU  50 141.165   0.497   2.921
  389   2HD1  LEU  50          HD12      LEU  50 140.031  -0.846   3.069
  390   3HD1  LEU  50          HD11      LEU  50 139.780   0.387   1.836
  391   1HD2  LEU  50          HD21      LEU  50 140.478   1.076   5.638
  392   2HD2  LEU  50          HD23      LEU  50 138.761   0.779   5.909
  393   3HD2  LEU  50          HD22      LEU  50 139.785  -0.504   5.277
  394    H    VAL  51           HN       VAL  51 138.309   5.123   2.641
  395    HA   VAL  51           HA       VAL  51 140.258   7.051   3.474
  396    HB   VAL  51           HB       VAL  51 137.929   7.142   1.551
  397   1HG1  VAL  51          HG12      VAL  51 139.893   9.323   2.286
  398   2HG1  VAL  51          HG11      VAL  51 139.076   9.285   0.723
  399   3HG1  VAL  51          HG13      VAL  51 138.133   9.423   2.208
  400   1HG2  VAL  51          HG23      VAL  51 139.990   5.766   1.065
  401   2HG2  VAL  51          HG22      VAL  51 139.667   7.030  -0.123
  402   3HG2  VAL  51          HG21      VAL  51 140.923   7.263   1.094
  403    H    LEU  52           HN       LEU  52 136.968   6.553   4.497
  404    HA   LEU  52           HA       LEU  52 136.731   9.322   5.539
  405   1HB   LEU  52           HB2      LEU  52 134.840   6.961   5.625
  406   2HB   LEU  52           HB1      LEU  52 134.472   8.552   6.291
  407    HG   LEU  52           HG       LEU  52 135.243   8.049   3.401
  408   1HD1  LEU  52          HD11      LEU  52 133.054   7.023   4.109
  409   2HD1  LEU  52          HD13      LEU  52 132.511   8.643   4.548
  410   3HD1  LEU  52          HD12      LEU  52 132.897   8.269   2.869
  411   1HD2  LEU  52          HD23      LEU  52 134.558  10.490   5.021
  412   2HD2  LEU  52          HD22      LEU  52 135.708  10.307   3.699
  413   3HD2  LEU  52          HD21      LEU  52 133.988  10.426   3.353
  414    H    LYS  53           HN       LYS  53 138.565   6.999   6.668
  415    HA   LYS  53           HA       LYS  53 139.227   6.291   8.814
  416   1HB   LYS  53           HB2      LYS  53 138.085   9.040   9.377
  417   2HB   LYS  53           HB1      LYS  53 138.991   8.101  10.563
  418   1HG   LYS  53           HG2      LYS  53 140.926   8.034   9.032
  419   2HG   LYS  53           HG1      LYS  53 140.020   8.979   7.849
  420   1HD   LYS  53           HD2      LYS  53 139.812  10.824   9.479
  421   2HD   LYS  53           HD1      LYS  53 140.724   9.879  10.658
  422   1HE   LYS  53           HE2      LYS  53 141.811  10.599   7.928
  423   2HE   LYS  53           HE1      LYS  53 142.093  11.580   9.366
  424   1HZ   LYS  53           HZ2      LYS  53 142.692   9.080  10.201
  425   2HZ   LYS  53           HZ1      LYS  53 143.260   9.071   8.603
  426   3HZ   LYS  53           HZ3      LYS  53 143.825  10.240   9.692
  427    H    LYS  54           HN       LYS  54 136.633   5.321   8.051
  428    HA   LYS  54           HA       LYS  54 134.769   4.254   9.007
  429   1HB   LYS  54           HB2      LYS  54 136.053   4.835  11.692
  430   2HB   LYS  54           HB1      LYS  54 134.962   3.522  11.279
  431   1HG   LYS  54           HG2      LYS  54 137.698   3.823  10.017
  432   2HG   LYS  54           HG1      LYS  54 137.415   2.886  11.479
  433   1HD   LYS  54           HD2      LYS  54 135.726   1.529  10.234
  434   2HD   LYS  54           HD1      LYS  54 136.156   2.406   8.764
  435   1HE   LYS  54           HE2      LYS  54 138.420   1.596   8.847
  436   2HE   LYS  54           HE1      LYS  54 138.174   0.910  10.452
  437   1HZ   LYS  54           HZ1      LYS  54 136.408  -0.503   9.408
  438   2HZ   LYS  54           HZ3      LYS  54 136.970   0.022   7.896
  439   3HZ   LYS  54           HZ2      LYS  54 137.999  -0.856   8.925
  440    H    ASP  55           HN       ASP  55 135.037   7.387   8.903
  441    HA   ASP  55           HA       ASP  55 133.426   8.299  11.128
  442   1HB   ASP  55           HB2      ASP  55 134.067   9.487   8.425
  443   2HB   ASP  55           HB1      ASP  55 133.024  10.308   9.590
  444    H    GLU  56           HN       GLU  56 131.453   7.390  11.409
  445    HA   GLU  56           HA       GLU  56 129.830   6.268   9.358
  446   1HB   GLU  56           HB2      GLU  56 129.647   5.643  11.723
  447   2HB   GLU  56           HB1      GLU  56 129.050   7.255  12.112
  448   1HG   GLU  56           HG2      GLU  56 127.071   6.906  10.731
  449   2HG   GLU  56           HG1      GLU  56 127.688   5.344  10.191
  450    H    ASP  57           HN       ASP  57 129.698   9.512  10.853
  451    HA   ASP  57           HA       ASP  57 127.233  10.258   9.552
  452   1HB   ASP  57           HB2      ASP  57 129.495  11.911  10.703
  453   2HB   ASP  57           HB1      ASP  57 128.006  12.613  10.069
  454    H    LEU  58           HN       LEU  58 130.633  10.633   8.699
  455    HA   LEU  58           HA       LEU  58 130.066  12.166   6.297
  456   1HB   LEU  58           HB2      LEU  58 132.502  10.507   7.027
  457   2HB   LEU  58           HB1      LEU  58 132.415  11.611   5.657
  458    HG   LEU  58           HG       LEU  58 132.017  12.416   8.558
  459   1HD1  LEU  58          HD12      LEU  58 134.397  12.586   6.698
  460   2HD1  LEU  58          HD11      LEU  58 134.242  13.608   8.127
  461   3HD1  LEU  58          HD13      LEU  58 134.322  11.857   8.299
  462   1HD2  LEU  58          HD21      LEU  58 131.913  13.885   5.927
  463   2HD2  LEU  58          HD23      LEU  58 130.874  14.055   7.341
  464   3HD2  LEU  58          HD22      LEU  58 132.496  14.736   7.357
  465    H    PHE  59           HN       PHE  59 130.523   8.734   7.002
  466    HA   PHE  59           HA       PHE  59 130.382   7.834   4.271
  467   1HB   PHE  59           HB2      PHE  59 131.260   6.381   6.020
  468   2HB   PHE  59           HB1      PHE  59 129.719   6.429   6.874
  469    HD1  PHE  59           HD1      PHE  59 131.392   5.300   3.747
  470    HD2  PHE  59           HD2      PHE  59 127.902   5.020   6.238
  471    HE1  PHE  59           HE1      PHE  59 130.596   3.363   2.416
  472    HE2  PHE  59           HE2      PHE  59 127.104   3.087   4.904
  473    HZ   PHE  59           HZ       PHE  59 128.451   2.258   2.994
  474    H    ARG  60           HN       ARG  60 127.890   8.039   6.838
  475    HA   ARG  60           HA       ARG  60 125.755   7.106   5.222
  476   1HB   ARG  60           HB2      ARG  60 125.761   8.954   7.613
  477   2HB   ARG  60           HB1      ARG  60 124.282   8.357   6.859
  478   1HG   ARG  60           HG2      ARG  60 125.083   6.025   7.223
  479   2HG   ARG  60           HG1      ARG  60 126.485   6.655   8.066
  480   1HD   ARG  60           HD2      ARG  60 123.593   7.065   8.862
  481   2HD   ARG  60           HD1      ARG  60 124.756   6.022   9.679
  482    HE   ARG  60           HE       ARG  60 125.979   8.492   9.739
  483   1HH1  ARG  60          HH21      ARG  60 122.887   7.220  10.584
  484   2HH1  ARG  60          HH22      ARG  60 122.615   8.363  11.857
  485   1HH2  ARG  60          HH11      ARG  60 125.644   9.993  11.393
  486   2HH2  ARG  60          HH12      ARG  60 124.180   9.935  12.316
  487    H    GLU  61           HN       GLU  61 126.785  10.517   5.820
  488    HA   GLU  61           HA       GLU  61 124.740  11.604   4.120
  489   1HB   GLU  61           HB2      GLU  61 127.396  12.650   5.109
  490   2HB   GLU  61           HB1      GLU  61 126.432  13.579   3.963
  491   1HG   GLU  61           HG2      GLU  61 125.834  14.351   6.158
  492   2HG   GLU  61           HG1      GLU  61 124.486  13.371   5.585
  493    H    TRP  62           HN       TRP  62 128.003  10.370   3.490
  494    HA   TRP  62           HA       TRP  62 128.190  11.312   0.799
  495   1HB   TRP  62           HB2      TRP  62 130.190  10.510   1.847
  496   2HB   TRP  62           HB1      TRP  62 129.452   8.950   2.208
  497    HD1  TRP  62           HD1      TRP  62 130.855  10.997  -0.717
  498    HE1  TRP  62           HE1      TRP  62 131.300   9.405  -2.698
  499    HE3  TRP  62           HE3      TRP  62 128.807   6.700   1.129
  500    HZ2  TRP  62           HZ2      TRP  62 130.832   6.659  -3.409
  501    HZ3  TRP  62           HZ3      TRP  62 128.824   4.618  -0.212
  502    HH2  TRP  62           HH2      TRP  62 129.833   4.593  -2.475
  503    H    LEU  63           HN       LEU  63 127.021   8.174   2.072
  504    HA   LEU  63           HA       LEU  63 126.411   7.135  -0.539
  505   1HB   LEU  63           HB2      LEU  63 126.737   5.659   1.396
  506   2HB   LEU  63           HB1      LEU  63 125.322   6.354   2.180
  507    HG   LEU  63           HG       LEU  63 123.894   5.526   0.344
  508   1HD1  LEU  63          HD13      LEU  63 126.557   4.671  -0.772
  509   2HD1  LEU  63          HD12      LEU  63 125.107   3.751  -1.173
  510   3HD1  LEU  63          HD11      LEU  63 125.210   5.457  -1.594
  511   1HD2  LEU  63          HD23      LEU  63 124.441   4.118   2.367
  512   2HD2  LEU  63          HD22      LEU  63 123.976   3.189   0.942
  513   3HD2  LEU  63          HD21      LEU  63 125.676   3.316   1.396
  514    H    LYS  64           HN       LYS  64 124.336   8.511   1.994
  515    HA   LYS  64           HA       LYS  64 121.902   8.375   0.508
  516   1HB   LYS  64           HB2      LYS  64 121.943   8.821   2.931
  517   2HB   LYS  64           HB1      LYS  64 122.696  10.388   2.632
  518   1HG   LYS  64           HG2      LYS  64 120.740  11.141   1.386
  519   2HG   LYS  64           HG1      LYS  64 120.001   9.545   1.527
  520   1HD   LYS  64           HD2      LYS  64 119.925   9.784   3.972
  521   2HD   LYS  64           HD1      LYS  64 120.691  11.368   3.849
  522   1HE   LYS  64           HE2      LYS  64 118.192  11.484   4.072
  523   2HE   LYS  64           HE1      LYS  64 118.802  12.245   2.603
  524   1HZ   LYS  64           HZ3      LYS  64 118.274   9.455   2.254
  525   2HZ   LYS  64           HZ2      LYS  64 116.886  10.314   2.728
  526   3HZ   LYS  64           HZ1      LYS  64 117.742  10.778   1.336
  527    H    ASP  65           HN       ASP  65 124.267  11.004   0.826
  528    HA   ASP  65           HA       ASP  65 122.883  12.788  -0.967
  529   1HB   ASP  65           HB2      ASP  65 124.649  13.432   0.746
  530   2HB   ASP  65           HB1      ASP  65 125.849  12.776  -0.368
  531    H    THR  66           HN       THR  66 125.201  10.193  -1.409
  532    HA   THR  66           HA       THR  66 125.836  10.947  -4.149
  533    HB   THR  66           HB       THR  66 126.401   8.441  -2.547
  534    HG1  THR  66           HG1      THR  66 127.988   9.615  -1.883
  535   1HG2  THR  66          HG21      THR  66 127.137   9.236  -5.361
  536   2HG2  THR  66          HG23      THR  66 128.112   8.096  -4.436
  537   3HG2  THR  66          HG22      THR  66 126.429   7.720  -4.805
  538    H    CYS  67           HN       CYS  67 123.503   8.693  -2.644
  539    HA   CYS  67           HA       CYS  67 122.446   8.173  -5.411
  540   1HB   CYS  67           HB2      CYS  67 122.028   5.851  -4.792
  541   2HB   CYS  67           HB1      CYS  67 123.742   6.227  -4.606
  542    HG   CYS  67           HG       CYS  67 122.965   6.693  -1.958
  543    H    GLY  68           HN       GLY  68 121.716   8.490  -1.964
  544   1HA   GLY  68           HA2      GLY  68 119.614   9.609  -1.333
  545   2HA   GLY  68           HA1      GLY  68 118.825   8.816  -2.696
  546    H    ALA  69           HN       ALA  69 121.070   6.840  -0.990
  547    HA   ALA  69           HA       ALA  69 119.240   4.819  -0.338
  548   1HB   ALA  69           HB3      ALA  69 121.761   4.647  -0.247
  549   2HB   ALA  69           HB2      ALA  69 121.703   5.509   1.291
  550   3HB   ALA  69           HB1      ALA  69 120.937   3.928   1.137
  551    H    ASN  70           HN       ASN  70 118.174   4.254   1.680
  552    HA   ASN  70           HA       ASN  70 117.289   6.631   3.184
  553   1HB   ASN  70           HB2      ASN  70 116.435   3.722   3.344
  554   2HB   ASN  70           HB1      ASN  70 115.626   5.080   4.129
  555   1HD2  ASN  70          HD22      ASN  70 114.459   4.195   0.474
  556   2HD2  ASN  70          HD21      ASN  70 115.146   3.119   1.593
  557    H    ALA  71           HN       ALA  71 116.995   6.257   5.620
  558    HA   ALA  71           HA       ALA  71 119.528   5.958   6.867
  559   1HB   ALA  71           HB2      ALA  71 117.498   7.184   7.779
  560   2HB   ALA  71           HB1      ALA  71 116.852   5.608   8.237
  561   3HB   ALA  71           HB3      ALA  71 118.358   6.185   8.950
  562    H    LYS  72           HN       LYS  72 116.917   3.602   6.358
  563    HA   LYS  72           HA       LYS  72 118.045   1.618   8.130
  564   1HB   LYS  72           HB2      LYS  72 116.172   1.309   5.761
  565   2HB   LYS  72           HB1      LYS  72 116.505   0.056   6.958
  566   1HG   LYS  72           HG2      LYS  72 115.629   1.527   8.739
  567   2HG   LYS  72           HG1      LYS  72 115.293   2.777   7.541
  568   1HD   LYS  72           HD2      LYS  72 113.752   1.243   6.370
  569   2HD   LYS  72           HD1      LYS  72 114.084  -0.005   7.571
  570   1HE   LYS  72           HE2      LYS  72 113.135   1.359   9.337
  571   2HE   LYS  72           HE1      LYS  72 112.951   2.726   8.238
  572   1HZ   LYS  72           HZ3      LYS  72 111.607   0.940   6.880
  573   2HZ   LYS  72           HZ2      LYS  72 111.386   0.263   8.423
  574   3HZ   LYS  72           HZ1      LYS  72 110.876   1.853   8.108
  575    H    GLN  73           HN       GLN  73 118.310   2.226   4.650
  576    HA   GLN  73           HA       GLN  73 119.843  -0.117   4.055
  577   1HB   GLN  73           HB2      GLN  73 119.552   2.541   2.639
  578   2HB   GLN  73           HB1      GLN  73 120.467   1.187   1.973
  579   1HG   GLN  73           HG2      GLN  73 118.461  -0.235   2.077
  580   2HG   GLN  73           HG1      GLN  73 117.541   1.102   2.764
  581   1HE2  GLN  73          HE22      GLN  73 117.344   0.876  -1.090
  582   2HE2  GLN  73          HE21      GLN  73 117.347  -0.378   0.054
  583    H    SER  74           HN       SER  74 120.792   3.184   4.966
  584    HA   SER  74           HA       SER  74 123.581   2.775   4.475
  585   1HB   SER  74           HB2      SER  74 122.336   4.686   6.460
  586   2HB   SER  74           HB1      SER  74 123.911   4.818   5.690
  587    HG   SER  74           HG       SER  74 122.930   5.182   3.747
  588    H    ARG  75           HN       ARG  75 121.544   2.258   7.373
  589    HA   ARG  75           HA       ARG  75 123.683   1.802   9.191
  590   1HB   ARG  75           HB2      ARG  75 120.855   0.720   9.107
  591   2HB   ARG  75           HB1      ARG  75 121.965   0.384  10.436
  592   1HG   ARG  75           HG2      ARG  75 122.208   2.779  10.880
  593   2HG   ARG  75           HG1      ARG  75 121.171   3.159   9.507
  594   1HD   ARG  75           HD2      ARG  75 119.275   2.067  10.564
  595   2HD   ARG  75           HD1      ARG  75 120.296   1.499  11.887
  596    HE   ARG  75           HE       ARG  75 120.615   4.230  11.999
  597   1HH1  ARG  75          HH21      ARG  75 117.912   2.097  11.799
  598   2HH1  ARG  75          HH22      ARG  75 116.877   3.104  12.755
  599   1HH2  ARG  75          HH11      ARG  75 119.275   5.555  13.257
  600   2HH2  ARG  75          HH12      ARG  75 117.649   5.057  13.585
  601    H    ASP  76           HN       ASP  76 122.070  -0.427   6.911
  602    HA   ASP  76           HA       ASP  76 123.425  -2.759   7.881
  603   1HB   ASP  76           HB2      ASP  76 122.136  -2.123   5.221
  604   2HB   ASP  76           HB1      ASP  76 122.793  -3.711   5.619
  605    H    CYS  77           HN       CYS  77 124.312  -0.417   5.307
  606    HA   CYS  77           HA       CYS  77 126.564  -1.971   4.405
  607   1HB   CYS  77           HB2      CYS  77 125.866   0.960   4.146
  608   2HB   CYS  77           HB1      CYS  77 127.304   0.246   3.415
  609    HG   CYS  77           HG       CYS  77 124.393  -0.629   2.664
  610    H    PHE  78           HN       PHE  78 126.243   0.661   6.834
  611    HA   PHE  78           HA       PHE  78 129.035   1.016   7.231
  612   1HB   PHE  78           HB2      PHE  78 127.387   2.550   8.204
  613   2HB   PHE  78           HB1      PHE  78 126.803   1.268   9.268
  614    HD1  PHE  78           HD2      PHE  78 128.155   0.454  11.131
  615    HD2  PHE  78           HD1      PHE  78 129.575   3.593   8.565
  616    HE1  PHE  78           HE2      PHE  78 129.945   0.979  12.765
  617    HE2  PHE  78           HE1      PHE  78 131.367   4.117  10.199
  618    HZ   PHE  78           HZ       PHE  78 131.551   2.810  12.299
  619    H    GLY  79           HN       GLY  79 126.826  -0.920   9.277
  620   1HA   GLY  79           HA2      GLY  79 128.873  -2.161  10.789
  621   2HA   GLY  79           HA1      GLY  79 127.255  -2.824  10.567
  622    H    CYS  80           HN       CYS  80 127.562  -2.946   7.630
  623    HA   CYS  80           HA       CYS  80 128.707  -5.601   7.486
  624   1HB   CYS  80           HB2      CYS  80 126.866  -4.835   6.009
  625   2HB   CYS  80           HB1      CYS  80 127.983  -3.716   5.227
  626    HG   CYS  80           HG       CYS  80 127.826  -6.702   4.688
  627    H    LEU  81           HN       LEU  81 129.807  -2.417   6.191
  628    HA   LEU  81           HA       LEU  81 132.282  -3.530   5.197
  629   1HB   LEU  81           HB2      LEU  81 131.560  -0.667   5.898
  630   2HB   LEU  81           HB1      LEU  81 132.986  -1.160   4.989
  631    HG   LEU  81           HG       LEU  81 130.107  -1.633   4.148
  632   1HD1  LEU  81          HD11      LEU  81 131.014   0.746   4.054
  633   2HD1  LEU  81          HD13      LEU  81 132.188   0.161   2.876
  634   3HD1  LEU  81          HD12      LEU  81 130.463   0.085   2.514
  635   1HD2  LEU  81          HD21      LEU  81 132.768  -2.505   3.037
  636   2HD2  LEU  81          HD23      LEU  81 131.249  -3.396   3.123
  637   3HD2  LEU  81          HD22      LEU  81 131.461  -2.134   1.912
  638    H    ARG  82           HN       ARG  82 131.346  -1.898   8.218
  639    HA   ARG  82           HA       ARG  82 133.987  -1.682   9.281
  640   1HB   ARG  82           HB2      ARG  82 132.050  -0.487  10.250
  641   2HB   ARG  82           HB1      ARG  82 131.391  -2.027  10.808
  642   1HG   ARG  82           HG2      ARG  82 133.319  -2.402  12.235
  643   2HG   ARG  82           HG1      ARG  82 134.127  -0.976  11.585
  644   1HD   ARG  82           HD2      ARG  82 132.337   0.458  12.499
  645   2HD   ARG  82           HD1      ARG  82 131.530  -0.969  13.152
  646    HE   ARG  82           HE       ARG  82 134.078  -1.105  14.228
  647   1HH1  ARG  82          HH21      ARG  82 131.555   1.235  14.045
  648   2HH1  ARG  82          HH22      ARG  82 131.966   1.992  15.547
  649   1HH2  ARG  82          HH11      ARG  82 134.635  -0.125  16.190
  650   2HH2  ARG  82          HH12      ARG  82 133.712   1.225  16.760
  651    H    GLU  83           HN       GLU  83 131.606  -4.315   9.472
  652    HA   GLU  83           HA       GLU  83 133.192  -5.908  11.270
  653   1HB   GLU  83           HB2      GLU  83 130.897  -6.592   9.423
  654   2HB   GLU  83           HB1      GLU  83 131.674  -7.786  10.466
  655   1HG   GLU  83           HG2      GLU  83 131.116  -6.508  12.448
  656   2HG   GLU  83           HG1      GLU  83 130.499  -5.177  11.472
  657    H    TRP  84           HN       TRP  84 132.987  -5.813   7.690
  658    HA   TRP  84           HA       TRP  84 134.614  -8.131   7.255
  659   1HB   TRP  84           HB2      TRP  84 133.258  -6.998   5.480
  660   2HB   TRP  84           HB1      TRP  84 134.402  -5.656   5.511
  661    HD1  TRP  84           HD1      TRP  84 134.037  -9.279   4.421
  662    HE1  TRP  84           HE1      TRP  84 136.032  -9.917   2.919
  663    HE3  TRP  84           HE3      TRP  84 136.955  -5.120   5.003
  664    HZ2  TRP  84           HZ2      TRP  84 138.532  -8.816   2.077
  665    HZ3  TRP  84           HZ3      TRP  84 139.141  -4.950   3.844
  666    HH2  TRP  84           HH2      TRP  84 139.930  -6.789   2.382
  667    H    CYS  85           HN       CYS  85 135.431  -4.659   7.513
  668    HA   CYS  85           HA       CYS  85 138.224  -4.954   7.064
  669   1HB   CYS  85           HB2      CYS  85 136.633  -2.903   8.615
  670   2HB   CYS  85           HB1      CYS  85 138.379  -2.780   8.399
  671    HG   CYS  85           HG       CYS  85 136.300  -2.172   6.269
  672    H    ASP  86           HN       ASP  86 136.341  -5.147  10.077
  673    HA   ASP  86           HA       ASP  86 138.551  -5.318  11.857
  674   1HB   ASP  86           HB2      ASP  86 135.779  -6.533  12.012
  675   2HB   ASP  86           HB1      ASP  86 136.941  -6.597  13.337
  676    H    ALA  87           HN       ALA  87 137.155  -7.643   9.653
  677    HA   ALA  87           HA       ALA  87 138.712  -9.865  10.852
  678   1HB   ALA  87           HB3      ALA  87 136.316 -10.093   9.986
  679   2HB   ALA  87           HB2      ALA  87 137.003  -9.982   8.365
  680   3HB   ALA  87           HB1      ALA  87 137.470 -11.306   9.433
  681    H    PHE  88           HN       PHE  88 138.665  -7.892   7.896
  682    HA   PHE  88           HA       PHE  88 141.088  -9.371   6.923
  683   1HB   PHE  88           HB2      PHE  88 139.066  -7.686   5.445
  684   2HB   PHE  88           HB1      PHE  88 140.497  -8.404   4.709
  685    HD1  PHE  88           HD2      PHE  88 140.773 -10.913   4.740
  686    HD2  PHE  88           HD1      PHE  88 137.104  -8.982   5.861
  687    HE1  PHE  88           HE2      PHE  88 139.554 -13.052   4.436
  688    HE2  PHE  88           HE1      PHE  88 135.883 -11.120   5.555
  689    HZ   PHE  88           HZ       PHE  88 137.109 -13.150   4.837
  690    H    LEU  89           HN       LEU  89 140.323  -6.345   8.349
  691    HA   LEU  89           HA       LEU  89 142.475  -4.945   6.846
  692   1HB   LEU  89           HB2      LEU  89 140.262  -3.817   7.453
  693   2HB   LEU  89           HB1      LEU  89 140.826  -3.834   9.121
  694    HG   LEU  89           HG       LEU  89 142.952  -2.677   8.268
  695   1HD1  LEU  89          HD11      LEU  89 141.211  -2.542   5.801
  696   2HD1  LEU  89          HD13      LEU  89 142.354  -1.247   6.147
  697   3HD1  LEU  89          HD12      LEU  89 142.933  -2.892   5.924
  698   1HD2  LEU  89          HD23      LEU  89 140.254  -1.296   8.148
  699   2HD2  LEU  89          HD22      LEU  89 141.294  -1.470   9.561
  700   3HD2  LEU  89          HD21      LEU  89 141.795  -0.441   8.220
  701   1H    MET   1           HT2      MET   1 171.143  -5.194  -1.958
  702   2H    MET   1           HT1      MET   1 171.309  -5.522  -0.299
  703   3H    MET   1           HT3      MET   1 172.577  -5.887  -1.364
  704    HA   MET   1           HA       MET   1 171.599  -7.760  -2.157
  705   1HB   MET   1           HB2      MET   1 170.412  -7.337   0.602
  706   2HB   MET   1           HB1      MET   1 170.380  -8.881  -0.253
  707   1HG   MET   1           HG2      MET   1 172.841  -8.865  -0.388
  708   2HG   MET   1           HG1      MET   1 172.879  -7.321   0.466
  709   1HE   MET   1           HE1      MET   1 174.497  -9.780   1.291
  710   2HE   MET   1           HE3      MET   1 174.509  -8.314   2.280
  711   3HE   MET   1           HE2      MET   1 174.266  -9.889   3.033
  712    H    THR   2           HN       THR   2 168.771  -8.156  -0.580
  713    HA   THR   2           HA       THR   2 167.192  -7.466  -2.994
  714    HB   THR   2           HB       THR   2 165.424  -8.810  -1.942
  715    HG1  THR   2           HG1      THR   2 165.896  -8.233   0.213
  716   1HG2  THR   2          HG21      THR   2 167.219  -9.946  -3.223
  717   2HG2  THR   2          HG23      THR   2 168.138 -10.143  -1.730
  718   3HG2  THR   2          HG22      THR   2 166.591 -10.966  -1.928
  719    H    THR   3           HN       THR   3 164.685  -7.164  -1.597
  720    HA   THR   3           HA       THR   3 164.783  -4.328  -1.074
  721    HB   THR   3           HB       THR   3 162.403  -4.613  -0.400
  722    HG1  THR   3           HG1      THR   3 163.280  -7.171  -0.121
  723   1HG2  THR   3          HG22      THR   3 163.252  -6.120  -2.890
  724   2HG2  THR   3          HG21      THR   3 161.611  -5.558  -2.568
  725   3HG2  THR   3          HG23      THR   3 162.919  -4.392  -2.774
  726    H    SER   4           HN       SER   4 164.152  -3.330   1.018
  727    HA   SER   4           HA       SER   4 165.747  -4.248   3.181
  728   1HB   SER   4           HB2      SER   4 165.062  -1.938   3.130
  729   2HB   SER   4           HB1      SER   4 163.359  -2.384   3.116
  730    HG   SER   4           HG       SER   4 164.476  -3.566   5.196
  731    H    GLN   5           HN       GLN   5 164.991  -5.057   5.268
  732    HA   GLN   5           HA       GLN   5 163.368  -7.393   5.006
  733   1HB   GLN   5           HB2      GLN   5 164.379  -5.887   7.431
  734   2HB   GLN   5           HB1      GLN   5 163.528  -7.429   7.533
  735   1HG   GLN   5           HG2      GLN   5 165.229  -8.521   6.185
  736   2HG   GLN   5           HG1      GLN   5 166.037  -6.981   5.894
  737   1HE2  GLN   5          HE22      GLN   5 167.738  -8.740   8.752
  738   2HE2  GLN   5          HE21      GLN   5 167.408  -9.166   7.142
  739    H    LYS   6           HN       LYS   6 162.540  -4.089   5.715
  740    HA   LYS   6           HA       LYS   6 160.131  -4.527   7.174
  741   1HB   LYS   6           HB2      LYS   6 161.026  -2.280   5.360
  742   2HB   LYS   6           HB1      LYS   6 159.531  -2.229   6.298
  743   1HG   LYS   6           HG2      LYS   6 160.821  -2.565   8.379
  744   2HG   LYS   6           HG1      LYS   6 162.315  -2.609   7.442
  745   1HD   LYS   6           HD2      LYS   6 161.893  -0.308   6.653
  746   2HD   LYS   6           HD1      LYS   6 160.401  -0.262   7.593
  747   1HE   LYS   6           HE2      LYS   6 161.579  -0.386   9.662
  748   2HE   LYS   6           HE1      LYS   6 163.081  -0.847   8.862
  749   1HZ   LYS   6           HZ3      LYS   6 162.750   1.416   7.661
  750   2HZ   LYS   6           HZ2      LYS   6 161.787   1.784   9.011
  751   3HZ   LYS   6           HZ1      LYS   6 163.422   1.372   9.218
  752    H    HIS   7           HN       HIS   7 160.814  -4.408   3.685
  753    HA   HIS   7           HA       HIS   7 158.126  -4.352   2.779
  754   1HB   HIS   7           HB2      HIS   7 159.913  -4.003   1.197
  755   2HB   HIS   7           HB1      HIS   7 160.616  -5.578   1.558
  756    HD2  HIS   7           HD2      HIS   7 159.529  -7.704   0.104
  757    HE1  HIS   7           HE1      HIS   7 156.438  -5.541  -1.793
  758    HE2  HIS   7           HE2      HIS   7 157.646  -7.769  -1.699
  759    H    ARG   8           HN       ARG   8 160.216  -7.193   3.389
  760    HA   ARG   8           HA       ARG   8 158.158  -9.101   2.793
  761   1HB   ARG   8           HB2      ARG   8 160.765  -9.281   4.333
  762   2HB   ARG   8           HB1      ARG   8 159.741 -10.680   4.001
  763   1HG   ARG   8           HG2      ARG   8 159.910 -10.240   1.588
  764   2HG   ARG   8           HG1      ARG   8 160.929  -8.839   1.903
  765   1HD   ARG   8           HD2      ARG   8 162.454 -10.499   3.186
  766   2HD   ARG   8           HD1      ARG   8 161.570 -11.763   2.337
  767    HE   ARG   8           HE       ARG   8 163.690 -10.181   1.261
  768   1HH1  ARG   8          HH21      ARG   8 160.540 -11.308   0.403
  769   2HH1  ARG   8          HH22      ARG   8 160.751 -10.984  -1.283
  770   1HH2  ARG   8          HH11      ARG   8 163.975  -9.777  -0.925
  771   2HH2  ARG   8          HH12      ARG   8 162.693 -10.131  -2.035
  772    H    ASP   9           HN       ASP   9 159.160  -7.414   5.701
  773    HA   ASP   9           HA       ASP   9 157.675  -9.070   7.550
  774   1HB   ASP   9           HB2      ASP   9 158.738  -6.248   7.758
  775   2HB   ASP   9           HB1      ASP   9 157.983  -7.106   9.097
  776    H    PHE  10           HN       PHE  10 156.966  -6.052   5.808
  777    HA   PHE  10           HA       PHE  10 154.463  -5.517   7.109
  778   1HB   PHE  10           HB2      PHE  10 155.800  -3.906   5.688
  779   2HB   PHE  10           HB1      PHE  10 155.229  -4.784   4.271
  780    HD1  PHE  10           HD2      PHE  10 152.874  -4.696   3.592
  781    HD2  PHE  10           HD1      PHE  10 154.279  -2.548   7.037
  782    HE1  PHE  10           HE2      PHE  10 150.778  -3.369   3.620
  783    HE2  PHE  10           HE1      PHE  10 152.184  -1.220   7.063
  784    HZ   PHE  10           HZ       PHE  10 150.435  -1.627   5.350
  785    H    VAL  11           HN       VAL  11 155.246  -7.309   4.119
  786    HA   VAL  11           HA       VAL  11 152.414  -7.935   3.652
  787    HB   VAL  11           HB       VAL  11 153.254  -9.236   1.748
  788   1HG1  VAL  11          HG13      VAL  11 154.487  -6.511   2.203
  789   2HG1  VAL  11          HG12      VAL  11 154.647  -7.362   0.669
  790   3HG1  VAL  11          HG11      VAL  11 153.050  -6.913   1.264
  791   1HG2  VAL  11          HG23      VAL  11 155.902  -8.746   3.117
  792   2HG2  VAL  11          HG22      VAL  11 155.207 -10.284   2.604
  793   3HG2  VAL  11          HG21      VAL  11 155.811  -9.144   1.401
  794    H    ALA  12           HN       ALA  12 154.133  -8.892   6.088
  795    HA   ALA  12           HA       ALA  12 153.475 -11.815   5.859
  796   1HB   ALA  12           HB3      ALA  12 155.568 -10.383   7.514
  797   2HB   ALA  12           HB2      ALA  12 155.177 -12.095   7.680
  798   3HB   ALA  12           HB1      ALA  12 155.852 -11.487   6.169
  799    H    GLU  13           HN       GLU  13 152.536  -8.910   7.362
  800    HA   GLU  13           HA       GLU  13 150.786 -10.414   9.171
  801   1HB   GLU  13           HB2      GLU  13 151.546  -8.884  11.131
  802   2HB   GLU  13           HB1      GLU  13 152.555 -10.270  10.719
  803   1HG   GLU  13           HG2      GLU  13 154.045  -8.853   9.413
  804   2HG   GLU  13           HG1      GLU  13 152.999  -7.458   9.682
  805    HA   PRO  14           HA       PRO  14 147.849  -7.186   8.299
  806   1HB   PRO  14           HB2      PRO  14 147.625  -6.815  11.275
  807   2HB   PRO  14           HB1      PRO  14 146.340  -6.999  10.063
  808   1HG   PRO  14           HG2      PRO  14 147.064  -9.019  11.659
  809   2HG   PRO  14           HG1      PRO  14 146.563  -9.289   9.980
  810   1HD   PRO  14           HD2      PRO  14 149.287  -9.475  11.172
  811   2HD   PRO  14           HD1      PRO  14 148.624 -10.269   9.726
  812    H    MET  15           HN       MET  15 147.562  -4.806   8.536
  813    HA   MET  15           HA       MET  15 150.154  -3.482   9.135
  814   1HB   MET  15           HB2      MET  15 148.852  -1.488   8.062
  815   2HB   MET  15           HB1      MET  15 149.369  -2.821   7.032
  816   1HG   MET  15           HG2      MET  15 147.205  -3.743   6.913
  817   2HG   MET  15           HG1      MET  15 146.651  -2.859   8.336
  818   1HE   MET  15           HE2      MET  15 148.281  -2.558   4.986
  819   2HE   MET  15           HE1      MET  15 146.644  -2.771   4.374
  820   3HE   MET  15           HE3      MET  15 147.484  -1.232   4.144
  821    H    GLY  16           HN       GLY  16 146.943  -3.775  10.434
  822   1HA   GLY  16           HA2      GLY  16 145.923  -2.770  12.297
  823   2HA   GLY  16           HA1      GLY  16 147.563  -2.607  12.924
  824    H    GLU  17           HN       GLU  17 147.474  -0.521  13.729
  825    HA   GLU  17           HA       GLU  17 146.553   1.673  11.913
  826   1HB   GLU  17           HB2      GLU  17 147.004   1.557  14.908
  827   2HB   GLU  17           HB1      GLU  17 146.595   3.032  14.033
  828   1HG   GLU  17           HG2      GLU  17 144.517   1.985  13.222
  829   2HG   GLU  17           HG1      GLU  17 144.921   0.503  14.090
  830    H    LYS  18           HN       LYS  18 149.206   0.326  11.707
  831    HA   LYS  18           HA       LYS  18 151.258   1.879  12.887
  832   1HB   LYS  18           HB2      LYS  18 151.163   0.385  10.254
  833   2HB   LYS  18           HB1      LYS  18 152.635   1.138  10.870
  834   1HG   LYS  18           HG2      LYS  18 152.414  -0.199  12.958
  835   2HG   LYS  18           HG1      LYS  18 150.999  -0.997  12.270
  836   1HD   LYS  18           HD2      LYS  18 152.295  -1.995  10.523
  837   2HD   LYS  18           HD1      LYS  18 153.695  -0.989  10.897
  838   1HE   LYS  18           HE2      LYS  18 154.044  -2.114  12.994
  839   2HE   LYS  18           HE1      LYS  18 152.506  -2.965  12.858
  840   1HZ   LYS  18           HZ3      LYS  18 154.201  -3.368  10.587
  841   2HZ   LYS  18           HZ2      LYS  18 154.922  -3.898  12.031
  842   3HZ   LYS  18           HZ1      LYS  18 153.409  -4.509  11.561
  843    HA   PRO  19           HA       PRO  19 150.817   5.799  10.871
  844   1HB   PRO  19           HB2      PRO  19 153.456   6.643  10.758
  845   2HB   PRO  19           HB1      PRO  19 152.460   6.679  12.227
  846   1HG   PRO  19           HG2      PRO  19 154.495   4.667  11.374
  847   2HG   PRO  19           HG1      PRO  19 154.188   5.347  12.982
  848   1HD   PRO  19           HD2      PRO  19 153.307   2.876  12.281
  849   2HD   PRO  19           HD1      PRO  19 152.394   3.918  13.395
  850    H    VAL  20           HN       VAL  20 151.156   6.907   8.869
  851    HA   VAL  20           HA       VAL  20 151.267   5.319   6.564
  852    HB   VAL  20           HB       VAL  20 150.332   7.543   6.463
  853   1HG1  VAL  20          HG11      VAL  20 151.905   8.507   8.191
  854   2HG1  VAL  20          HG13      VAL  20 153.124   8.627   6.922
  855   3HG1  VAL  20          HG12      VAL  20 151.628   9.551   6.797
  856   1HG2  VAL  20          HG21      VAL  20 151.594   6.561   4.436
  857   2HG2  VAL  20          HG23      VAL  20 151.259   8.293   4.409
  858   3HG2  VAL  20          HG22      VAL  20 152.870   7.712   4.830
  859    H    GLY  21           HN       GLY  21 153.898   7.158   8.083
  860   1HA   GLY  21           HA2      GLY  21 155.885   6.664   6.120
  861   2HA   GLY  21           HA1      GLY  21 156.222   7.015   7.814
  862    H    SER  22           HN       SER  22 154.272   4.365   7.944
  863    HA   SER  22           HA       SER  22 156.557   2.590   8.423
  864   1HB   SER  22           HB2      SER  22 154.963   1.095   9.338
  865   2HB   SER  22           HB1      SER  22 154.350   2.690   9.758
  866    HG   SER  22           HG       SER  22 153.420   2.148   7.373
  867    H    LEU  23           HN       LEU  23 154.197   3.200   5.955
  868    HA   LEU  23           HA       LEU  23 154.313   0.728   4.543
  869   1HB   LEU  23           HB2      LEU  23 153.875   3.559   3.551
  870   2HB   LEU  23           HB1      LEU  23 153.645   2.127   2.551
  871    HG   LEU  23           HG       LEU  23 152.224   2.580   5.192
  872   1HD1  LEU  23          HD12      LEU  23 151.647   4.301   3.467
  873   2HD1  LEU  23          HD11      LEU  23 151.151   2.997   2.386
  874   3HD1  LEU  23          HD13      LEU  23 150.284   3.269   3.898
  875   1HD2  LEU  23          HD23      LEU  23 152.103   0.478   3.030
  876   2HD2  LEU  23          HD22      LEU  23 152.066   0.279   4.779
  877   3HD2  LEU  23          HD21      LEU  23 150.638   0.861   3.933
  878    H    ALA  24           HN       ALA  24 155.760  -0.076   3.082
  879    HA   ALA  24           HA       ALA  24 158.464   0.873   3.136
  880   1HB   ALA  24           HB1      ALA  24 157.048  -1.038   1.269
  881   2HB   ALA  24           HB3      ALA  24 158.784  -0.746   1.222
  882   3HB   ALA  24           HB2      ALA  24 158.047  -1.450   2.661
  883    H    GLY  25           HN       GLY  25 159.560   2.230   1.816
  884   1HA   GLY  25           HA2      GLY  25 159.993   3.364  -0.287
  885   2HA   GLY  25           HA1      GLY  25 158.290   3.196  -0.707
  886    H    ILE  26           HN       ILE  26 157.711   4.085   2.222
  887    HA   ILE  26           HA       ILE  26 157.834   7.014   1.616
  888    HB   ILE  26           HB       ILE  26 156.284   5.575   3.793
  889   1HG1  ILE  26          HG12      ILE  26 155.447   4.778   1.665
  890   2HG1  ILE  26          HG11      ILE  26 154.308   5.976   2.273
  891   1HG2  ILE  26          HG22      ILE  26 156.718   7.978   4.176
  892   2HG2  ILE  26          HG21      ILE  26 156.021   8.350   2.599
  893   3HG2  ILE  26          HG23      ILE  26 155.007   7.676   3.874
  894   1HD1  ILE  26          HD13      ILE  26 155.708   7.674   0.860
  895   2HD1  ILE  26          HD12      ILE  26 156.297   6.237   0.026
  896   3HD1  ILE  26          HD11      ILE  26 154.575   6.611   0.027
  897    H    GLY  27           HN       GLY  27 159.479   8.137   2.608
  898   1HA   GLY  27           HA2      GLY  27 160.838   6.915   4.935
  899   2HA   GLY  27           HA1      GLY  27 161.413   8.294   3.998
  900    H    GLU  28           HN       GLU  28 161.556   8.687   6.613
  901    HA   GLU  28           HA       GLU  28 159.256   9.543   8.012
  902   1HB   GLU  28           HB2      GLU  28 162.124  10.510   8.181
  903   2HB   GLU  28           HB1      GLU  28 160.868  10.998   9.316
  904   1HG   GLU  28           HG2      GLU  28 161.929   9.160  10.369
  905   2HG   GLU  28           HG1      GLU  28 160.457   8.477   9.680
  906    H    VAL  29           HN       VAL  29 161.342  11.400   5.788
  907    HA   VAL  29           HA       VAL  29 160.020  13.913   6.270
  908    HB   VAL  29           HB       VAL  29 161.632  12.908   3.906
  909   1HG1  VAL  29          HG11      VAL  29 160.422  15.612   4.502
  910   2HG1  VAL  29          HG13      VAL  29 161.842  15.444   3.470
  911   3HG1  VAL  29          HG12      VAL  29 160.323  14.672   3.013
  912   1HG2  VAL  29          HG21      VAL  29 162.851  13.104   6.049
  913   2HG2  VAL  29          HG23      VAL  29 163.396  14.322   4.897
  914   3HG2  VAL  29          HG22      VAL  29 162.304  14.773   6.205
  915    H    LEU  30           HN       LEU  30 159.569  11.411   3.787
  916    HA   LEU  30           HA       LEU  30 157.493  12.783   2.366
  917   1HB   LEU  30           HB2      LEU  30 158.035   9.807   2.606
  918   2HB   LEU  30           HB1      LEU  30 156.967  10.546   1.415
  919    HG   LEU  30           HG       LEU  30 159.921  11.189   1.694
  920   1HD1  LEU  30          HD11      LEU  30 159.475   8.839   0.962
  921   2HD1  LEU  30          HD13      LEU  30 158.528   9.472  -0.383
  922   3HD1  LEU  30          HD12      LEU  30 160.256   9.807  -0.284
  923   1HD2  LEU  30          HD22      LEU  30 157.725  12.069  -0.182
  924   2HD2  LEU  30          HD21      LEU  30 158.957  13.045   0.616
  925   3HD2  LEU  30          HD23      LEU  30 159.394  12.022  -0.749
  926    H    GLY  31           HN       GLY  31 157.452  10.581   5.123
  927   1HA   GLY  31           HA2      GLY  31 154.637  10.141   5.233
  928   2HA   GLY  31           HA1      GLY  31 155.718  10.057   6.623
  929    H    LYS  32           HN       LYS  32 156.641  12.755   6.569
  930    HA   LYS  32           HA       LYS  32 154.587  14.036   8.077
  931   1HB   LYS  32           HB2      LYS  32 156.979  14.556   8.347
  932   2HB   LYS  32           HB1      LYS  32 157.018  15.249   6.728
  933   1HG   LYS  32           HG2      LYS  32 155.363  16.957   7.416
  934   2HG   LYS  32           HG1      LYS  32 155.324  16.261   9.035
  935   1HD   LYS  32           HD2      LYS  32 157.705  16.758   9.332
  936   2HD   LYS  32           HD1      LYS  32 157.794  17.394   7.689
  937   1HE   LYS  32           HE2      LYS  32 155.926  19.022   8.410
  938   2HE   LYS  32           HE1      LYS  32 156.322  18.546  10.062
  939   1HZ   LYS  32           HZ2      LYS  32 158.735  19.045   9.251
  940   2HZ   LYS  32           HZ1      LYS  32 157.939  20.021   8.109
  941   3HZ   LYS  32           HZ3      LYS  32 157.723  20.309   9.767
  942    H    LYS  33           HN       LYS  33 155.556  14.453   4.655
  943    HA   LYS  33           HA       LYS  33 153.820  16.699   4.193
  944   1HB   LYS  33           HB2      LYS  33 154.963  14.612   2.318
  945   2HB   LYS  33           HB1      LYS  33 154.051  16.019   1.768
  946   1HG   LYS  33           HG2      LYS  33 155.674  17.510   2.878
  947   2HG   LYS  33           HG1      LYS  33 156.589  16.104   3.422
  948   1HD   LYS  33           HD2      LYS  33 156.970  15.434   1.081
  949   2HD   LYS  33           HD1      LYS  33 156.057  16.839   0.529
  950   1HE   LYS  33           HE2      LYS  33 158.455  17.330   0.449
  951   2HE   LYS  33           HE1      LYS  33 157.685  18.320   1.689
  952   1HZ   LYS  33           HZ3      LYS  33 158.762  15.703   2.452
  953   2HZ   LYS  33           HZ2      LYS  33 159.853  16.981   2.198
  954   3HZ   LYS  33           HZ1      LYS  33 158.629  17.125   3.367
  955    H    LEU  34           HN       LEU  34 153.364  13.198   3.593
  956    HA   LEU  34           HA       LEU  34 150.702  13.415   2.582
  957   1HB   LEU  34           HB2      LEU  34 152.003  11.153   4.136
  958   2HB   LEU  34           HB1      LEU  34 150.493  11.021   3.244
  959    HG   LEU  34           HG       LEU  34 153.122  11.838   1.985
  960   1HD1  LEU  34          HD12      LEU  34 153.194   9.517   2.850
  961   2HD1  LEU  34          HD11      LEU  34 151.717   9.149   1.959
  962   3HD1  LEU  34          HD13      LEU  34 153.197   9.550   1.087
  963   1HD2  LEU  34          HD22      LEU  34 150.327  11.307   0.953
  964   2HD2  LEU  34          HD21      LEU  34 151.434  12.619   0.545
  965   3HD2  LEU  34          HD23      LEU  34 151.715  11.001  -0.089
  966    H    GLU  35           HN       GLU  35 151.992  13.111   5.847
  967    HA   GLU  35           HA       GLU  35 149.505  12.834   7.223
  968   1HB   GLU  35           HB2      GLU  35 151.713  12.488   8.299
  969   2HB   GLU  35           HB1      GLU  35 152.030  14.219   8.181
  970   1HG   GLU  35           HG2      GLU  35 150.138  14.715   9.627
  971   2HG   GLU  35           HG1      GLU  35 149.673  13.012   9.659
  972    H    GLU  36           HN       GLU  36 151.277  15.730   6.185
  973    HA   GLU  36           HA       GLU  36 149.464  17.615   7.400
  974   1HB   GLU  36           HB2      GLU  36 151.779  18.185   6.614
  975   2HB   GLU  36           HB1      GLU  36 151.215  18.014   4.952
  976   1HG   GLU  36           HG2      GLU  36 149.549  19.789   5.319
  977   2HG   GLU  36           HG1      GLU  36 150.084  19.953   6.992
  978    H    ARG  37           HN       ARG  37 149.343  15.647   4.577
  979    HA   ARG  37           HA       ARG  37 147.246  17.298   3.297
  980   1HB   ARG  37           HB2      ARG  37 148.546  14.680   2.518
  981   2HB   ARG  37           HB1      ARG  37 147.261  15.445   1.584
  982   1HG   ARG  37           HG2      ARG  37 148.671  17.498   1.416
  983   2HG   ARG  37           HG1      ARG  37 149.973  16.638   2.234
  984   1HD   ARG  37           HD2      ARG  37 149.830  14.882   0.435
  985   2HD   ARG  37           HD1      ARG  37 148.706  15.925  -0.428
  986    HE   ARG  37           HE       ARG  37 151.580  16.123  -0.406
  987   1HH1  ARG  37          HH21      ARG  37 148.758  18.107  -0.240
  988   2HH1  ARG  37          HH22      ARG  37 149.606  19.554  -0.666
  989   1HH2  ARG  37          HH11      ARG  37 152.678  17.990  -0.971
  990   2HH2  ARG  37          HH12      ARG  37 151.815  19.488  -1.087
  991    H    GLY  38           HN       GLY  38 147.188  15.232   5.868
  992   1HA   GLY  38           HA2      GLY  38 145.054  14.710   6.899
  993   2HA   GLY  38           HA1      GLY  38 144.334  14.537   5.305
  994    H    PHE  39           HN       PHE  39 147.330  12.952   5.331
  995    HA   PHE  39           HA       PHE  39 145.947  10.323   5.760
  996   1HB   PHE  39           HB2      PHE  39 148.516  11.024   4.333
  997   2HB   PHE  39           HB1      PHE  39 147.883   9.392   4.504
  998    HD1  PHE  39           HD2      PHE  39 145.840   8.705   3.318
  999    HD2  PHE  39           HD1      PHE  39 147.481  12.641   2.847
 1000    HE1  PHE  39           HE2      PHE  39 144.407   9.063   1.326
 1001    HE2  PHE  39           HE1      PHE  39 146.049  13.003   0.854
 1002    HZ   PHE  39           HZ       PHE  39 144.510  11.212   0.093
 1003    H    ASP  40           HN       ASP  40 146.228  10.810   8.160
 1004    HA   ASP  40           HA       ASP  40 148.973  10.750   9.185
 1005   1HB   ASP  40           HB2      ASP  40 147.910  10.800  11.401
 1006   2HB   ASP  40           HB1      ASP  40 147.226  12.039  10.349
 1007    H    LYS  41           HN       LYS  41 146.752   8.355   8.183
 1008    HA   LYS  41           HA       LYS  41 148.327   6.271   9.667
 1009   1HB   LYS  41           HB2      LYS  41 145.349   6.205   9.082
 1010   2HB   LYS  41           HB1      LYS  41 146.275   4.949   9.902
 1011   1HG   LYS  41           HG2      LYS  41 146.114   7.791  10.930
 1012   2HG   LYS  41           HG1      LYS  41 144.980   6.538  11.422
 1013   1HD   LYS  41           HD2      LYS  41 146.996   5.149  12.124
 1014   2HD   LYS  41           HD1      LYS  41 147.975   6.595  11.879
 1015   1HE   LYS  41           HE2      LYS  41 145.552   6.500  13.687
 1016   2HE   LYS  41           HE1      LYS  41 147.210   6.293  14.249
 1017   1HZ   LYS  41           HZ2      LYS  41 146.695   8.612  12.571
 1018   2HZ   LYS  41           HZ1      LYS  41 146.008   8.648  14.125
 1019   3HZ   LYS  41           HZ3      LYS  41 147.684   8.459  13.945
 1020    H    ALA  42           HN       ALA  42 148.608   4.300   8.537
 1021    HA   ALA  42           HA       ALA  42 149.003   4.573   5.720
 1022   1HB   ALA  42           HB1      ALA  42 148.983   2.176   7.555
 1023   2HB   ALA  42           HB3      ALA  42 149.352   2.051   5.835
 1024   3HB   ALA  42           HB2      ALA  42 150.379   3.023   6.889
 1025    H    TYR  43           HN       TYR  43 146.379   2.985   7.559
 1026    HA   TYR  43           HA       TYR  43 145.169   1.711   5.345
 1027   1HB   TYR  43           HB2      TYR  43 143.125   1.584   6.659
 1028   2HB   TYR  43           HB1      TYR  43 144.520   1.245   7.677
 1029    HD1  TYR  43           HD1      TYR  43 142.145   3.952   6.682
 1030    HD2  TYR  43           HD2      TYR  43 144.938   2.532   9.620
 1031    HE1  TYR  43           HE1      TYR  43 141.431   5.748   8.231
 1032    HE2  TYR  43           HE2      TYR  43 144.224   4.333  11.167
 1033    HH   TYR  43           HH       TYR  43 142.150   5.751  11.497
 1034    H    VAL  44           HN       VAL  44 145.253   5.114   6.047
 1035    HA   VAL  44           HA       VAL  44 142.876   5.705   4.407
 1036    HB   VAL  44           HB       VAL  44 145.092   7.599   5.259
 1037   1HG1  VAL  44          HG11      VAL  44 143.539   8.314   3.395
 1038   2HG1  VAL  44          HG13      VAL  44 142.201   8.146   4.529
 1039   3HG1  VAL  44          HG12      VAL  44 143.466   9.337   4.828
 1040   1HG2  VAL  44          HG22      VAL  44 143.943   6.404   7.164
 1041   2HG2  VAL  44          HG21      VAL  44 143.739   8.151   7.172
 1042   3HG2  VAL  44          HG23      VAL  44 142.426   7.115   6.615
 1043    H    VAL  45           HN       VAL  45 146.323   5.504   4.090
 1044    HA   VAL  45           HA       VAL  45 146.464   6.566   1.367
 1045    HB   VAL  45           HB       VAL  45 148.451   4.898   2.952
 1046   1HG1  VAL  45          HG13      VAL  45 148.706   6.452   0.362
 1047   2HG1  VAL  45          HG12      VAL  45 150.083   5.852   1.286
 1048   3HG1  VAL  45          HG11      VAL  45 148.928   4.718   0.586
 1049   1HG2  VAL  45          HG23      VAL  45 147.847   7.131   3.922
 1050   2HG2  VAL  45          HG22      VAL  45 149.536   7.017   3.431
 1051   3HG2  VAL  45          HG21      VAL  45 148.382   7.882   2.419
 1052    H    LEU  46           HN       LEU  46 146.280   3.403   2.916
 1053    HA   LEU  46           HA       LEU  46 146.631   1.780   0.592
 1054   1HB   LEU  46           HB2      LEU  46 146.578   0.910   2.943
 1055   2HB   LEU  46           HB1      LEU  46 144.860   1.284   3.015
 1056    HG   LEU  46           HG       LEU  46 144.622  -0.233   0.938
 1057   1HD1  LEU  46          HD13      LEU  46 147.420  -0.927   1.834
 1058   2HD1  LEU  46          HD12      LEU  46 146.420  -2.045   0.913
 1059   3HD1  LEU  46          HD11      LEU  46 146.873  -0.493   0.215
 1060   1HD2  LEU  46          HD21      LEU  46 145.169  -1.091   3.755
 1061   2HD2  LEU  46          HD23      LEU  46 143.670  -1.155   2.835
 1062   3HD2  LEU  46          HD22      LEU  46 144.938  -2.336   2.530
 1063    H    GLY  47           HN       GLY  47 143.891   3.460   2.002
 1064   1HA   GLY  47           HA2      GLY  47 141.805   2.426   0.372
 1065   2HA   GLY  47           HA1      GLY  47 141.786   4.019   1.125
 1066    H    GLN  48           HN       GLN  48 144.033   5.170  -0.183
 1067    HA   GLN  48           HA       GLN  48 142.850   6.052  -2.628
 1068   1HB   GLN  48           HB2      GLN  48 144.607   7.294  -1.326
 1069   2HB   GLN  48           HB1      GLN  48 145.791   6.111  -1.879
 1070   1HG   GLN  48           HG2      GLN  48 145.897   8.044  -3.345
 1071   2HG   GLN  48           HG1      GLN  48 145.191   6.703  -4.245
 1072   1HE2  GLN  48          HE22      GLN  48 142.417   8.706  -5.052
 1073   2HE2  GLN  48          HE21      GLN  48 143.598   7.603  -5.571
 1074    H    PHE  49           HN       PHE  49 145.417   3.674  -1.969
 1075    HA   PHE  49           HA       PHE  49 145.993   2.986  -4.673
 1076   1HB   PHE  49           HB2      PHE  49 147.380   2.295  -2.731
 1077   2HB   PHE  49           HB1      PHE  49 146.083   1.229  -2.197
 1078    HD1  PHE  49           HD1      PHE  49 147.979   1.968  -5.357
 1079    HD2  PHE  49           HD2      PHE  49 146.299  -1.030  -2.777
 1080    HE1  PHE  49           HE1      PHE  49 148.867   0.194  -6.840
 1081    HE2  PHE  49           HE2      PHE  49 147.188  -2.804  -4.262
 1082    HZ   PHE  49           HZ       PHE  49 148.473  -2.192  -6.294
 1083    H    LEU  50           HN       LEU  50 143.589   1.786  -2.388
 1084    HA   LEU  50           HA       LEU  50 142.547  -0.280  -4.131
 1085   1HB   LEU  50           HB2      LEU  50 141.303   1.209  -1.797
 1086   2HB   LEU  50           HB1      LEU  50 140.512  -0.134  -2.616
 1087    HG   LEU  50           HG       LEU  50 143.269  -0.323  -1.360
 1088   1HD1  LEU  50          HD13      LEU  50 140.537  -1.006  -0.239
 1089   2HD1  LEU  50          HD12      LEU  50 142.041  -1.626   0.441
 1090   3HD1  LEU  50          HD11      LEU  50 141.725   0.106   0.436
 1091   1HD2  LEU  50          HD21      LEU  50 141.372  -2.277  -2.664
 1092   2HD2  LEU  50          HD23      LEU  50 143.116  -2.112  -2.872
 1093   3HD2  LEU  50          HD22      LEU  50 142.471  -2.843  -1.408
 1094    H    VAL  51           HN       VAL  51 141.746   3.115  -3.592
 1095    HA   VAL  51           HA       VAL  51 139.421   3.186  -5.267
 1096    HB   VAL  51           HB       VAL  51 141.319   5.307  -4.249
 1097   1HG1  VAL  51          HG12      VAL  51 138.891   5.604  -6.030
 1098   2HG1  VAL  51          HG11      VAL  51 139.458   6.912  -4.993
 1099   3HG1  VAL  51          HG13      VAL  51 140.502   6.281  -6.267
 1100   1HG2  VAL  51          HG23      VAL  51 139.744   4.089  -2.698
 1101   2HG2  VAL  51          HG22      VAL  51 139.490   5.833  -2.762
 1102   3HG2  VAL  51          HG21      VAL  51 138.404   4.751  -3.634
 1103    H    LEU  52           HN       LEU  52 142.811   3.201  -6.068
 1104    HA   LEU  52           HA       LEU  52 142.309   4.369  -8.748
 1105   1HB   LEU  52           HB2      LEU  52 144.836   3.363  -7.420
 1106   2HB   LEU  52           HB1      LEU  52 144.775   4.062  -9.039
 1107    HG   LEU  52           HG       LEU  52 143.813   5.477  -6.534
 1108   1HD1  LEU  52          HD11      LEU  52 146.288   5.015  -6.605
 1109   2HD1  LEU  52          HD13      LEU  52 146.354   5.943  -8.102
 1110   3HD1  LEU  52          HD12      LEU  52 145.876   6.730  -6.599
 1111   1HD2  LEU  52          HD23      LEU  52 143.915   6.175  -9.458
 1112   2HD2  LEU  52          HD22      LEU  52 142.713   6.604  -8.243
 1113   3HD2  LEU  52          HD21      LEU  52 144.248   7.461  -8.296
 1114    H    LYS  53           HN       LYS  53 141.466   1.494  -7.718
 1115    HA   LYS  53           HA       LYS  53 141.352  -0.654  -8.680
 1116   1HB   LYS  53           HB2      LYS  53 141.645   1.116 -11.122
 1117   2HB   LYS  53           HB1      LYS  53 141.248  -0.600 -11.205
 1118   1HG   LYS  53           HG2      LYS  53 139.242  -0.202  -9.824
 1119   2HG   LYS  53           HG1      LYS  53 139.638   1.516  -9.747
 1120   1HD   LYS  53           HD2      LYS  53 139.480   1.664 -12.209
 1121   2HD   LYS  53           HD1      LYS  53 139.077  -0.052 -12.280
 1122   1HE   LYS  53           HE2      LYS  53 137.459   1.955 -10.697
 1123   2HE   LYS  53           HE1      LYS  53 137.083   1.512 -12.363
 1124   1HZ   LYS  53           HZ2      LYS  53 137.412  -0.882 -11.155
 1125   2HZ   LYS  53           HZ1      LYS  53 136.663   0.034  -9.936
 1126   3HZ   LYS  53           HZ3      LYS  53 135.915  -0.132 -11.449
 1127    H    LYS  54           HN       LYS  54 143.993   0.058  -7.796
 1128    HA   LYS  54           HA       LYS  54 146.208  -0.707  -7.975
 1129   1HB   LYS  54           HB2      LYS  54 145.185  -2.579 -10.130
 1130   2HB   LYS  54           HB1      LYS  54 146.566  -2.806  -9.067
 1131   1HG   LYS  54           HG2      LYS  54 143.727  -2.611  -8.032
 1132   2HG   LYS  54           HG1      LYS  54 144.486  -4.137  -8.465
 1133   1HD   LYS  54           HD2      LYS  54 146.326  -3.636  -6.853
 1134   2HD   LYS  54           HD1      LYS  54 145.449  -2.188  -6.355
 1135   1HE   LYS  54           HE2      LYS  54 143.583  -3.490  -5.572
 1136   2HE   LYS  54           HE1      LYS  54 144.247  -4.964  -6.275
 1137   1HZ   LYS  54           HZ1      LYS  54 146.206  -4.611  -4.777
 1138   2HZ   LYS  54           HZ3      LYS  54 145.308  -3.407  -3.989
 1139   3HZ   LYS  54           HZ2      LYS  54 144.755  -5.014  -3.991
 1140    H    ASP  55           HN       ASP  55 144.972   1.328 -10.022
 1141    HA   ASP  55           HA       ASP  55 146.499   0.905 -12.446
 1142   1HB   ASP  55           HB2      ASP  55 145.152   3.334 -11.252
 1143   2HB   ASP  55           HB1      ASP  55 146.036   3.405 -12.777
 1144    H    GLU  56           HN       GLU  56 148.670   0.738 -12.262
 1145    HA   GLU  56           HA       GLU  56 150.269   1.929 -10.235
 1146   1HB   GLU  56           HB2      GLU  56 150.960  -0.047 -11.513
 1147   2HB   GLU  56           HB1      GLU  56 151.072   0.928 -12.977
 1148   1HG   GLU  56           HG2      GLU  56 152.852   2.277 -11.998
 1149   2HG   GLU  56           HG1      GLU  56 152.686   1.432 -10.459
 1150    H    ASP  57           HN       ASP  57 149.579   3.067 -13.552
 1151    HA   ASP  57           HA       ASP  57 151.492   5.228 -13.446
 1152   1HB   ASP  57           HB2      ASP  57 149.008   4.799 -15.126
 1153   2HB   ASP  57           HB1      ASP  57 150.099   6.167 -15.345
 1154    H    LEU  58           HN       LEU  58 148.061   4.986 -12.671
 1155    HA   LEU  58           HA       LEU  58 147.793   7.817 -12.086
 1156   1HB   LEU  58           HB2      LEU  58 146.118   5.460 -11.156
 1157   2HB   LEU  58           HB1      LEU  58 145.670   7.152 -10.954
 1158    HG   LEU  58           HG       LEU  58 146.187   5.808 -13.628
 1159   1HD1  LEU  58          HD12      LEU  58 143.643   6.444 -12.120
 1160   2HD1  LEU  58          HD11      LEU  58 143.664   6.177 -13.863
 1161   3HD1  LEU  58          HD13      LEU  58 144.160   4.890 -12.767
 1162   1HD2  LEU  58          HD21      LEU  58 145.464   8.608 -12.776
 1163   2HD2  LEU  58          HD23      LEU  58 146.582   8.078 -14.033
 1164   3HD2  LEU  58          HD22      LEU  58 144.846   7.997 -14.310
 1165    H    PHE  59           HN       PHE  59 148.526   4.941 -10.164
 1166    HA   PHE  59           HA       PHE  59 148.570   6.277  -7.615
 1167   1HB   PHE  59           HB2      PHE  59 148.435   3.848  -7.749
 1168   2HB   PHE  59           HB1      PHE  59 149.985   3.779  -8.586
 1169    HD1  PHE  59           HD1      PHE  59 148.341   4.658  -5.367
 1170    HD2  PHE  59           HD2      PHE  59 152.049   3.870  -7.388
 1171    HE1  PHE  59           HE1      PHE  59 149.512   4.561  -3.182
 1172    HE2  PHE  59           HE2      PHE  59 153.220   3.775  -5.205
 1173    HZ   PHE  59           HZ       PHE  59 151.952   4.121  -3.102
 1174    H    ARG  60           HN       ARG  60 151.195   5.436  -9.902
 1175    HA   ARG  60           HA       ARG  60 153.276   6.612  -8.372
 1176   1HB   ARG  60           HB2      ARG  60 153.022   6.174 -11.351
 1177   2HB   ARG  60           HB1      ARG  60 154.494   6.770 -10.586
 1178   1HG   ARG  60           HG2      ARG  60 154.519   4.741  -9.138
 1179   2HG   ARG  60           HG1      ARG  60 153.120   4.128 -10.000
 1180   1HD   ARG  60           HD2      ARG  60 155.821   4.768 -11.212
 1181   2HD   ARG  60           HD1      ARG  60 155.165   3.155 -10.931
 1182    HE   ARG  60           HE       ARG  60 153.250   4.342 -12.520
 1183   1HH1  ARG  60          HH21      ARG  60 156.668   3.907 -12.635
 1184   2HH1  ARG  60          HH22      ARG  60 156.740   3.869 -14.365
 1185   1HH2  ARG  60          HH11      ARG  60 153.322   4.292 -14.778
 1186   2HH2  ARG  60          HH12      ARG  60 154.843   4.085 -15.579
 1187    H    GLU  61           HN       GLU  61 151.321   8.105 -11.018
 1188    HA   GLU  61           HA       GLU  61 152.680  10.630 -10.816
 1189   1HB   GLU  61           HB2      GLU  61 149.990   9.794 -11.911
 1190   2HB   GLU  61           HB1      GLU  61 150.450  11.495 -11.852
 1191   1HG   GLU  61           HG2      GLU  61 151.069  10.681 -14.027
 1192   2HG   GLU  61           HG1      GLU  61 152.564  10.862 -13.112
 1193    H    TRP  62           HN       TRP  62 149.906   9.225  -9.105
 1194    HA   TRP  62           HA       TRP  62 149.073  11.630  -7.813
 1195   1HB   TRP  62           HB2      TRP  62 147.584   9.754  -7.752
 1196   2HB   TRP  62           HB1      TRP  62 148.814   8.718  -7.028
 1197    HD1  TRP  62           HD1      TRP  62 146.458  11.626  -6.178
 1198    HE1  TRP  62           HE1      TRP  62 146.270  11.807  -3.609
 1199    HE3  TRP  62           HE3      TRP  62 149.976   8.192  -4.789
 1200    HZ2  TRP  62           HZ2      TRP  62 147.466  10.645  -1.269
 1201    HZ3  TRP  62           HZ3      TRP  62 150.425   7.746  -2.395
 1202    HH2  TRP  62           HH2      TRP  62 149.178   8.967  -0.637
 1203    H    LEU  63           HN       LEU  63 151.321   9.074  -6.700
 1204    HA   LEU  63           HA       LEU  63 151.868  10.385  -4.200
 1205   1HB   LEU  63           HB2      LEU  63 152.283   7.984  -4.520
 1206   2HB   LEU  63           HB1      LEU  63 153.504   8.346  -5.736
 1207    HG   LEU  63           HG       LEU  63 154.854   9.521  -4.036
 1208   1HD1  LEU  63          HD13      LEU  63 152.465   8.890  -2.315
 1209   2HD1  LEU  63          HD12      LEU  63 154.062   9.022  -1.578
 1210   3HD1  LEU  63          HD11      LEU  63 153.377  10.394  -2.443
 1211   1HD2  LEU  63          HD23      LEU  63 155.057   7.039  -4.443
 1212   2HD2  LEU  63          HD22      LEU  63 155.590   7.557  -2.843
 1213   3HD2  LEU  63          HD21      LEU  63 154.015   6.788  -3.041
 1214    H    LYS  64           HN       LYS  64 153.728  10.199  -7.216
 1215    HA   LYS  64           HA       LYS  64 155.861  11.898  -6.367
 1216   1HB   LYS  64           HB2      LYS  64 156.011  10.513  -8.398
 1217   2HB   LYS  64           HB1      LYS  64 154.773  11.507  -9.170
 1218   1HG   LYS  64           HG2      LYS  64 156.208  13.473  -9.047
 1219   2HG   LYS  64           HG1      LYS  64 157.420  12.570  -8.139
 1220   1HD   LYS  64           HD2      LYS  64 157.752  11.068 -10.058
 1221   2HD   LYS  64           HD1      LYS  64 156.522  11.947 -10.968
 1222   1HE   LYS  64           HE2      LYS  64 158.867  12.660 -11.518
 1223   2HE   LYS  64           HE1      LYS  64 157.856  13.975 -10.919
 1224   1HZ   LYS  64           HZ3      LYS  64 159.173  12.556  -8.814
 1225   2HZ   LYS  64           HZ2      LYS  64 160.276  13.231  -9.916
 1226   3HZ   LYS  64           HZ1      LYS  64 159.136  14.220  -9.135
 1227    H    ASP  65           HN       ASP  65 152.863  12.652  -8.110
 1228    HA   ASP  65           HA       ASP  65 153.362  15.488  -8.237
 1229   1HB   ASP  65           HB2      ASP  65 151.731  14.170  -9.677
 1230   2HB   ASP  65           HB1      ASP  65 150.657  14.129  -8.278
 1231    H    THR  66           HN       THR  66 151.932  13.364  -5.839
 1232    HA   THR  66           HA       THR  66 150.726  15.538  -4.324
 1233    HB   THR  66           HB       THR  66 151.192  12.619  -3.667
 1234    HG1  THR  66           HG1      THR  66 149.424  12.432  -4.754
 1235   1HG2  THR  66          HG21      THR  66 149.873  14.842  -2.114
 1236   2HG2  THR  66          HG23      THR  66 149.439  13.152  -1.863
 1237   3HG2  THR  66          HG22      THR  66 151.089  13.694  -1.556
 1238    H    CYS  67           HN       CYS  67 153.829  13.771  -4.137
 1239    HA   CYS  67           HA       CYS  67 154.606  15.667  -1.936
 1240   1HB   CYS  67           HB2      CYS  67 155.805  13.853  -0.828
 1241   2HB   CYS  67           HB1      CYS  67 154.102  13.431  -1.008
 1242    HG   CYS  67           HG       CYS  67 155.050  12.161  -3.315
 1243    H    GLY  68           HN       GLY  68 155.659  13.740  -4.707
 1244   1HA   GLY  68           HA2      GLY  68 157.375  14.699  -6.192
 1245   2HA   GLY  68           HA1      GLY  68 158.181  15.365  -4.773
 1246    H    ALA  69           HN       ALA  69 156.920  12.192  -4.340
 1247    HA   ALA  69           HA       ALA  69 159.359  11.000  -3.646
 1248   1HB   ALA  69           HB3      ALA  69 157.056  10.029  -3.276
 1249   2HB   ALA  69           HB2      ALA  69 157.051   9.553  -4.975
 1250   3HB   ALA  69           HB1      ALA  69 158.243   8.867  -3.871
 1251    H    ASN  70           HN       ASN  70 160.816   9.584  -4.829
 1252    HA   ASN  70           HA       ASN  70 161.107  10.385  -7.651
 1253   1HB   ASN  70           HB2      ASN  70 162.836   8.644  -5.868
 1254   2HB   ASN  70           HB1      ASN  70 163.281   9.246  -7.465
 1255   1HD2  ASN  70          HD22      ASN  70 164.161  11.548  -4.396
 1256   2HD2  ASN  70          HD21      ASN  70 163.999   9.859  -4.365
 1257    H    ALA  71           HN       ALA  71 161.833   8.558  -9.171
 1258    HA   ALA  71           HA       ALA  71 159.715   6.705  -9.535
 1259   1HB   ALA  71           HB2      ALA  71 161.365   7.519 -11.287
 1260   2HB   ALA  71           HB1      ALA  71 162.526   6.378 -10.606
 1261   3HB   ALA  71           HB3      ALA  71 161.026   5.788 -11.323
 1262    H    LYS  72           HN       LYS  72 162.839   6.337  -7.879
 1263    HA   LYS  72           HA       LYS  72 162.638   3.465  -7.629
 1264   1HB   LYS  72           HB2      LYS  72 164.170   5.486  -5.960
 1265   2HB   LYS  72           HB1      LYS  72 164.412   3.739  -5.911
 1266   1HG   LYS  72           HG2      LYS  72 165.019   3.753  -8.304
 1267   2HG   LYS  72           HG1      LYS  72 164.781   5.501  -8.354
 1268   1HD   LYS  72           HD2      LYS  72 166.549   5.792  -6.654
 1269   2HD   LYS  72           HD1      LYS  72 166.790   4.046  -6.607
 1270   1HE   LYS  72           HE2      LYS  72 167.498   4.022  -8.926
 1271   2HE   LYS  72           HE1      LYS  72 167.093   5.729  -9.109
 1272   1HZ   LYS  72           HZ3      LYS  72 168.733   5.921  -7.078
 1273   2HZ   LYS  72           HZ2      LYS  72 169.360   4.488  -7.741
 1274   3HZ   LYS  72           HZ1      LYS  72 169.300   5.906  -8.677
 1275    H    GLN  73           HN       GLN  73 161.723   6.170  -5.535
 1276    HA   GLN  73           HA       GLN  73 160.931   4.564  -3.300
 1277   1HB   GLN  73           HB2      GLN  73 160.183   7.368  -4.160
 1278   2HB   GLN  73           HB1      GLN  73 159.654   6.652  -2.637
 1279   1HG   GLN  73           HG2      GLN  73 161.999   6.284  -1.982
 1280   2HG   GLN  73           HG1      GLN  73 162.541   6.979  -3.509
 1281   1HE2  GLN  73          HE22      GLN  73 162.268   9.543  -0.628
 1282   2HE2  GLN  73          HE21      GLN  73 162.813   7.936  -0.578
 1283    H    SER  74           HN       SER  74 159.129   5.800  -6.108
 1284    HA   SER  74           HA       SER  74 156.570   4.984  -5.125
 1285   1HB   SER  74           HB2      SER  74 157.415   5.261  -8.015
 1286   2HB   SER  74           HB1      SER  74 155.787   5.377  -7.358
 1287    HG   SER  74           HG       SER  74 156.332   7.261  -6.348
 1288    H    ARG  75           HN       ARG  75 159.041   3.297  -7.098
 1289    HA   ARG  75           HA       ARG  75 157.417   1.072  -7.807
 1290   1HB   ARG  75           HB2      ARG  75 160.402   1.319  -7.354
 1291   2HB   ARG  75           HB1      ARG  75 159.648  -0.166  -7.930
 1292   1HG   ARG  75           HG2      ARG  75 158.733   1.015  -9.871
 1293   2HG   ARG  75           HG1      ARG  75 159.400   2.538  -9.284
 1294   1HD   ARG  75           HD2      ARG  75 161.670   1.698  -9.521
 1295   2HD   ARG  75           HD1      ARG  75 161.070   0.095  -9.947
 1296    HE   ARG  75           HE       ARG  75 159.932   1.704 -11.870
 1297   1HH1  ARG  75          HH21      ARG  75 163.111   1.301 -10.594
 1298   2HH1  ARG  75          HH22      ARG  75 163.901   1.625 -12.101
 1299   1HH2  ARG  75          HH11      ARG  75 160.948   2.124 -13.848
 1300   2HH2  ARG  75          HH12      ARG  75 162.677   2.092 -13.941
 1301    H    ASP  76           HN       ASP  76 159.327   1.690  -4.847
 1302    HA   ASP  76           HA       ASP  76 158.909  -0.929  -3.758
 1303   1HB   ASP  76           HB2      ASP  76 159.557   1.726  -2.465
 1304   2HB   ASP  76           HB1      ASP  76 159.490   0.208  -1.570
 1305    H    CYS  77           HN       CYS  77 156.994   2.095  -3.427
 1306    HA   CYS  77           HA       CYS  77 155.240   0.985  -1.427
 1307   1HB   CYS  77           HB2      CYS  77 154.946   3.301  -3.352
 1308   2HB   CYS  77           HB1      CYS  77 153.718   2.883  -2.158
 1309    HG   CYS  77           HG       CYS  77 156.625   3.748  -1.382
 1310    H    PHE  78           HN       PHE  78 155.047   1.138  -5.018
 1311    HA   PHE  78           HA       PHE  78 152.366   0.211  -5.195
 1312   1HB   PHE  78           HB2      PHE  78 153.571   1.067  -7.153
 1313   2HB   PHE  78           HB1      PHE  78 154.664  -0.318  -7.101
 1314    HD1  PHE  78           HD2      PHE  78 153.901  -2.560  -7.699
 1315    HD2  PHE  78           HD1      PHE  78 151.239   0.808  -7.856
 1316    HE1  PHE  78           HE2      PHE  78 152.278  -3.905  -9.003
 1317    HE2  PHE  78           HE1      PHE  78 149.613  -0.539  -9.159
 1318    HZ   PHE  78           HZ       PHE  78 150.133  -2.895  -9.734
 1319    H    GLY  79           HN       GLY  79 155.325  -1.761  -5.601
 1320   1HA   GLY  79           HA2      GLY  79 153.995  -4.259  -5.564
 1321   2HA   GLY  79           HA1      GLY  79 155.693  -4.028  -5.152
 1322    H    CYS  80           HN       CYS  80 155.045  -2.187  -2.935
 1323    HA   CYS  80           HA       CYS  80 154.777  -4.186  -0.856
 1324   1HB   CYS  80           HB2      CYS  80 156.067  -2.086  -0.563
 1325   2HB   CYS  80           HB1      CYS  80 154.561  -1.171  -0.638
 1326    HG   CYS  80           HG       CYS  80 155.565  -2.703   1.787
 1327    H    LEU  81           HN       LEU  81 152.571  -1.562  -1.990
 1328    HA   LEU  81           HA       LEU  81 150.459  -2.390  -0.200
 1329   1HB   LEU  81           HB2      LEU  81 150.335  -0.770  -2.765
 1330   2HB   LEU  81           HB1      LEU  81 149.027  -0.920  -1.595
 1331    HG   LEU  81           HG       LEU  81 151.766   0.261  -1.034
 1332   1HD1  LEU  81          HD11      LEU  81 150.157   1.592  -2.494
 1333   2HD1  LEU  81          HD13      LEU  81 149.075   1.648  -1.102
 1334   3HD1  LEU  81          HD12      LEU  81 150.671   2.395  -1.011
 1335   1HD2  LEU  81          HD21      LEU  81 149.383  -0.385   0.692
 1336   2HD2  LEU  81          HD23      LEU  81 151.100  -0.550   1.056
 1337   3HD2  LEU  81          HD22      LEU  81 150.346   1.041   1.077
 1338    H    ARG  82           HN       ARG  82 151.236  -3.102  -3.603
 1339    HA   ARG  82           HA       ARG  82 148.833  -4.530  -4.178
 1340   1HB   ARG  82           HB2      ARG  82 150.414  -3.802  -5.935
 1341   2HB   ARG  82           HB1      ARG  82 151.589  -4.983  -5.354
 1342   1HG   ARG  82           HG2      ARG  82 150.090  -6.819  -5.871
 1343   2HG   ARG  82           HG1      ARG  82 148.794  -5.697  -6.287
 1344   1HD   ARG  82           HD2      ARG  82 150.152  -4.820  -8.152
 1345   2HD   ARG  82           HD1      ARG  82 151.447  -5.945  -7.738
 1346    HE   ARG  82           HE       ARG  82 149.238  -7.581  -8.093
 1347   1HH1  ARG  82          HH21      ARG  82 150.857  -5.126  -9.892
 1348   2HH1  ARG  82          HH22      ARG  82 150.443  -5.796 -11.435
 1349   1HH2  ARG  82          HH11      ARG  82 148.678  -8.466 -10.101
 1350   2HH2  ARG  82          HH12      ARG  82 149.207  -7.684 -11.553
 1351    H    GLU  83           HN       GLU  83 151.921  -5.629  -2.794
 1352    HA   GLU  83           HA       GLU  83 151.169  -8.408  -2.781
 1353   1HB   GLU  83           HB2      GLU  83 153.290  -6.859  -1.279
 1354   2HB   GLU  83           HB1      GLU  83 153.074  -8.603  -1.103
 1355   1HG   GLU  83           HG2      GLU  83 153.470  -8.954  -3.467
 1356   2HG   GLU  83           HG1      GLU  83 153.499  -7.219  -3.767
 1357    H    TRP  84           HN       TRP  84 150.845  -5.820  -0.319
 1358    HA   TRP  84           HA       TRP  84 149.979  -7.550   1.793
 1359   1HB   TRP  84           HB2      TRP  84 150.658  -5.160   2.110
 1360   2HB   TRP  84           HB1      TRP  84 149.169  -4.666   1.306
 1361    HD1  TRP  84           HD1      TRP  84 150.494  -6.171   4.530
 1362    HE1  TRP  84           HE1      TRP  84 148.617  -6.188   6.293
 1363    HE3  TRP  84           HE3      TRP  84 146.536  -4.776   1.617
 1364    HZ2  TRP  84           HZ2      TRP  84 145.804  -5.679   6.450
 1365    HZ3  TRP  84           HZ3      TRP  84 144.270  -4.559   2.599
 1366    HH2  TRP  84           HH2      TRP  84 143.902  -5.004   5.006
 1367    H    CYS  85           HN       CYS  85 148.162  -5.715  -0.681
 1368    HA   CYS  85           HA       CYS  85 145.569  -6.485   0.192
 1369   1HB   CYS  85           HB2      CYS  85 146.636  -5.706  -2.528
 1370   2HB   CYS  85           HB1      CYS  85 144.927  -6.033  -2.237
 1371    HG   CYS  85           HG       CYS  85 146.400  -3.510  -1.400
 1372    H    ASP  86           HN       ASP  86 147.811  -8.087  -2.061
 1373    HA   ASP  86           HA       ASP  86 146.027 -10.121  -2.937
 1374   1HB   ASP  86           HB2      ASP  86 149.033 -10.145  -2.555
 1375   2HB   ASP  86           HB1      ASP  86 148.142 -11.466  -3.312
 1376    H    ALA  87           HN       ALA  87 147.766  -9.687   0.061
 1377    HA   ALA  87           HA       ALA  87 147.158 -12.454   0.940
 1378   1HB   ALA  87           HB3      ALA  87 149.367 -11.249   1.413
 1379   2HB   ALA  87           HB2      ALA  87 148.465 -10.280   2.580
 1380   3HB   ALA  87           HB1      ALA  87 148.584 -12.026   2.789
 1381    H    PHE  88           HN       PHE  88 146.182  -9.115   1.679
 1382    HA   PHE  88           HA       PHE  88 144.235 -10.183   3.697
 1383   1HB   PHE  88           HB2      PHE  88 145.408  -7.426   3.335
 1384   2HB   PHE  88           HB1      PHE  88 144.186  -7.843   4.534
 1385    HD1  PHE  88           HD2      PHE  88 144.714  -9.592   6.280
 1386    HD2  PHE  88           HD1      PHE  88 147.713  -7.939   3.687
 1387    HE1  PHE  88           HE2      PHE  88 146.487 -10.392   7.818
 1388    HE2  PHE  88           HE1      PHE  88 149.487  -8.738   5.227
 1389    HZ   PHE  88           HZ       PHE  88 148.871  -9.958   7.293
 1390    H    LEU  89           HN       LEU  89 144.200  -8.946   0.496
 1391    HA   LEU  89           HA       LEU  89 141.535  -7.675   0.879
 1392   1HB   LEU  89           HB2      LEU  89 143.349  -6.654  -0.609
 1393   2HB   LEU  89           HB1      LEU  89 143.052  -7.990  -1.716
 1394    HG   LEU  89           HG       LEU  89 140.575  -7.321  -1.640
 1395   1HD1  LEU  89          HD11      LEU  89 141.833  -4.985  -0.195
 1396   2HD1  LEU  89          HD13      LEU  89 140.403  -4.736  -1.194
 1397   3HD1  LEU  89          HD12      LEU  89 140.338  -5.840   0.173
 1398   1HD2  LEU  89          HD23      LEU  89 142.664  -5.481  -2.845
 1399   2HD2  LEU  89          HD22      LEU  89 141.934  -6.897  -3.603
 1400   3HD2  LEU  89          HD21      LEU  89 140.958  -5.461  -3.292
   
  No H/Q in entry =        1400
  Start of MODEL   10
    1   1H    MET   1           HT1      MET   1 119.317  -9.704  13.918
    2   2H    MET   1           HT3      MET   1 120.113 -10.968  14.721
    3   3H    MET   1           HT2      MET   1 120.264 -10.806  13.037
    4    HA   MET   1           HA       MET   1 118.749 -12.564  13.393
    5   1HB   MET   1           HB2      MET   1 116.736 -12.218  14.807
    6   2HB   MET   1           HB1      MET   1 118.225 -12.056  15.737
    7   1HG   MET   1           HG2      MET   1 118.078  -9.551  15.319
    8   2HG   MET   1           HG1      MET   1 116.458  -9.835  14.682
    9   1HE   MET   1           HE1      MET   1 118.923 -10.484  17.316
   10   2HE   MET   1           HE3      MET   1 118.344  -8.999  18.082
   11   3HE   MET   1           HE2      MET   1 118.084 -10.557  18.862
   12    H    THR   2           HN       THR   2 118.396  -9.209  12.669
   13    HA   THR   2           HA       THR   2 116.000  -9.715  10.952
   14    HB   THR   2           HB       THR   2 117.356  -7.104  11.678
   15    HG1  THR   2           HG1      THR   2 115.795  -6.918  13.201
   16   1HG2  THR   2          HG21      THR   2 114.752  -7.778  10.289
   17   2HG2  THR   2          HG23      THR   2 115.166  -6.166  10.873
   18   3HG2  THR   2          HG22      THR   2 116.132  -6.919   9.604
   19    H    THR   3           HN       THR   3 119.425  -9.164  10.780
   20    HA   THR   3           HA       THR   3 119.471  -8.109   8.088
   21    HB   THR   3           HB       THR   3 121.873  -8.623   8.160
   22    HG1  THR   3           HG1      THR   3 122.114 -10.492   9.167
   23   1HG2  THR   3          HG23      THR   3 121.037  -6.628   9.351
   24   2HG2  THR   3          HG22      THR   3 120.822  -7.595  10.811
   25   3HG2  THR   3          HG21      THR   3 122.440  -7.318  10.167
   26    H    SER   4           HN       SER   4 120.129  -9.259   6.163
   27    HA   SER   4           HA       SER   4 118.926 -11.899   5.948
   28   1HB   SER   4           HB2      SER   4 118.741 -10.543   4.000
   29   2HB   SER   4           HB1      SER   4 120.451 -10.123   4.033
   30    HG   SER   4           HG       SER   4 119.502 -12.776   3.720
   31    H    GLN   5           HN       GLN   5 120.200 -13.734   4.997
   32    HA   GLN   5           HA       GLN   5 122.370 -14.449   6.696
   33   1HB   GLN   5           HB2      GLN   5 121.427 -15.579   4.050
   34   2HB   GLN   5           HB1      GLN   5 122.690 -16.327   5.029
   35   1HG   GLN   5           HG2      GLN   5 121.135 -16.536   6.917
   36   2HG   GLN   5           HG1      GLN   5 119.870 -15.742   5.978
   37   1HE2  GLN   5          HE22      GLN   5 119.512 -19.483   5.652
   38   2HE2  GLN   5          HE21      GLN   5 119.570 -18.431   6.983
   39    H    LYS   6           HN       LYS   6 122.332 -12.689   3.674
   40    HA   LYS   6           HA       LYS   6 124.970 -13.217   2.772
   41   1HB   LYS   6           HB2      LYS   6 123.196 -10.777   2.523
   42   2HB   LYS   6           HB1      LYS   6 124.738 -10.942   1.682
   43   1HG   LYS   6           HG2      LYS   6 123.933 -13.009   0.604
   44   2HG   LYS   6           HG1      LYS   6 122.389 -12.842   1.440
   45   1HD   LYS   6           HD2      LYS   6 122.013 -10.675   0.323
   46   2HD   LYS   6           HD1      LYS   6 123.556 -10.842  -0.517
   47   1HE   LYS   6           HE2      LYS   6 121.324 -12.877  -0.724
   48   2HE   LYS   6           HE1      LYS   6 121.541 -11.555  -1.873
   49   1HZ   LYS   6           HZ3      LYS   6 123.945 -13.046  -1.336
   50   2HZ   LYS   6           HZ2      LYS   6 122.717 -13.975  -2.054
   51   3HZ   LYS   6           HZ1      LYS   6 123.276 -12.565  -2.819
   52    H    HIS   7           HN       HIS   7 123.728 -10.905   5.162
   53    HA   HIS   7           HA       HIS   7 126.096  -9.384   5.483
   54   1HB   HIS   7           HB2      HIS   7 124.071  -8.598   6.495
   55   2HB   HIS   7           HB1      HIS   7 123.874 -10.088   7.414
   56    HD2  HIS   7           HD2      HIS   7 125.390 -10.230   9.790
   57    HE1  HIS   7           HE1      HIS   7 127.155  -6.408   9.469
   58    HE2  HIS   7           HE2      HIS   7 126.821  -8.410  10.989
   59    H    ARG   8           HN       ARG   8 125.061 -12.292   7.317
   60    HA   ARG   8           HA       ARG   8 127.492 -12.430   8.842
   61   1HB   ARG   8           HB2      ARG   8 125.316 -14.451   8.260
   62   2HB   ARG   8           HB1      ARG   8 126.680 -14.786   9.331
   63   1HG   ARG   8           HG2      ARG   8 126.056 -12.891  10.755
   64   2HG   ARG   8           HG1      ARG   8 124.728 -12.489   9.666
   65   1HD   ARG   8           HD2      ARG   8 123.599 -14.563  10.161
   66   2HD   ARG   8           HD1      ARG   8 124.988 -15.160  11.071
   67    HE   ARG   8           HE       ARG   8 124.314 -12.831  12.392
   68   1HH1  ARG   8          HH21      ARG   8 122.645 -15.665  11.356
   69   2HH1  ARG   8          HH22      ARG   8 121.509 -15.632  12.663
   70   1HH2  ARG   8          HH11      ARG   8 122.845 -12.777  14.105
   71   2HH2  ARG   8          HH12      ARG   8 121.624 -13.999  14.221
   72    H    ASP   9           HN       ASP   9 126.470 -13.774   5.758
   73    HA   ASP   9           HA       ASP   9 128.717 -15.599   5.546
   74   1HB   ASP   9           HB2      ASP   9 126.745 -14.524   3.528
   75   2HB   ASP   9           HB1      ASP   9 128.041 -15.634   3.088
   76    H    PHE  10           HN       PHE  10 128.092 -12.269   4.502
   77    HA   PHE  10           HA       PHE  10 130.437 -12.034   2.851
   78   1HB   PHE  10           HB2      PHE  10 128.460 -10.466   2.852
   79   2HB   PHE  10           HB1      PHE  10 129.045  -9.824   4.386
   80    HD1  PHE  10           HD2      PHE  10 131.184  -8.588   4.507
   81    HD2  PHE  10           HD1      PHE  10 129.606  -9.999   0.767
   82    HE1  PHE  10           HE2      PHE  10 132.751  -7.103   3.284
   83    HE2  PHE  10           HE1      PHE  10 131.173  -8.512  -0.454
   84    HZ   PHE  10           HZ       PHE  10 132.742  -7.061   0.805
   85    H    VAL  11           HN       VAL  11 129.841 -11.324   6.296
   86    HA   VAL  11           HA       VAL  11 132.611 -10.416   6.675
   87    HB   VAL  11           HB       VAL  11 131.965 -10.111   9.005
   88   1HG1  VAL  11          HG13      VAL  11 129.820  -9.302   7.020
   89   2HG1  VAL  11          HG12      VAL  11 129.940  -8.656   8.655
   90   3HG1  VAL  11          HG11      VAL  11 131.234  -8.360   7.494
   91   1HG2  VAL  11          HG22      VAL  11 129.574 -11.746   8.153
   92   2HG2  VAL  11          HG21      VAL  11 130.693 -12.068   9.475
   93   3HG2  VAL  11          HG23      VAL  11 129.542 -10.736   9.598
   94    H    ALA  12           HN       ALA  12 131.739 -13.312   5.898
   95    HA   ALA  12           HA       ALA  12 133.318 -14.721   8.035
   96   1HB   ALA  12           HB2      ALA  12 131.085 -15.785   6.281
   97   2HB   ALA  12           HB1      ALA  12 132.027 -16.746   7.421
   98   3HB   ALA  12           HB3      ALA  12 130.980 -15.455   8.011
   99    H    GLU  13           HN       GLU  13 133.372 -13.705   4.816
  100    HA   GLU  13           HA       GLU  13 135.659 -15.483   4.281
  101   1HB   GLU  13           HB2      GLU  13 134.778 -16.343   2.176
  102   2HB   GLU  13           HB1      GLU  13 133.659 -16.748   3.476
  103   1HG   GLU  13           HG2      GLU  13 132.403 -14.605   2.879
  104   2HG   GLU  13           HG1      GLU  13 133.391 -14.549   1.418
  105    HA   PRO  14           HA       PRO  14 137.419 -11.886   2.321
  106   1HB   PRO  14           HB2      PRO  14 137.794 -13.630  -0.100
  107   2HB   PRO  14           HB1      PRO  14 138.959 -12.561   0.708
  108   1HG   PRO  14           HG2      PRO  14 139.003 -15.227   1.038
  109   2HG   PRO  14           HG1      PRO  14 139.454 -14.105   2.333
  110   1HD   PRO  14           HD2      PRO  14 137.033 -15.806   2.107
  111   2HD   PRO  14           HD1      PRO  14 137.772 -15.081   3.551
  112    H    MET  15           HN       MET  15 136.925 -10.334   0.578
  113    HA   MET  15           HA       MET  15 134.159 -10.676  -0.453
  114   1HB   MET  15           HB2      MET  15 134.502  -8.235  -1.132
  115   2HB   MET  15           HB1      MET  15 134.499  -8.570   0.598
  116   1HG   MET  15           HG2      MET  15 136.867  -8.408   0.744
  117   2HG   MET  15           HG1      MET  15 137.056  -8.498  -1.007
  118   1HE   MET  15           HE1      MET  15 135.361  -6.800   1.828
  119   2HE   MET  15           HE3      MET  15 136.879  -5.909   1.988
  120   3HE   MET  15           HE2      MET  15 135.407  -5.066   1.516
  121    H    GLY  16           HN       GLY  16 137.470 -10.540  -1.545
  122   1HA   GLY  16           HA2      GLY  16 138.413 -10.812  -3.676
  123   2HA   GLY  16           HA1      GLY  16 136.971 -11.762  -4.036
  124    H    GLU  17           HN       GLU  17 136.371 -11.012  -6.022
  125    HA   GLU  17           HA       GLU  17 136.204  -8.056  -6.463
  126   1HB   GLU  17           HB2      GLU  17 136.333 -10.409  -8.363
  127   2HB   GLU  17           HB1      GLU  17 136.028  -8.751  -8.886
  128   1HG   GLU  17           HG2      GLU  17 138.156  -8.024  -7.912
  129   2HG   GLU  17           HG1      GLU  17 138.460  -9.656  -7.317
  130    H    LYS  18           HN       LYS  18 134.141  -9.664  -4.994
  131    HA   LYS  18           HA       LYS  18 131.886 -10.169  -6.651
  132   1HB   LYS  18           HB2      LYS  18 131.948  -9.173  -3.779
  133   2HB   LYS  18           HB1      LYS  18 130.554  -9.909  -4.564
  134   1HG   LYS  18           HG2      LYS  18 133.170 -11.407  -4.519
  135   2HG   LYS  18           HG1      LYS  18 132.168 -11.386  -3.070
  136   1HD   LYS  18           HD2      LYS  18 130.299 -12.350  -4.264
  137   2HD   LYS  18           HD1      LYS  18 131.146 -12.208  -5.803
  138   1HE   LYS  18           HE2      LYS  18 131.151 -14.513  -4.544
  139   2HE   LYS  18           HE1      LYS  18 132.639 -13.935  -5.296
  140   1HZ   LYS  18           HZ2      LYS  18 133.164 -12.901  -3.086
  141   2HZ   LYS  18           HZ1      LYS  18 131.874 -13.796  -2.437
  142   3HZ   LYS  18           HZ3      LYS  18 133.201 -14.599  -3.124
  143    HA   PRO  19           HA       PRO  19 130.795  -6.071  -7.932
  144   1HB   PRO  19           HB2      PRO  19 128.041  -6.267  -8.136
  145   2HB   PRO  19           HB1      PRO  19 129.177  -6.934  -9.325
  146   1HG   PRO  19           HG2      PRO  19 127.737  -8.318  -7.107
  147   2HG   PRO  19           HG1      PRO  19 128.059  -8.870  -8.761
  148   1HD   PRO  19           HD2      PRO  19 129.522  -9.736  -6.634
  149   2HD   PRO  19           HD1      PRO  19 130.228  -9.552  -8.254
  150    H    VAL  20           HN       VAL  20 129.887  -4.087  -7.210
  151    HA   VAL  20           HA       VAL  20 129.938  -3.601  -4.455
  152    HB   VAL  20           HB       VAL  20 130.111  -1.872  -6.248
  153   1HG1  VAL  20          HG13      VAL  20 128.047  -2.828  -7.469
  154   2HG1  VAL  20          HG12      VAL  20 127.089  -1.904  -6.310
  155   3HG1  VAL  20          HG11      VAL  20 128.200  -1.073  -7.398
  156   1HG2  VAL  20          HG21      VAL  20 129.691  -1.266  -3.878
  157   2HG2  VAL  20          HG23      VAL  20 128.929  -0.126  -4.988
  158   3HG2  VAL  20          HG22      VAL  20 127.955  -1.350  -4.176
  159    H    GLY  21           HN       GLY  21 127.066  -4.113  -6.508
  160   1HA   GLY  21           HA2      GLY  21 125.105  -3.716  -4.509
  161   2HA   GLY  21           HA1      GLY  21 124.877  -4.724  -5.936
  162    H    SER  22           HN       SER  22 127.525  -6.024  -4.485
  163    HA   SER  22           HA       SER  22 125.939  -8.213  -3.342
  164   1HB   SER  22           HB2      SER  22 128.050  -8.599  -4.650
  165   2HB   SER  22           HB1      SER  22 128.948  -7.820  -3.350
  166    HG   SER  22           HG       SER  22 127.573  -9.507  -2.072
  167    H    LEU  23           HN       LEU  23 127.549  -5.359  -2.249
  168    HA   LEU  23           HA       LEU  23 128.061  -6.145   0.462
  169   1HB   LEU  23           HB2      LEU  23 127.461  -3.417  -0.719
  170   2HB   LEU  23           HB1      LEU  23 128.064  -3.688   0.915
  171    HG   LEU  23           HG       LEU  23 129.487  -4.642  -1.588
  172   1HD1  LEU  23          HD12      LEU  23 129.872  -2.135   0.070
  173   2HD1  LEU  23          HD11      LEU  23 131.056  -2.730  -1.094
  174   3HD1  LEU  23          HD13      LEU  23 129.455  -2.230  -1.640
  175   1HD2  LEU  23          HD23      LEU  23 130.103  -4.678   1.367
  176   2HD2  LEU  23          HD22      LEU  23 130.343  -5.943   0.163
  177   3HD2  LEU  23          HD21      LEU  23 131.431  -4.560   0.214
  178    H    ALA  24           HN       ALA  24 126.751  -6.111   2.241
  179    HA   ALA  24           HA       ALA  24 123.919  -6.357   1.855
  180   1HB   ALA  24           HB2      ALA  24 125.094  -7.388   3.765
  181   2HB   ALA  24           HB1      ALA  24 125.447  -5.787   4.410
  182   3HB   ALA  24           HB3      ALA  24 123.780  -6.350   4.318
  183    H    GLY  25           HN       GLY  25 122.324  -4.859   1.913
  184   1HA   GLY  25           HA2      GLY  25 121.308  -2.771   2.651
  185   2HA   GLY  25           HA1      GLY  25 122.920  -2.100   2.898
  186    H    ILE  26           HN       ILE  26 123.641  -3.389   0.163
  187    HA   ILE  26           HA       ILE  26 122.677  -1.074  -1.465
  188    HB   ILE  26           HB       ILE  26 124.801  -3.129  -2.149
  189   1HG1  ILE  26          HG12      ILE  26 125.492  -1.996  -0.114
  190   2HG1  ILE  26          HG11      ILE  26 126.413  -1.329  -1.460
  191   1HG2  ILE  26          HG21      ILE  26 123.781  -1.797  -4.017
  192   2HG2  ILE  26          HG23      ILE  26 124.329  -0.328  -3.209
  193   3HG2  ILE  26          HG22      ILE  26 125.506  -1.500  -3.801
  194   1HD1  ILE  26          HD11      ILE  26 124.496   0.459  -1.559
  195   2HD1  ILE  26          HD13      ILE  26 124.152  -0.078   0.085
  196   3HD1  ILE  26          HD12      ILE  26 125.731   0.598  -0.310
  197    H    GLY  27           HN       GLY  27 120.884  -1.504  -2.744
  198   1HA   GLY  27           HA2      GLY  27 120.260  -4.321  -3.410
  199   2HA   GLY  27           HA1      GLY  27 119.184  -2.940  -3.615
  200    H    GLU  28           HN       GLU  28 119.268  -4.543  -5.730
  201    HA   GLU  28           HA       GLU  28 121.340  -4.229  -7.625
  202   1HB   GLU  28           HB2      GLU  28 118.365  -4.639  -7.991
  203   2HB   GLU  28           HB1      GLU  28 119.513  -4.683  -9.328
  204   1HG   GLU  28           HG2      GLU  28 119.827  -6.399  -6.858
  205   2HG   GLU  28           HG1      GLU  28 118.948  -6.943  -8.287
  206    H    VAL  29           HN       VAL  29 118.509  -2.122  -7.036
  207    HA   VAL  29           HA       VAL  29 119.043  -0.393  -9.280
  208    HB   VAL  29           HB       VAL  29 117.510   0.039  -6.700
  209   1HG1  VAL  29          HG11      VAL  29 117.913   1.858  -9.087
  210   2HG1  VAL  29          HG13      VAL  29 116.529   2.015  -8.004
  211   3HG1  VAL  29          HG12      VAL  29 118.165   2.234  -7.382
  212   1HG2  VAL  29          HG21      VAL  29 116.698  -0.462  -9.581
  213   2HG2  VAL  29          HG23      VAL  29 116.520  -1.585  -8.233
  214   3HG2  VAL  29          HG22      VAL  29 115.570  -0.100  -8.274
  215    H    LEU  30           HN       LEU  30 119.945  -0.233  -5.854
  216    HA   LEU  30           HA       LEU  30 121.311   2.283  -6.046
  217   1HB   LEU  30           HB2      LEU  30 121.753  -0.004  -4.102
  218   2HB   LEU  30           HB1      LEU  30 122.355   1.639  -3.895
  219    HG   LEU  30           HG       LEU  30 119.429   0.856  -4.109
  220   1HD1  LEU  30          HD11      LEU  30 120.540   0.165  -1.987
  221   2HD1  LEU  30          HD13      LEU  30 121.030   1.840  -1.726
  222   3HD1  LEU  30          HD12      LEU  30 119.320   1.412  -1.732
  223   1HD2  LEU  30          HD23      LEU  30 120.875   3.497  -3.932
  224   2HD2  LEU  30          HD22      LEU  30 119.468   3.059  -4.902
  225   3HD2  LEU  30          HD21      LEU  30 119.291   3.334  -3.173
  226    H    GLY  31           HN       GLY  31 122.351  -1.051  -6.549
  227   1HA   GLY  31           HA2      GLY  31 125.152  -0.574  -6.676
  228   2HA   GLY  31           HA1      GLY  31 124.319  -1.884  -7.514
  229    H    LYS  32           HN       LYS  32 122.625  -0.289  -9.172
  230    HA   LYS  32           HA       LYS  32 124.410   0.230 -11.353
  231   1HB   LYS  32           HB2      LYS  32 121.512   0.981 -10.912
  232   2HB   LYS  32           HB1      LYS  32 122.371   1.267 -12.426
  233   1HG   LYS  32           HG2      LYS  32 122.873  -1.142 -12.603
  234   2HG   LYS  32           HG1      LYS  32 122.013  -1.431 -11.091
  235   1HD   LYS  32           HD2      LYS  32 119.936  -0.554 -12.099
  236   2HD   LYS  32           HD1      LYS  32 120.796  -0.270 -13.614
  237   1HE   LYS  32           HE2      LYS  32 121.384  -2.739 -13.618
  238   2HE   LYS  32           HE1      LYS  32 120.250  -2.931 -12.281
  239   1HZ   LYS  32           HZ2      LYS  32 118.513  -1.983 -13.680
  240   2HZ   LYS  32           HZ1      LYS  32 119.609  -1.848 -14.971
  241   3HZ   LYS  32           HZ3      LYS  32 119.176  -3.379 -14.385
  242    H    LYS  33           HN       LYS  33 122.835   2.439  -9.028
  243    HA   LYS  33           HA       LYS  33 123.640   4.843 -10.377
  244   1HB   LYS  33           HB2      LYS  33 122.958   4.272  -7.481
  245   2HB   LYS  33           HB1      LYS  33 123.260   5.895  -8.105
  246   1HG   LYS  33           HG2      LYS  33 121.438   5.608  -9.744
  247   2HG   LYS  33           HG1      LYS  33 121.132   3.988  -9.118
  248   1HD   LYS  33           HD2      LYS  33 120.621   4.937  -6.898
  249   2HD   LYS  33           HD1      LYS  33 120.922   6.559  -7.524
  250   1HE   LYS  33           HE2      LYS  33 118.865   4.694  -8.728
  251   2HE   LYS  33           HE1      LYS  33 118.477   5.859  -7.462
  252   1HZ   LYS  33           HZ3      LYS  33 119.688   6.520 -10.092
  253   2HZ   LYS  33           HZ2      LYS  33 118.057   6.752  -9.675
  254   3HZ   LYS  33           HZ1      LYS  33 119.274   7.632  -8.879
  255    H    LEU  34           HN       LEU  34 125.110   3.070  -7.637
  256    HA   LEU  34           HA       LEU  34 127.366   4.800  -7.357
  257   1HB   LEU  34           HB2      LEU  34 127.011   1.852  -6.734
  258   2HB   LEU  34           HB1      LEU  34 128.443   2.767  -6.286
  259    HG   LEU  34           HG       LEU  34 125.689   3.706  -5.481
  260   1HD1  LEU  34          HD13      LEU  34 127.488   1.697  -4.103
  261   2HD1  LEU  34          HD12      LEU  34 126.229   2.593  -3.252
  262   3HD1  LEU  34          HD11      LEU  34 125.797   1.495  -4.563
  263   1HD2  LEU  34          HD23      LEU  34 128.517   4.188  -4.468
  264   2HD2  LEU  34          HD22      LEU  34 127.409   5.371  -5.156
  265   3HD2  LEU  34          HD21      LEU  34 127.080   4.678  -3.575
  266    H    GLU  35           HN       GLU  35 126.735   2.000  -9.388
  267    HA   GLU  35           HA       GLU  35 129.357   1.693 -10.477
  268   1HB   GLU  35           HB2      GLU  35 127.566   0.036 -10.825
  269   2HB   GLU  35           HB1      GLU  35 126.680   1.190 -11.820
  270   1HG   GLU  35           HG2      GLU  35 128.537   1.241 -13.437
  271   2HG   GLU  35           HG1      GLU  35 129.455   0.121 -12.430
  272    H    GLU  36           HN       GLU  36 126.658   3.761 -11.500
  273    HA   GLU  36           HA       GLU  36 127.994   4.821 -13.823
  274   1HB   GLU  36           HB2      GLU  36 125.539   4.962 -13.483
  275   2HB   GLU  36           HB1      GLU  36 125.800   6.062 -12.131
  276   1HG   GLU  36           HG2      GLU  36 126.861   7.690 -13.616
  277   2HG   GLU  36           HG1      GLU  36 126.706   6.581 -14.979
  278    H    ARG  37           HN       ARG  37 128.293   5.351 -10.458
  279    HA   ARG  37           HA       ARG  37 129.528   8.021 -10.756
  280   1HB   ARG  37           HB2      ARG  37 128.992   6.230  -8.379
  281   2HB   ARG  37           HB1      ARG  37 129.826   7.773  -8.239
  282   1HG   ARG  37           HG2      ARG  37 127.128   7.569  -9.577
  283   2HG   ARG  37           HG1      ARG  37 127.260   7.708  -7.828
  284   1HD   ARG  37           HD2      ARG  37 128.650   9.790  -8.179
  285   2HD   ARG  37           HD1      ARG  37 128.256   9.692  -9.895
  286    HE   ARG  37           HE       ARG  37 125.789   9.580  -8.659
  287   1HH1  ARG  37          HH21      ARG  37 128.544  11.646  -8.540
  288   2HH1  ARG  37          HH22      ARG  37 127.624  13.071  -8.186
  289   1HH2  ARG  37          HH11      ARG  37 124.573  11.424  -8.203
  290   2HH2  ARG  37          HH12      ARG  37 125.374  12.946  -7.996
  291    H    GLY  38           HN       GLY  38 130.615   4.931 -11.283
  292   1HA   GLY  38           HA2      GLY  38 132.932   4.601 -11.955
  293   2HA   GLY  38           HA1      GLY  38 133.436   5.792 -10.766
  294    H    PHE  39           HN       PHE  39 131.157   3.760  -9.330
  295    HA   PHE  39           HA       PHE  39 133.353   2.163  -8.051
  296   1HB   PHE  39           HB2      PHE  39 130.518   2.712  -7.156
  297   2HB   PHE  39           HB1      PHE  39 131.707   1.790  -6.244
  298    HD1  PHE  39           HD1      PHE  39 130.704   5.110  -7.408
  299    HD2  PHE  39           HD2      PHE  39 133.621   2.903  -5.191
  300    HE1  PHE  39           HE1      PHE  39 131.571   7.230  -6.468
  301    HE2  PHE  39           HE2      PHE  39 134.507   5.020  -4.244
  302    HZ   PHE  39           HZ       PHE  39 133.481   7.187  -4.884
  303    H    ASP  40           HN       ASP  40 133.260   0.788 -10.097
  304    HA   ASP  40           HA       ASP  40 130.837  -0.816 -10.475
  305   1HB   ASP  40           HB2      ASP  40 132.070  -1.900 -12.272
  306   2HB   ASP  40           HB1      ASP  40 132.298  -0.154 -12.379
  307    H    LYS  41           HN       LYS  41 133.546  -1.034  -8.403
  308    HA   LYS  41           HA       LYS  41 132.887  -3.909  -7.852
  309   1HB   LYS  41           HB2      LYS  41 135.648  -2.658  -7.791
  310   2HB   LYS  41           HB1      LYS  41 135.260  -4.316  -7.339
  311   1HG   LYS  41           HG2      LYS  41 134.703  -3.152 -10.083
  312   2HG   LYS  41           HG1      LYS  41 136.160  -4.060  -9.688
  313   1HD   LYS  41           HD2      LYS  41 134.509  -5.905  -8.854
  314   2HD   LYS  41           HD1      LYS  41 133.306  -5.036  -9.804
  315   1HE   LYS  41           HE2      LYS  41 134.666  -5.272 -11.817
  316   2HE   LYS  41           HE1      LYS  41 135.941  -6.062 -10.890
  317   1HZ   LYS  41           HZ2      LYS  41 133.426  -7.313 -10.458
  318   2HZ   LYS  41           HZ1      LYS  41 133.803  -7.278 -12.114
  319   3HZ   LYS  41           HZ3      LYS  41 134.882  -7.990 -11.015
  320    H    ALA  42           HN       ALA  42 133.071  -4.539  -5.677
  321    HA   ALA  42           HA       ALA  42 132.225  -2.592  -3.773
  322   1HB   ALA  42           HB1      ALA  42 133.333  -5.384  -3.407
  323   2HB   ALA  42           HB3      ALA  42 132.611  -4.432  -2.109
  324   3HB   ALA  42           HB2      ALA  42 131.635  -4.918  -3.495
  325    H    TYR  43           HN       TYR  43 135.441  -4.045  -4.320
  326    HA   TYR  43           HA       TYR  43 136.646  -2.986  -1.990
  327   1HB   TYR  43           HB2      TYR  43 138.808  -3.308  -3.082
  328   2HB   TYR  43           HB1      TYR  43 137.751  -4.687  -3.360
  329    HD1  TYR  43           HD1      TYR  43 138.966  -1.512  -4.902
  330    HD2  TYR  43           HD2      TYR  43 137.241  -5.390  -5.556
  331    HE1  TYR  43           HE1      TYR  43 139.290  -1.240  -7.344
  332    HE2  TYR  43           HE2      TYR  43 137.560  -5.119  -8.000
  333    HH   TYR  43           HH       TYR  43 138.260  -2.161  -9.443
  334    H    VAL  44           HN       VAL  44 135.626  -1.269  -4.823
  335    HA   VAL  44           HA       VAL  44 137.456   0.992  -4.361
  336    HB   VAL  44           HB       VAL  44 134.903   0.908  -6.012
  337   1HG1  VAL  44          HG12      VAL  44 135.922   3.178  -5.303
  338   2HG1  VAL  44          HG11      VAL  44 137.280   2.753  -6.340
  339   3HG1  VAL  44          HG13      VAL  44 135.666   2.922  -7.027
  340   1HG2  VAL  44          HG21      VAL  44 136.595  -0.766  -6.745
  341   2HG2  VAL  44          HG23      VAL  44 136.372   0.516  -7.934
  342   3HG2  VAL  44          HG22      VAL  44 137.787   0.527  -6.880
  343    H    VAL  45           HN       VAL  45 134.239  -0.013  -3.536
  344    HA   VAL  45           HA       VAL  45 133.452   2.517  -2.277
  345    HB   VAL  45           HB       VAL  45 132.240  -0.259  -2.024
  346   1HG1  VAL  45          HG13      VAL  45 131.238   2.491  -1.230
  347   2HG1  VAL  45          HG12      VAL  45 130.222   1.051  -1.283
  348   3HG1  VAL  45          HG11      VAL  45 131.574   1.133  -0.156
  349   1HG2  VAL  45          HG21      VAL  45 131.782   2.054  -3.915
  350   2HG2  VAL  45          HG23      VAL  45 131.998   0.345  -4.294
  351   3HG2  VAL  45          HG22      VAL  45 130.491   0.904  -3.569
  352    H    LEU  46           HN       LEU  46 134.753  -0.606  -1.273
  353    HA   LEU  46           HA       LEU  46 134.626  -0.215   1.554
  354   1HB   LEU  46           HB2      LEU  46 135.228  -2.384   0.445
  355   2HB   LEU  46           HB1      LEU  46 136.751  -1.667  -0.065
  356    HG   LEU  46           HG       LEU  46 137.179  -1.188   2.429
  357   1HD1  LEU  46          HD11      LEU  46 134.798  -3.033   2.610
  358   2HD1  LEU  46          HD13      LEU  46 135.990  -2.927   3.903
  359   3HD1  LEU  46          HD12      LEU  46 135.067  -1.501   3.441
  360   1HD2  LEU  46          HD21      LEU  46 137.300  -3.814   1.015
  361   2HD2  LEU  46          HD23      LEU  46 138.597  -2.826   1.682
  362   3HD2  LEU  46          HD22      LEU  46 137.620  -3.829   2.749
  363    H    GLY  47           HN       GLY  47 136.908   0.749  -0.940
  364   1HA   GLY  47           HA2      GLY  47 138.974   1.800   0.714
  365   2HA   GLY  47           HA1      GLY  47 138.638   2.340  -0.933
  366    H    GLN  48           HN       GLN  48 135.973   3.283  -0.519
  367    HA   GLN  48           HA       GLN  48 136.466   5.930   0.428
  368   1HB   GLN  48           HB2      GLN  48 134.592   5.323  -1.096
  369   2HB   GLN  48           HB1      GLN  48 133.819   4.451   0.224
  370   1HG   GLN  48           HG2      GLN  48 132.814   6.660   0.048
  371   2HG   GLN  48           HG1      GLN  48 133.755   6.589   1.535
  372   1HE2  GLN  48          HE22      GLN  48 135.816   8.473  -1.456
  373   2HE2  GLN  48          HE21      GLN  48 135.229   6.898  -1.691
  374    H    PHE  49           HN       PHE  49 134.994   3.091   1.976
  375    HA   PHE  49           HA       PHE  49 134.293   4.314   4.453
  376   1HB   PHE  49           HB2      PHE  49 133.525   2.070   3.751
  377   2HB   PHE  49           HB1      PHE  49 135.172   1.462   3.888
  378    HD1  PHE  49           HD1      PHE  49 132.565   3.259   5.892
  379    HD2  PHE  49           HD2      PHE  49 135.861   0.504   5.915
  380    HE1  PHE  49           HE1      PHE  49 132.169   2.805   8.298
  381    HE2  PHE  49           HE2      PHE  49 135.468   0.053   8.318
  382    HZ   PHE  49           HZ       PHE  49 133.622   1.204   9.513
  383    H    LEU  50           HN       LEU  50 137.279   2.821   3.306
  384    HA   LEU  50           HA       LEU  50 138.704   3.107   5.821
  385   1HB   LEU  50           HB2      LEU  50 139.807   2.924   2.997
  386   2HB   LEU  50           HB1      LEU  50 140.747   2.725   4.475
  387    HG   LEU  50           HG       LEU  50 138.422   0.971   3.617
  388   1HD1  LEU  50          HD11      LEU  50 140.453   0.654   2.249
  389   2HD1  LEU  50          HD13      LEU  50 141.407   0.436   3.716
  390   3HD1  LEU  50          HD12      LEU  50 140.169  -0.744   3.287
  391   1HD2  LEU  50          HD22      LEU  50 140.147   1.081   6.091
  392   2HD2  LEU  50          HD21      LEU  50 138.405   0.831   5.962
  393   3HD2  LEU  50          HD23      LEU  50 139.515  -0.470   5.540
  394    H    VAL  51           HN       VAL  51 138.379   5.122   2.933
  395    HA   VAL  51           HA       VAL  51 140.260   7.135   3.718
  396    HB   VAL  51           HB       VAL  51 137.855   7.215   1.877
  397   1HG1  VAL  51          HG11      VAL  51 139.951   9.317   2.478
  398   2HG1  VAL  51          HG13      VAL  51 139.004   9.315   0.989
  399   3HG1  VAL  51          HG12      VAL  51 138.197   9.491   2.547
  400   1HG2  VAL  51          HG22      VAL  51 139.915   5.781   1.358
  401   2HG2  VAL  51          HG21      VAL  51 139.458   6.958   0.127
  402   3HG2  VAL  51          HG23      VAL  51 140.806   7.297   1.214
  403    H    LEU  52           HN       LEU  52 136.910   6.572   4.605
  404    HA   LEU  52           HA       LEU  52 136.606   9.262   5.773
  405   1HB   LEU  52           HB2      LEU  52 134.827   6.812   5.764
  406   2HB   LEU  52           HB1      LEU  52 134.377   8.350   6.495
  407    HG   LEU  52           HG       LEU  52 135.192   8.050   3.589
  408   1HD1  LEU  52          HD11      LEU  52 132.432   8.112   4.848
  409   2HD1  LEU  52          HD13      LEU  52 132.750   8.231   3.116
  410   3HD1  LEU  52          HD12      LEU  52 133.165   6.757   3.990
  411   1HD2  LEU  52          HD23      LEU  52 134.127  10.302   5.298
  412   2HD2  LEU  52          HD22      LEU  52 135.429  10.329   4.109
  413   3HD2  LEU  52          HD21      LEU  52 133.754  10.269   3.575
  414    H    LYS  53           HN       LYS  53 138.478   6.890   6.811
  415    HA   LYS  53           HA       LYS  53 139.097   6.053   8.920
  416   1HB   LYS  53           HB2      LYS  53 138.090   8.821   9.653
  417   2HB   LYS  53           HB1      LYS  53 139.108   7.810  10.681
  418   1HG   LYS  53           HG2      LYS  53 140.854   7.786   8.935
  419   2HG   LYS  53           HG1      LYS  53 139.842   8.798   7.907
  420   1HD   LYS  53           HD2      LYS  53 139.884  10.581   9.614
  421   2HD   LYS  53           HD1      LYS  53 140.901   9.571  10.642
  422   1HE   LYS  53           HE2      LYS  53 142.573   9.483   8.744
  423   2HE   LYS  53           HE1      LYS  53 141.599  10.699   7.919
  424   1HZ   LYS  53           HZ3      LYS  53 141.828  11.969  10.134
  425   2HZ   LYS  53           HZ2      LYS  53 143.150  10.940  10.411
  426   3HZ   LYS  53           HZ1      LYS  53 143.134  11.963   9.054
  427    H    LYS  54           HN       LYS  54 136.494   5.243   8.128
  428    HA   LYS  54           HA       LYS  54 134.580   4.212   8.984
  429   1HB   LYS  54           HB2      LYS  54 136.042   4.550  11.624
  430   2HB   LYS  54           HB1      LYS  54 134.665   3.495  11.336
  431   1HG   LYS  54           HG2      LYS  54 135.960   2.242   9.655
  432   2HG   LYS  54           HG1      LYS  54 137.344   3.301   9.930
  433   1HD   LYS  54           HD2      LYS  54 137.375   2.598  12.317
  434   2HD   LYS  54           HD1      LYS  54 136.048   1.483  11.984
  435   1HE   LYS  54           HE2      LYS  54 138.752   1.418  10.610
  436   2HE   LYS  54           HE1      LYS  54 138.260   0.347  11.922
  437   1HZ   LYS  54           HZ3      LYS  54 136.290  -0.201  10.416
  438   2HZ   LYS  54           HZ2      LYS  54 137.210   0.493   9.167
  439   3HZ   LYS  54           HZ1      LYS  54 137.801  -0.858  10.011
  440    H    ASP  55           HN       ASP  55 134.880   7.320   9.019
  441    HA   ASP  55           HA       ASP  55 133.253   8.177  11.264
  442   1HB   ASP  55           HB2      ASP  55 134.717   9.734   9.999
  443   2HB   ASP  55           HB1      ASP  55 133.679   9.540   8.590
  444    H    GLU  56           HN       GLU  56 131.245   7.340  11.478
  445    HA   GLU  56           HA       GLU  56 129.637   6.268   9.392
  446   1HB   GLU  56           HB2      GLU  56 129.401   5.659  11.765
  447   2HB   GLU  56           HB1      GLU  56 128.775   7.270  12.114
  448   1HG   GLU  56           HG2      GLU  56 126.864   6.881  10.620
  449   2HG   GLU  56           HG1      GLU  56 127.504   5.294  10.192
  450    H    ASP  57           HN       ASP  57 129.502   9.520  10.872
  451    HA   ASP  57           HA       ASP  57 127.048  10.267   9.546
  452   1HB   ASP  57           HB2      ASP  57 129.264  11.909  10.784
  453   2HB   ASP  57           HB1      ASP  57 127.790  12.618  10.125
  454    H    LEU  58           HN       LEU  58 130.447  10.686   8.716
  455    HA   LEU  58           HA       LEU  58 129.887  12.331   6.390
  456   1HB   LEU  58           HB2      LEU  58 132.302  10.651   7.108
  457   2HB   LEU  58           HB1      LEU  58 132.235  11.696   5.694
  458    HG   LEU  58           HG       LEU  58 131.771  12.667   8.532
  459   1HD1  LEU  58          HD12      LEU  58 134.271  12.722   6.816
  460   2HD1  LEU  58          HD11      LEU  58 134.072  13.647   8.303
  461   3HD1  LEU  58          HD13      LEU  58 134.064  11.884   8.352
  462   1HD2  LEU  58          HD22      LEU  58 131.932  13.988   5.823
  463   2HD2  LEU  58          HD21      LEU  58 130.803  14.289   7.143
  464   3HD2  LEU  58          HD23      LEU  58 132.456  14.881   7.248
  465    H    PHE  59           HN       PHE  59 130.258   8.858   6.915
  466    HA   PHE  59           HA       PHE  59 130.181   8.090   4.150
  467   1HB   PHE  59           HB2      PHE  59 130.866   6.537   5.938
  468   2HB   PHE  59           HB1      PHE  59 129.238   6.585   6.614
  469    HD1  PHE  59           HD1      PHE  59 131.125   5.744   3.496
  470    HD2  PHE  59           HD2      PHE  59 127.571   5.109   5.824
  471    HE1  PHE  59           HE1      PHE  59 130.446   3.922   1.959
  472    HE2  PHE  59           HE2      PHE  59 126.890   3.286   4.284
  473    HZ   PHE  59           HZ       PHE  59 128.328   2.692   2.352
  474    H    ARG  60           HN       ARG  60 127.606   8.449   6.594
  475    HA   ARG  60           HA       ARG  60 125.447   7.617   4.958
  476   1HB   ARG  60           HB2      ARG  60 125.548   9.570   7.265
  477   2HB   ARG  60           HB1      ARG  60 124.043   9.046   6.510
  478   1HG   ARG  60           HG2      ARG  60 124.486   6.739   7.090
  479   2HG   ARG  60           HG1      ARG  60 126.092   7.147   7.683
  480   1HD   ARG  60           HD2      ARG  60 124.449   6.894   9.535
  481   2HD   ARG  60           HD1      ARG  60 125.113   8.526   9.458
  482    HE   ARG  60           HE       ARG  60 122.813   8.666   7.912
  483   1HH1  ARG  60          HH21      ARG  60 123.620   7.612  11.095
  484   2HH1  ARG  60          HH22      ARG  60 122.088   8.051  11.772
  485   1HH2  ARG  60          HH11      ARG  60 120.809   9.247   8.779
  486   2HH2  ARG  60          HH12      ARG  60 120.497   8.977  10.461
  487    H    GLU  61           HN       GLU  61 126.681  10.966   5.481
  488    HA   GLU  61           HA       GLU  61 124.764  12.162   3.722
  489   1HB   GLU  61           HB2      GLU  61 126.164  13.433   5.363
  490   2HB   GLU  61           HB1      GLU  61 127.575  13.114   4.358
  491   1HG   GLU  61           HG2      GLU  61 126.707  15.331   3.833
  492   2HG   GLU  61           HG1      GLU  61 126.430  14.266   2.456
  493    H    TRP  62           HN       TRP  62 128.016  10.806   3.192
  494    HA   TRP  62           HA       TRP  62 128.239  11.598   0.458
  495   1HB   TRP  62           HB2      TRP  62 130.212  10.853   1.604
  496   2HB   TRP  62           HB1      TRP  62 129.468   9.303   1.999
  497    HD1  TRP  62           HD1      TRP  62 130.910  11.265  -0.962
  498    HE1  TRP  62           HE1      TRP  62 131.431   9.611  -2.873
  499    HE3  TRP  62           HE3      TRP  62 128.907   6.996   0.999
  500    HZ2  TRP  62           HZ2      TRP  62 131.037   6.831  -3.488
  501    HZ3  TRP  62           HZ3      TRP  62 129.008   4.867  -0.259
  502    HH2  TRP  62           HH2      TRP  62 130.064   4.780  -2.497
  503    H    LEU  63           HN       LEU  63 127.072   8.525   1.871
  504    HA   LEU  63           HA       LEU  63 126.524   7.311  -0.668
  505   1HB   LEU  63           HB2      LEU  63 126.773   6.009   1.407
  506   2HB   LEU  63           HB1      LEU  63 125.316   6.754   2.057
  507    HG   LEU  63           HG       LEU  63 124.007   5.771   0.189
  508   1HD1  LEU  63          HD12      LEU  63 126.726   4.770  -0.611
  509   2HD1  LEU  63          HD11      LEU  63 125.296   3.826  -1.017
  510   3HD1  LEU  63          HD13      LEU  63 125.462   5.474  -1.616
  511   1HD2  LEU  63          HD22      LEU  63 124.359   4.601   2.397
  512   2HD2  LEU  63          HD21      LEU  63 123.993   3.516   1.055
  513   3HD2  LEU  63          HD23      LEU  63 125.652   3.679   1.632
  514    H    LYS  64           HN       LYS  64 124.447   9.081   1.609
  515    HA   LYS  64           HA       LYS  64 122.021   8.752   0.170
  516   1HB   LYS  64           HB2      LYS  64 122.140   9.630   2.491
  517   2HB   LYS  64           HB1      LYS  64 122.906  11.095   1.890
  518   1HG   LYS  64           HG2      LYS  64 120.590  11.621   2.206
  519   2HG   LYS  64           HG1      LYS  64 120.820  11.471   0.469
  520   1HD   LYS  64           HD2      LYS  64 119.826   9.283   0.438
  521   2HD   LYS  64           HD1      LYS  64 119.861   9.175   2.198
  522   1HE   LYS  64           HE2      LYS  64 117.603   9.715   1.526
  523   2HE   LYS  64           HE1      LYS  64 118.301  11.155   2.266
  524   1HZ   LYS  64           HZ1      LYS  64 118.608  10.796  -0.622
  525   2HZ   LYS  64           HZ3      LYS  64 117.085  11.260  -0.039
  526   3HZ   LYS  64           HZ2      LYS  64 118.445  12.226   0.281
  527    H    ASP  65           HN       ASP  65 124.404  11.389   0.033
  528    HA   ASP  65           HA       ASP  65 123.040  12.806  -2.071
  529   1HB   ASP  65           HB2      ASP  65 125.866  12.904  -1.007
  530   2HB   ASP  65           HB1      ASP  65 125.325  13.932  -2.334
  531    H    THR  66           HN       THR  66 125.394  10.188  -2.047
  532    HA   THR  66           HA       THR  66 126.092  10.502  -4.835
  533    HB   THR  66           HB       THR  66 126.444   8.087  -3.039
  534    HG1  THR  66           HG1      THR  66 128.661   9.478  -3.520
  535   1HG2  THR  66          HG23      THR  66 127.785   8.931  -5.623
  536   2HG2  THR  66          HG22      THR  66 128.271   7.554  -4.636
  537   3HG2  THR  66          HG21      THR  66 126.693   7.562  -5.421
  538    H    CYS  67           HN       CYS  67 123.727   8.384  -3.118
  539    HA   CYS  67           HA       CYS  67 122.693   7.633  -5.851
  540   1HB   CYS  67           HB2      CYS  67 122.162   5.403  -4.895
  541   2HB   CYS  67           HB1      CYS  67 123.893   5.741  -4.909
  542    HG   CYS  67           HG       CYS  67 122.521   6.500  -2.270
  543    H    GLY  68           HN       GLY  68 121.876   8.352  -2.489
  544   1HA   GLY  68           HA2      GLY  68 119.769   9.469  -1.964
  545   2HA   GLY  68           HA1      GLY  68 119.019   8.649  -3.336
  546    H    ALA  69           HN       ALA  69 121.154   6.670  -1.530
  547    HA   ALA  69           HA       ALA  69 119.263   4.707  -0.871
  548   1HB   ALA  69           HB2      ALA  69 121.722   4.385  -0.716
  549   2HB   ALA  69           HB1      ALA  69 121.753   5.426   0.708
  550   3HB   ALA  69           HB3      ALA  69 120.903   3.882   0.764
  551    H    ASN  70           HN       ASN  70 118.201   4.196   1.201
  552    HA   ASN  70           HA       ASN  70 117.260   6.642   2.540
  553   1HB   ASN  70           HB2      ASN  70 115.626   4.934   1.920
  554   2HB   ASN  70           HB1      ASN  70 116.493   3.728   2.871
  555   1HD2  ASN  70          HD22      ASN  70 114.758   6.756   5.055
  556   2HD2  ASN  70          HD21      ASN  70 115.565   7.138   3.612
  557    H    ALA  71           HN       ALA  71 117.009   6.532   4.966
  558    HA   ALA  71           HA       ALA  71 119.547   6.374   6.236
  559   1HB   ALA  71           HB1      ALA  71 116.741   6.433   7.370
  560   2HB   ALA  71           HB3      ALA  71 118.194   6.567   8.361
  561   3HB   ALA  71           HB2      ALA  71 117.835   7.801   7.153
  562    H    LYS  72           HN       LYS  72 116.922   3.999   5.990
  563    HA   LYS  72           HA       LYS  72 118.011   2.229   8.000
  564   1HB   LYS  72           HB2      LYS  72 115.639   2.153   7.253
  565   2HB   LYS  72           HB1      LYS  72 116.171   1.596   5.668
  566   1HG   LYS  72           HG2      LYS  72 117.191  -0.403   6.718
  567   2HG   LYS  72           HG1      LYS  72 116.641   0.156   8.297
  568   1HD   LYS  72           HD2      LYS  72 114.301   0.060   7.519
  569   2HD   LYS  72           HD1      LYS  72 114.853  -0.499   5.939
  570   1HE   LYS  72           HE2      LYS  72 115.937  -2.456   7.080
  571   2HE   LYS  72           HE1      LYS  72 115.185  -1.933   8.587
  572   1HZ   LYS  72           HZ1      LYS  72 113.121  -1.921   6.845
  573   2HZ   LYS  72           HZ3      LYS  72 114.018  -3.261   6.318
  574   3HZ   LYS  72           HZ2      LYS  72 113.479  -3.183   7.927
  575    H    GLN  73           HN       GLN  73 118.287   2.407   4.469
  576    HA   GLN  73           HA       GLN  73 119.778  -0.013   4.153
  577   1HB   GLN  73           HB2      GLN  73 119.576   2.482   2.447
  578   2HB   GLN  73           HB1      GLN  73 120.440   1.028   1.944
  579   1HG   GLN  73           HG2      GLN  73 118.373  -0.295   2.205
  580   2HG   GLN  73           HG1      GLN  73 117.507   1.157   2.703
  581   1HE2  GLN  73          HE22      GLN  73 117.722   0.390  -1.181
  582   2HE2  GLN  73          HE21      GLN  73 117.928  -0.762   0.050
  583    H    SER  74           HN       SER  74 120.755   3.328   4.815
  584    HA   SER  74           HA       SER  74 123.547   2.894   4.361
  585   1HB   SER  74           HB2      SER  74 122.355   5.128   4.497
  586   2HB   SER  74           HB1      SER  74 122.313   4.912   6.245
  587    HG   SER  74           HG       SER  74 124.506   4.968   6.302
  588    H    ARG  75           HN       ARG  75 121.498   2.589   7.278
  589    HA   ARG  75           HA       ARG  75 123.633   2.250   9.128
  590   1HB   ARG  75           HB2      ARG  75 120.805   1.163   9.144
  591   2HB   ARG  75           HB1      ARG  75 121.921   0.979  10.499
  592   1HG   ARG  75           HG2      ARG  75 122.186   3.456  10.575
  593   2HG   ARG  75           HG1      ARG  75 120.983   3.599   9.294
  594   1HD   ARG  75           HD2      ARG  75 120.523   2.354  12.021
  595   2HD   ARG  75           HD1      ARG  75 119.936   3.930  11.495
  596    HE   ARG  75           HE       ARG  75 118.933   2.167   9.598
  597   1HH1  ARG  75          HH21      ARG  75 118.899   2.482  13.028
  598   2HH1  ARG  75          HH22      ARG  75 117.362   1.709  13.221
  599   1HH2  ARG  75          HH11      ARG  75 116.923   1.148   9.826
  600   2HH2  ARG  75          HH12      ARG  75 116.242   0.952  11.406
  601    H    ASP  76           HN       ASP  76 121.998  -0.112   7.011
  602    HA   ASP  76           HA       ASP  76 123.292  -2.400   8.144
  603   1HB   ASP  76           HB2      ASP  76 122.070  -1.904   5.421
  604   2HB   ASP  76           HB1      ASP  76 122.682  -3.478   5.934
  605    H    CYS  77           HN       CYS  77 124.250  -0.232   5.466
  606    HA   CYS  77           HA       CYS  77 126.467  -1.845   4.623
  607   1HB   CYS  77           HB2      CYS  77 125.888   1.113   4.360
  608   2HB   CYS  77           HB1      CYS  77 127.287   0.333   3.622
  609    HG   CYS  77           HG       CYS  77 124.842  -1.199   2.822
  610    H    PHE  78           HN       PHE  78 126.200   0.799   7.032
  611    HA   PHE  78           HA       PHE  78 128.983   1.081   7.507
  612   1HB   PHE  78           HB2      PHE  78 127.306   2.628   8.436
  613   2HB   PHE  78           HB1      PHE  78 126.703   1.349   9.490
  614    HD1  PHE  78           HD1      PHE  78 129.488   3.674   8.834
  615    HD2  PHE  78           HD2      PHE  78 128.002   0.572  11.408
  616    HE1  PHE  78           HE1      PHE  78 131.210   4.250  10.523
  617    HE2  PHE  78           HE2      PHE  78 129.725   1.147  13.096
  618    HZ   PHE  78           HZ       PHE  78 131.329   2.987  12.653
  619    H    GLY  79           HN       GLY  79 126.673  -0.870   9.445
  620   1HA   GLY  79           HA2      GLY  79 128.680  -2.194  10.960
  621   2HA   GLY  79           HA1      GLY  79 127.038  -2.790  10.722
  622    H    CYS  80           HN       CYS  80 127.301  -2.933   7.795
  623    HA   CYS  80           HA       CYS  80 128.365  -5.614   7.627
  624   1HB   CYS  80           HB2      CYS  80 126.563  -4.739   6.149
  625   2HB   CYS  80           HB1      CYS  80 127.742  -3.680   5.378
  626    HG   CYS  80           HG       CYS  80 128.084  -6.790   5.298
  627    H    LEU  81           HN       LEU  81 129.544  -2.493   6.301
  628    HA   LEU  81           HA       LEU  81 132.014  -3.657   5.354
  629   1HB   LEU  81           HB2      LEU  81 131.321  -0.766   5.970
  630   2HB   LEU  81           HB1      LEU  81 132.725  -1.308   5.049
  631    HG   LEU  81           HG       LEU  81 129.831  -1.822   4.287
  632   1HD1  LEU  81          HD11      LEU  81 130.487   0.551   4.061
  633   2HD1  LEU  81          HD13      LEU  81 131.882   0.069   3.094
  634   3HD1  LEU  81          HD12      LEU  81 130.250  -0.201   2.484
  635   1HD2  LEU  81          HD21      LEU  81 132.484  -2.657   3.126
  636   2HD2  LEU  81          HD23      LEU  81 130.993  -3.586   3.283
  637   3HD2  LEU  81          HD22      LEU  81 131.133  -2.353   2.034
  638    H    ARG  82           HN       ARG  82 131.059  -1.952   8.326
  639    HA   ARG  82           HA       ARG  82 133.689  -1.742   9.427
  640   1HB   ARG  82           HB2      ARG  82 131.730  -0.507  10.324
  641   2HB   ARG  82           HB1      ARG  82 131.081  -2.029  10.939
  642   1HG   ARG  82           HG2      ARG  82 133.046  -2.342  12.356
  643   2HG   ARG  82           HG1      ARG  82 133.793  -0.895  11.684
  644   1HD   ARG  82           HD2      ARG  82 131.976   0.484  12.603
  645   2HD   ARG  82           HD1      ARG  82 131.197  -0.962  13.250
  646    HE   ARG  82           HE       ARG  82 133.748  -1.046  14.329
  647   1HH1  ARG  82          HH21      ARG  82 131.201   1.269  14.149
  648   2HH1  ARG  82          HH22      ARG  82 131.572   1.991  15.679
  649   1HH2  ARG  82          HH11      ARG  82 134.246  -0.123  16.323
  650   2HH2  ARG  82          HH12      ARG  82 133.297   1.201  16.913
  651    H    GLU  83           HN       GLU  83 131.268  -4.349   9.663
  652    HA   GLU  83           HA       GLU  83 132.775  -5.892  11.559
  653   1HB   GLU  83           HB2      GLU  83 130.568  -6.614   9.623
  654   2HB   GLU  83           HB1      GLU  83 131.281  -7.785  10.733
  655   1HG   GLU  83           HG2      GLU  83 130.125  -5.141  11.650
  656   2HG   GLU  83           HG1      GLU  83 129.187  -6.632  11.593
  657    H    TRP  84           HN       TRP  84 132.683  -5.916   7.984
  658    HA   TRP  84           HA       TRP  84 134.293  -8.245   7.637
  659   1HB   TRP  84           HB2      TRP  84 133.037  -7.047   5.812
  660   2HB   TRP  84           HB1      TRP  84 134.251  -5.769   5.882
  661    HD1  TRP  84           HD1      TRP  84 133.718  -9.358   4.772
  662    HE1  TRP  84           HE1      TRP  84 135.733 -10.111   3.348
  663    HE3  TRP  84           HE3      TRP  84 136.856  -5.393   5.502
  664    HZ2  TRP  84           HZ2      TRP  84 138.324  -9.165   2.621
  665    HZ3  TRP  84           HZ3      TRP  84 139.091  -5.350   4.435
  666    HH2  TRP  84           HH2      TRP  84 139.829  -7.230   2.995
  667    H    CYS  85           HN       CYS  85 135.134  -4.803   7.997
  668    HA   CYS  85           HA       CYS  85 137.949  -5.071   7.681
  669   1HB   CYS  85           HB2      CYS  85 136.225  -3.104   9.192
  670   2HB   CYS  85           HB1      CYS  85 137.983  -2.966   9.183
  671    HG   CYS  85           HG       CYS  85 137.789  -1.932   6.950
  672    H    ASP  86           HN       ASP  86 135.899  -5.385  10.562
  673    HA   ASP  86           HA       ASP  86 137.985  -5.668  12.475
  674   1HB   ASP  86           HB2      ASP  86 135.164  -6.761  12.406
  675   2HB   ASP  86           HB1      ASP  86 136.233  -6.949  13.797
  676    H    ALA  87           HN       ALA  87 136.581  -7.980  10.213
  677    HA   ALA  87           HA       ALA  87 137.986 -10.243  11.472
  678   1HB   ALA  87           HB2      ALA  87 135.693 -10.343  10.292
  679   2HB   ALA  87           HB1      ALA  87 136.608 -10.287   8.783
  680   3HB   ALA  87           HB3      ALA  87 136.852 -11.618   9.915
  681    H    PHE  88           HN       PHE  88 138.315  -8.222   8.581
  682    HA   PHE  88           HA       PHE  88 140.817  -9.707   7.867
  683   1HB   PHE  88           HB2      PHE  88 139.062  -7.827   6.267
  684   2HB   PHE  88           HB1      PHE  88 140.571  -8.524   5.677
  685    HD1  PHE  88           HD2      PHE  88 140.793 -11.001   5.423
  686    HD2  PHE  88           HD1      PHE  88 137.049  -9.134   6.392
  687    HE1  PHE  88           HE2      PHE  88 139.593 -13.072   4.780
  688    HE2  PHE  88           HE1      PHE  88 135.848 -11.205   5.750
  689    HZ   PHE  88           HZ       PHE  88 137.120 -13.173   4.940
  690    H    LEU  89           HN       LEU  89 140.085  -6.402   6.922
  691    HA   LEU  89           HA       LEU  89 142.705  -5.551   7.965
  692   1HB   LEU  89           HB2      LEU  89 142.116  -4.765   5.759
  693   2HB   LEU  89           HB1      LEU  89 140.570  -4.151   6.329
  694    HG   LEU  89           HG       LEU  89 141.673  -2.444   7.664
  695   1HD1  LEU  89          HD11      LEU  89 144.170  -3.951   6.869
  696   2HD1  LEU  89          HD13      LEU  89 144.244  -2.259   7.368
  697   3HD1  LEU  89          HD12      LEU  89 143.638  -3.481   8.484
  698   1HD2  LEU  89          HD22      LEU  89 141.349  -2.113   5.167
  699   2HD2  LEU  89          HD21      LEU  89 142.596  -1.099   5.897
  700   3HD2  LEU  89          HD23      LEU  89 143.052  -2.529   4.968
  701   1H    MET   1           HT1      MET   1 165.590  -8.412  -3.874
  702   2H    MET   1           HT3      MET   1 165.331 -10.040  -3.480
  703   3H    MET   1           HT2      MET   1 164.926  -8.823  -2.366
  704    HA   MET   1           HA       MET   1 166.941  -9.758  -1.605
  705   1HB   MET   1           HB2      MET   1 168.910  -9.892  -3.115
  706   2HB   MET   1           HB1      MET   1 167.572 -10.882  -3.697
  707   1HG   MET   1           HG2      MET   1 166.888  -8.903  -5.143
  708   2HG   MET   1           HG1      MET   1 168.425  -8.157  -4.704
  709   1HE   MET   1           HE1      MET   1 166.627 -11.153  -5.815
  710   2HE   MET   1           HE3      MET   1 166.813 -10.528  -7.460
  711   3HE   MET   1           HE2      MET   1 167.634 -12.010  -6.977
  712    H    THR   2           HN       THR   2 166.152  -6.948  -3.449
  713    HA   THR   2           HA       THR   2 168.354  -5.366  -2.189
  714    HB   THR   2           HB       THR   2 166.362  -4.565  -4.329
  715    HG1  THR   2           HG1      THR   2 167.963  -5.020  -5.747
  716   1HG2  THR   2          HG21      THR   2 168.853  -3.254  -3.217
  717   2HG2  THR   2          HG23      THR   2 168.037  -2.725  -4.687
  718   3HG2  THR   2          HG22      THR   2 167.203  -2.639  -3.135
  719    H    THR   3           HN       THR   3 164.933  -5.928  -1.996
  720    HA   THR   3           HA       THR   3 164.232  -3.392  -0.797
  721    HB   THR   3           HB       THR   3 162.133  -4.510  -0.183
  722    HG1  THR   3           HG1      THR   3 162.604  -6.505   0.417
  723   1HG2  THR   3          HG23      THR   3 162.453  -3.767  -2.515
  724   2HG2  THR   3          HG22      THR   3 163.138  -5.341  -2.919
  725   3HG2  THR   3          HG21      THR   3 161.446  -5.213  -2.439
  726    H    SER   4           HN       SER   4 163.718  -3.024   1.454
  727    HA   SER   4           HA       SER   4 165.640  -4.239   3.270
  728   1HB   SER   4           HB2      SER   4 165.154  -1.949   3.699
  729   2HB   SER   4           HB1      SER   4 163.416  -2.219   3.608
  730    HG   SER   4           HG       SER   4 165.085  -3.460   5.533
  731    H    GLN   5           HN       GLN   5 164.884  -5.176   5.376
  732    HA   GLN   5           HA       GLN   5 163.270  -7.479   4.942
  733   1HB   GLN   5           HB2      GLN   5 164.175  -6.107   7.484
  734   2HB   GLN   5           HB1      GLN   5 163.335  -7.658   7.466
  735   1HG   GLN   5           HG2      GLN   5 165.103  -8.625   6.064
  736   2HG   GLN   5           HG1      GLN   5 165.936  -7.070   6.022
  737   1HE2  GLN   5          HE22      GLN   5 167.384  -9.185   8.786
  738   2HE2  GLN   5          HE21      GLN   5 167.177  -9.428   7.119
  739    H    LYS   6           HN       LYS   6 162.387  -4.227   5.880
  740    HA   LYS   6           HA       LYS   6 159.946  -4.758   7.228
  741   1HB   LYS   6           HB2      LYS   6 160.840  -2.442   5.495
  742   2HB   LYS   6           HB1      LYS   6 159.330  -2.442   6.408
  743   1HG   LYS   6           HG2      LYS   6 160.590  -2.808   8.497
  744   2HG   LYS   6           HG1      LYS   6 162.100  -2.805   7.585
  745   1HD   LYS   6           HD2      LYS   6 161.650  -0.496   6.839
  746   2HD   LYS   6           HD1      LYS   6 160.141  -0.497   7.755
  747   1HE   LYS   6           HE2      LYS   6 162.847  -1.008   9.013
  748   2HE   LYS   6           HE1      LYS   6 162.091   0.585   8.950
  749   1HZ   LYS   6           HZ3      LYS   6 160.351  -1.499   9.905
  750   2HZ   LYS   6           HZ2      LYS   6 161.704  -1.238  10.899
  751   3HZ   LYS   6           HZ1      LYS   6 160.647   0.044  10.544
  752    H    HIS   7           HN       HIS   7 160.707  -4.510   3.770
  753    HA   HIS   7           HA       HIS   7 158.045  -4.454   2.804
  754   1HB   HIS   7           HB2      HIS   7 159.839  -4.017   1.275
  755   2HB   HIS   7           HB1      HIS   7 160.597  -5.570   1.619
  756    HD2  HIS   7           HD2      HIS   7 159.507  -7.764   0.222
  757    HE1  HIS   7           HE1      HIS   7 156.627  -5.575  -1.955
  758    HE2  HIS   7           HE2      HIS   7 157.747  -7.836  -1.699
  759    H    ARG   8           HN       ARG   8 160.146  -7.313   3.360
  760    HA   ARG   8           HA       ARG   8 158.084  -9.195   2.686
  761   1HB   ARG   8           HB2      ARG   8 160.686  -9.459   4.210
  762   2HB   ARG   8           HB1      ARG   8 159.635 -10.832   3.852
  763   1HG   ARG   8           HG2      ARG   8 159.820 -10.375   1.449
  764   2HG   ARG   8           HG1      ARG   8 160.814  -8.957   1.781
  765   1HD   ARG   8           HD2      ARG   8 162.578 -10.319   2.706
  766   2HD   ARG   8           HD1      ARG   8 161.563 -11.761   2.649
  767    HE   ARG   8           HE       ARG   8 161.647 -10.935   0.015
  768   1HH1  ARG   8          HH21      ARG   8 163.964 -11.576   2.486
  769   2HH1  ARG   8          HH22      ARG   8 165.187 -12.112   1.384
  770   1HH2  ARG   8          HH11      ARG   8 163.228 -11.637  -1.437
  771   2HH2  ARG   8          HH12      ARG   8 164.771 -12.146  -0.838
  772    H    ASP   9           HN       ASP   9 159.078  -7.641   5.679
  773    HA   ASP   9           HA       ASP   9 157.494  -9.380   7.380
  774   1HB   ASP   9           HB2      ASP   9 158.775  -6.681   7.821
  775   2HB   ASP   9           HB1      ASP   9 157.836  -7.498   9.069
  776    H    PHE  10           HN       PHE  10 156.931  -6.280   5.753
  777    HA   PHE  10           HA       PHE  10 154.441  -5.702   7.072
  778   1HB   PHE  10           HB2      PHE  10 155.821  -4.068   5.735
  779   2HB   PHE  10           HB1      PHE  10 155.267  -4.885   4.274
  780    HD1  PHE  10           HD2      PHE  10 152.884  -4.815   3.612
  781    HD2  PHE  10           HD1      PHE  10 154.334  -2.675   7.044
  782    HE1  PHE  10           HE2      PHE  10 150.795  -3.477   3.661
  783    HE2  PHE  10           HE1      PHE  10 152.247  -1.336   7.092
  784    HZ   PHE  10           HZ       PHE  10 150.479  -1.734   5.398
  785    H    VAL  11           HN       VAL  11 155.212  -7.432   4.049
  786    HA   VAL  11           HA       VAL  11 152.366  -7.943   3.517
  787    HB   VAL  11           HB       VAL  11 153.171  -9.150   1.558
  788   1HG1  VAL  11          HG13      VAL  11 154.700  -6.596   2.138
  789   2HG1  VAL  11          HG12      VAL  11 154.588  -7.336   0.540
  790   3HG1  VAL  11          HG11      VAL  11 153.134  -6.734   1.339
  791   1HG2  VAL  11          HG22      VAL  11 155.823  -8.908   2.978
  792   2HG2  VAL  11          HG21      VAL  11 155.030 -10.373   2.402
  793   3HG2  VAL  11          HG23      VAL  11 155.721  -9.232   1.247
  794    H    ALA  12           HN       ALA  12 153.980  -9.042   5.950
  795    HA   ALA  12           HA       ALA  12 153.194 -11.923   5.600
  796   1HB   ALA  12           HB2      ALA  12 155.407 -10.730   7.293
  797   2HB   ALA  12           HB1      ALA  12 154.957 -12.435   7.265
  798   3HB   ALA  12           HB3      ALA  12 155.621 -11.674   5.819
  799    H    GLU  13           HN       GLU  13 152.429  -9.053   7.204
  800    HA   GLU  13           HA       GLU  13 150.750 -10.550   9.106
  801   1HB   GLU  13           HB2      GLU  13 151.583  -9.392  11.085
  802   2HB   GLU  13           HB1      GLU  13 152.923 -10.218  10.293
  803   1HG   GLU  13           HG2      GLU  13 153.385  -8.020   9.079
  804   2HG   GLU  13           HG1      GLU  13 152.252  -7.271  10.205
  805    HA   PRO  14           HA       PRO  14 147.741  -7.371   8.256
  806   1HB   PRO  14           HB2      PRO  14 147.623  -6.961  11.234
  807   2HB   PRO  14           HB1      PRO  14 146.295  -7.170  10.073
  808   1HG   PRO  14           HG2      PRO  14 147.114  -9.163  11.678
  809   2HG   PRO  14           HG1      PRO  14 146.503  -9.457  10.041
  810   1HD   PRO  14           HD2      PRO  14 149.282  -9.682  11.059
  811   2HD   PRO  14           HD1      PRO  14 148.541 -10.425   9.624
  812    H    MET  15           HN       MET  15 147.513  -4.998   8.366
  813    HA   MET  15           HA       MET  15 150.099  -3.668   8.977
  814   1HB   MET  15           HB2      MET  15 148.941  -1.702   7.825
  815   2HB   MET  15           HB1      MET  15 149.262  -3.114   6.822
  816   1HG   MET  15           HG2      MET  15 146.997  -3.832   6.915
  817   2HG   MET  15           HG1      MET  15 146.627  -2.739   8.250
  818   1HE   MET  15           HE1      MET  15 148.059  -3.063   4.835
  819   2HE   MET  15           HE3      MET  15 146.370  -3.056   4.310
  820   3HE   MET  15           HE2      MET  15 147.438  -1.726   3.870
  821    H    GLY  16           HN       GLY  16 146.802  -3.842  10.096
  822   1HA   GLY  16           HA2      GLY  16 145.729  -2.838  11.924
  823   2HA   GLY  16           HA1      GLY  16 147.335  -2.774  12.649
  824    H    GLU  17           HN       GLU  17 147.421  -0.727  13.473
  825    HA   GLU  17           HA       GLU  17 146.616   1.569  11.731
  826   1HB   GLU  17           HB2      GLU  17 146.982   1.295  14.722
  827   2HB   GLU  17           HB1      GLU  17 146.694   2.837  13.915
  828   1HG   GLU  17           HG2      GLU  17 144.585   1.992  12.994
  829   2HG   GLU  17           HG1      GLU  17 144.875   0.418  13.735
  830    H    LYS  18           HN       LYS  18 149.241   0.129  11.520
  831    HA   LYS  18           HA       LYS  18 151.316   1.629  12.756
  832   1HB   LYS  18           HB2      LYS  18 151.309   0.284  10.029
  833   2HB   LYS  18           HB1      LYS  18 152.752   0.765  10.914
  834   1HG   LYS  18           HG2      LYS  18 150.751  -1.047  12.254
  835   2HG   LYS  18           HG1      LYS  18 151.869  -1.725  11.074
  836   1HD   LYS  18           HD2      LYS  18 153.782  -0.966  12.343
  837   2HD   LYS  18           HD1      LYS  18 152.748  -0.069  13.456
  838   1HE   LYS  18           HE2      LYS  18 153.611  -2.455  14.142
  839   2HE   LYS  18           HE1      LYS  18 151.937  -2.009  14.479
  840   1HZ   LYS  18           HZ2      LYS  18 151.392  -3.013  12.259
  841   2HZ   LYS  18           HZ1      LYS  18 152.964  -3.657  12.242
  842   3HZ   LYS  18           HZ3      LYS  18 151.874  -4.114  13.459
  843    HA   PRO  19           HA       PRO  19 150.924   5.536  10.704
  844   1HB   PRO  19           HB2      PRO  19 153.554   6.392  10.627
  845   2HB   PRO  19           HB1      PRO  19 152.541   6.423  12.083
  846   1HG   PRO  19           HG2      PRO  19 154.605   4.429  11.261
  847   2HG   PRO  19           HG1      PRO  19 154.265   5.104  12.865
  848   1HD   PRO  19           HD2      PRO  19 153.418   2.623  12.130
  849   2HD   PRO  19           HD1      PRO  19 152.496   3.641  13.256
  850    H    VAL  20           HN       VAL  20 151.260   6.619   8.705
  851    HA   VAL  20           HA       VAL  20 151.407   5.024   6.411
  852    HB   VAL  20           HB       VAL  20 150.490   7.343   6.524
  853   1HG1  VAL  20          HG13      VAL  20 152.581   8.187   7.783
  854   2HG1  VAL  20          HG12      VAL  20 153.343   8.287   6.195
  855   3HG1  VAL  20          HG11      VAL  20 151.903   9.244   6.545
  856   1HG2  VAL  20          HG21      VAL  20 150.997   6.236   4.361
  857   2HG2  VAL  20          HG23      VAL  20 151.224   7.983   4.270
  858   3HG2  VAL  20          HG22      VAL  20 152.623   6.918   4.407
  859    H    GLY  21           HN       GLY  21 154.016   6.976   7.857
  860   1HA   GLY  21           HA2      GLY  21 155.997   6.458   5.902
  861   2HA   GLY  21           HA1      GLY  21 156.342   6.850   7.586
  862    H    SER  22           HN       SER  22 154.425   4.187   7.786
  863    HA   SER  22           HA       SER  22 156.735   2.445   8.273
  864   1HB   SER  22           HB2      SER  22 154.697   2.449   9.746
  865   2HB   SER  22           HB1      SER  22 153.774   1.790   8.399
  866    HG   SER  22           HG       SER  22 155.752   0.222   8.471
  867    H    LEU  23           HN       LEU  23 154.474   3.077   5.737
  868    HA   LEU  23           HA       LEU  23 154.570   0.535   4.410
  869   1HB   LEU  23           HB2      LEU  23 154.149   3.324   3.298
  870   2HB   LEU  23           HB1      LEU  23 153.867   1.837   2.395
  871    HG   LEU  23           HG       LEU  23 152.508   2.499   5.024
  872   1HD1  LEU  23          HD12      LEU  23 151.582   2.888   2.165
  873   2HD1  LEU  23          HD11      LEU  23 150.502   2.935   3.558
  874   3HD1  LEU  23          HD13      LEU  23 151.788   4.131   3.399
  875   1HD2  LEU  23          HD23      LEU  23 152.306   0.250   3.021
  876   2HD2  LEU  23          HD22      LEU  23 152.318   0.176   4.782
  877   3HD2  LEU  23          HD21      LEU  23 150.873   0.718   3.936
  878    H    ALA  24           HN       ALA  24 156.016  -0.272   2.945
  879    HA   ALA  24           HA       ALA  24 158.716   0.696   3.021
  880   1HB   ALA  24           HB1      ALA  24 157.412  -1.158   1.010
  881   2HB   ALA  24           HB3      ALA  24 159.148  -0.953   1.235
  882   3HB   ALA  24           HB2      ALA  24 158.167  -1.656   2.522
  883    H    GLY  25           HN       GLY  25 159.768   2.129   1.744
  884   1HA   GLY  25           HA2      GLY  25 160.178   3.301  -0.353
  885   2HA   GLY  25           HA1      GLY  25 158.483   3.080  -0.782
  886    H    ILE  26           HN       ILE  26 157.857   3.899   2.151
  887    HA   ILE  26           HA       ILE  26 157.852   6.836   1.594
  888    HB   ILE  26           HB       ILE  26 156.393   5.308   3.772
  889   1HG1  ILE  26          HG12      ILE  26 155.649   4.441   1.630
  890   2HG1  ILE  26          HG11      ILE  26 154.405   5.523   2.250
  891   1HG2  ILE  26          HG21      ILE  26 156.713   7.782   4.058
  892   2HG2  ILE  26          HG23      ILE  26 155.845   8.023   2.542
  893   3HG2  ILE  26          HG22      ILE  26 155.021   7.301   3.924
  894   1HD1  ILE  26          HD11      ILE  26 155.648   7.353   0.843
  895   2HD1  ILE  26          HD13      ILE  26 156.348   5.974  -0.004
  896   3HD1  ILE  26          HD12      ILE  26 154.602   6.205   0.014
  897    H    GLY  27           HN       GLY  27 159.515   7.982   2.569
  898   1HA   GLY  27           HA2      GLY  27 160.886   6.783   4.904
  899   2HA   GLY  27           HA1      GLY  27 161.452   8.158   3.958
  900    H    GLU  28           HN       GLU  28 161.602   8.542   6.579
  901    HA   GLU  28           HA       GLU  28 159.317   9.423   7.985
  902   1HB   GLU  28           HB2      GLU  28 162.205  10.311   8.142
  903   2HB   GLU  28           HB1      GLU  28 160.969  10.854   9.279
  904   1HG   GLU  28           HG2      GLU  28 161.501   7.926   8.728
  905   2HG   GLU  28           HG1      GLU  28 162.323   8.818  10.010
  906    H    VAL  29           HN       VAL  29 161.411  11.262   5.746
  907    HA   VAL  29           HA       VAL  29 160.096  13.782   6.223
  908    HB   VAL  29           HB       VAL  29 161.731  12.752   3.887
  909   1HG1  VAL  29          HG11      VAL  29 160.494  15.469   4.388
  910   2HG1  VAL  29          HG13      VAL  29 161.886  15.247   3.326
  911   3HG1  VAL  29          HG12      VAL  29 160.352  14.463   2.946
  912   1HG2  VAL  29          HG21      VAL  29 162.293  14.660   6.178
  913   2HG2  VAL  29          HG23      VAL  29 162.973  13.046   5.970
  914   3HG2  VAL  29          HG22      VAL  29 163.409  14.337   4.851
  915    H    LEU  30           HN       LEU  30 159.624  11.249   3.786
  916    HA   LEU  30           HA       LEU  30 157.535  12.615   2.370
  917   1HB   LEU  30           HB2      LEU  30 158.064   9.637   2.616
  918   2HB   LEU  30           HB1      LEU  30 157.016  10.391   1.414
  919    HG   LEU  30           HG       LEU  30 159.991  10.912   1.726
  920   1HD1  LEU  30          HD11      LEU  30 159.418   8.659   0.829
  921   2HD1  LEU  30          HD13      LEU  30 158.467   9.431  -0.440
  922   3HD1  LEU  30          HD12      LEU  30 160.211   9.676  -0.373
  923   1HD2  LEU  30          HD23      LEU  30 157.837  12.089  -0.026
  924   2HD2  LEU  30          HD22      LEU  30 159.180  12.897   0.784
  925   3HD2  LEU  30          HD21      LEU  30 159.476  11.942  -0.664
  926    H    GLY  31           HN       GLY  31 157.517  10.455   5.161
  927   1HA   GLY  31           HA2      GLY  31 154.711  10.003   5.287
  928   2HA   GLY  31           HA1      GLY  31 155.795   9.973   6.678
  929    H    LYS  32           HN       LYS  32 156.698  12.681   6.541
  930    HA   LYS  32           HA       LYS  32 154.585  13.984   7.973
  931   1HB   LYS  32           HB2      LYS  32 157.144  15.050   6.761
  932   2HB   LYS  32           HB1      LYS  32 156.060  16.026   7.753
  933   1HG   LYS  32           HG2      LYS  32 156.299  14.417   9.607
  934   2HG   LYS  32           HG1      LYS  32 157.387  13.441   8.619
  935   1HD   LYS  32           HD2      LYS  32 158.953  15.344   8.460
  936   2HD   LYS  32           HD1      LYS  32 157.867  16.316   9.454
  937   1HE   LYS  32           HE2      LYS  32 158.069  14.521  11.238
  938   2HE   LYS  32           HE1      LYS  32 159.362  13.815  10.270
  939   1HZ   LYS  32           HZ2      LYS  32 160.543  15.925  10.387
  940   2HZ   LYS  32           HZ1      LYS  32 159.308  16.580  11.352
  941   3HZ   LYS  32           HZ3      LYS  32 160.251  15.300  11.939
  942    H    LYS  33           HN       LYS  33 155.682  14.312   4.587
  943    HA   LYS  33           HA       LYS  33 154.015  16.574   3.997
  944   1HB   LYS  33           HB2      LYS  33 155.196  14.412   2.236
  945   2HB   LYS  33           HB1      LYS  33 154.333  15.814   1.602
  946   1HG   LYS  33           HG2      LYS  33 155.934  17.314   2.733
  947   2HG   LYS  33           HG1      LYS  33 156.800  15.913   3.363
  948   1HD   LYS  33           HD2      LYS  33 157.268  15.162   1.060
  949   2HD   LYS  33           HD1      LYS  33 156.406  16.565   0.429
  950   1HE   LYS  33           HE2      LYS  33 158.768  16.802   2.303
  951   2HE   LYS  33           HE1      LYS  33 158.934  16.811   0.547
  952   1HZ   LYS  33           HZ3      LYS  33 157.260  18.689   2.126
  953   2HZ   LYS  33           HZ2      LYS  33 158.778  19.052   1.453
  954   3HZ   LYS  33           HZ1      LYS  33 157.456  18.707   0.441
  955    H    LEU  34           HN       LEU  34 153.514  13.072   3.460
  956    HA   LEU  34           HA       LEU  34 150.889  13.327   2.363
  957   1HB   LEU  34           HB2      LEU  34 152.207  11.070   3.903
  958   2HB   LEU  34           HB1      LEU  34 150.631  10.926   3.140
  959    HG   LEU  34           HG       LEU  34 153.039  11.826   1.558
  960   1HD1  LEU  34          HD13      LEU  34 152.130   9.007   2.187
  961   2HD1  LEU  34          HD12      LEU  34 153.158   9.397   0.809
  962   3HD1  LEU  34          HD11      LEU  34 153.728   9.707   2.448
  963   1HD2  LEU  34          HD23      LEU  34 150.351  10.575   0.874
  964   2HD2  LEU  34          HD22      LEU  34 150.941  12.166   0.407
  965   3HD2  LEU  34          HD21      LEU  34 151.667  10.724  -0.287
  966    H    GLU  35           HN       GLU  35 152.091  13.083   5.659
  967    HA   GLU  35           HA       GLU  35 149.575  12.832   6.987
  968   1HB   GLU  35           HB2      GLU  35 151.731  12.529   8.143
  969   2HB   GLU  35           HB1      GLU  35 152.088  14.245   7.941
  970   1HG   GLU  35           HG2      GLU  35 150.122  14.829   9.302
  971   2HG   GLU  35           HG1      GLU  35 149.721  13.121   9.475
  972    H    GLU  36           HN       GLU  36 151.360  15.717   5.938
  973    HA   GLU  36           HA       GLU  36 149.488  17.611   7.040
  974   1HB   GLU  36           HB2      GLU  36 151.803  18.215   6.375
  975   2HB   GLU  36           HB1      GLU  36 151.383  17.923   4.688
  976   1HG   GLU  36           HG2      GLU  36 149.703  19.696   4.763
  977   2HG   GLU  36           HG1      GLU  36 150.018  19.954   6.478
  978    H    ARG  37           HN       ARG  37 149.459  15.546   4.315
  979    HA   ARG  37           HA       ARG  37 147.434  17.126   2.850
  980   1HB   ARG  37           HB2      ARG  37 148.787  14.474   2.319
  981   2HB   ARG  37           HB1      ARG  37 147.542  15.138   1.266
  982   1HG   ARG  37           HG2      ARG  37 149.983  16.750   2.008
  983   2HG   ARG  37           HG1      ARG  37 150.035  15.593   0.681
  984   1HD   ARG  37           HD2      ARG  37 148.039  16.777  -0.321
  985   2HD   ARG  37           HD1      ARG  37 148.226  18.017   0.919
  986    HE   ARG  37           HE       ARG  37 150.742  17.848  -0.207
  987   1HH1  ARG  37          HH21      ARG  37 147.521  18.271  -1.361
  988   2HH1  ARG  37          HH22      ARG  37 147.993  19.245  -2.713
  989   1HH2  ARG  37          HH11      ARG  37 151.376  19.112  -1.961
  990   2HH2  ARG  37          HH12      ARG  37 150.178  19.722  -3.053
  991    H    GLY  38           HN       GLY  38 147.292  15.131   5.499
  992   1HA   GLY  38           HA2      GLY  38 145.126  14.669   6.505
  993   2HA   GLY  38           HA1      GLY  38 144.432  14.479   4.902
  994    H    PHE  39           HN       PHE  39 147.385  12.848   4.980
  995    HA   PHE  39           HA       PHE  39 145.964  10.247   5.453
  996   1HB   PHE  39           HB2      PHE  39 148.580  10.856   4.066
  997   2HB   PHE  39           HB1      PHE  39 147.856   9.258   4.206
  998    HD1  PHE  39           HD1      PHE  39 147.638  12.547   2.619
  999    HD2  PHE  39           HD2      PHE  39 145.839   8.679   2.937
 1000    HE1  PHE  39           HE1      PHE  39 146.286  13.026   0.600
 1001    HE2  PHE  39           HE2      PHE  39 144.470   9.147   0.919
 1002    HZ   PHE  39           HZ       PHE  39 144.694  11.323  -0.251
 1003    H    ASP  40           HN       ASP  40 146.220  10.781   7.847
 1004    HA   ASP  40           HA       ASP  40 148.953  10.729   8.906
 1005   1HB   ASP  40           HB2      ASP  40 147.900  10.882  11.093
 1006   2HB   ASP  40           HB1      ASP  40 147.135  12.032   9.997
 1007    H    LYS  41           HN       LYS  41 146.725   8.332   7.926
 1008    HA   LYS  41           HA       LYS  41 148.297   6.264   9.430
 1009   1HB   LYS  41           HB2      LYS  41 145.315   6.202   8.883
 1010   2HB   LYS  41           HB1      LYS  41 146.247   4.921   9.653
 1011   1HG   LYS  41           HG2      LYS  41 146.072   7.748  10.735
 1012   2HG   LYS  41           HG1      LYS  41 145.023   6.436  11.267
 1013   1HD   LYS  41           HD2      LYS  41 147.249   5.151  11.734
 1014   2HD   LYS  41           HD1      LYS  41 148.003   6.741  11.654
 1015   1HE   LYS  41           HE2      LYS  41 146.542   7.567  13.428
 1016   2HE   LYS  41           HE1      LYS  41 145.693   6.022  13.478
 1017   1HZ   LYS  41           HZ2      LYS  41 148.505   5.667  13.709
 1018   2HZ   LYS  41           HZ1      LYS  41 147.930   6.715  14.915
 1019   3HZ   LYS  41           HZ3      LYS  41 147.268   5.161  14.757
 1020    H    ALA  42           HN       ALA  42 148.584   4.293   8.337
 1021    HA   ALA  42           HA       ALA  42 149.024   4.517   5.528
 1022   1HB   ALA  42           HB1      ALA  42 148.882   2.094   7.336
 1023   2HB   ALA  42           HB3      ALA  42 149.431   2.042   5.660
 1024   3HB   ALA  42           HB2      ALA  42 150.331   2.977   6.854
 1025    H    TYR  43           HN       TYR  43 146.366   2.959   7.337
 1026    HA   TYR  43           HA       TYR  43 145.196   1.682   5.101
 1027   1HB   TYR  43           HB2      TYR  43 143.119   1.562   6.384
 1028   2HB   TYR  43           HB1      TYR  43 144.505   1.167   7.394
 1029    HD1  TYR  43           HD1      TYR  43 142.193   3.945   6.467
 1030    HD2  TYR  43           HD2      TYR  43 144.929   2.371   9.377
 1031    HE1  TYR  43           HE1      TYR  43 141.505   5.710   8.066
 1032    HE2  TYR  43           HE2      TYR  43 144.244   4.140  10.979
 1033    HH   TYR  43           HH       TYR  43 142.486   6.865  10.062
 1034    H    VAL  44           HN       VAL  44 145.274   5.074   5.812
 1035    HA   VAL  44           HA       VAL  44 142.911   5.681   4.161
 1036    HB   VAL  44           HB       VAL  44 145.141   7.542   5.064
 1037   1HG1  VAL  44          HG12      VAL  44 143.570   8.236   3.130
 1038   2HG1  VAL  44          HG11      VAL  44 142.290   8.252   4.338
 1039   3HG1  VAL  44          HG13      VAL  44 143.673   9.331   4.506
 1040   1HG2  VAL  44          HG21      VAL  44 143.971   6.433   6.961
 1041   2HG2  VAL  44          HG23      VAL  44 143.637   8.163   6.896
 1042   3HG2  VAL  44          HG22      VAL  44 142.431   7.009   6.324
 1043    H    VAL  45           HN       VAL  45 146.356   5.430   3.845
 1044    HA   VAL  45           HA       VAL  45 146.478   6.466   1.102
 1045    HB   VAL  45           HB       VAL  45 148.508   4.838   2.674
 1046   1HG1  VAL  45          HG13      VAL  45 148.702   6.405   0.084
 1047   2HG1  VAL  45          HG12      VAL  45 150.100   5.810   0.981
 1048   3HG1  VAL  45          HG11      VAL  45 148.941   4.670   0.297
 1049   1HG2  VAL  45          HG21      VAL  45 147.993   7.801   2.375
 1050   2HG2  VAL  45          HG23      VAL  45 148.265   6.873   3.848
 1051   3HG2  VAL  45          HG22      VAL  45 149.607   7.201   2.753
 1052    H    LEU  46           HN       LEU  46 146.338   3.325   2.707
 1053    HA   LEU  46           HA       LEU  46 146.689   1.672   0.404
 1054   1HB   LEU  46           HB2      LEU  46 146.650   0.828   2.767
 1055   2HB   LEU  46           HB1      LEU  46 144.930   1.186   2.835
 1056    HG   LEU  46           HG       LEU  46 144.689  -0.350   0.782
 1057   1HD1  LEU  46          HD11      LEU  46 147.525  -0.959   1.612
 1058   2HD1  LEU  46          HD13      LEU  46 146.529  -2.146   0.772
 1059   3HD1  LEU  46          HD12      LEU  46 146.902  -0.607   0.000
 1060   1HD2  LEU  46          HD21      LEU  46 145.206  -1.135   3.614
 1061   2HD2  LEU  46          HD23      LEU  46 143.763  -1.345   2.628
 1062   3HD2  LEU  46          HD22      LEU  46 145.127  -2.440   2.431
 1063    H    GLY  47           HN       GLY  47 143.926   3.326   1.818
 1064   1HA   GLY  47           HA2      GLY  47 141.863   2.245   0.181
 1065   2HA   GLY  47           HA1      GLY  47 141.806   3.838   0.940
 1066    H    GLN  48           HN       GLN  48 144.083   4.984  -0.347
 1067    HA   GLN  48           HA       GLN  48 142.924   5.922  -2.781
 1068   1HB   GLN  48           HB2      GLN  48 144.688   7.146  -1.519
 1069   2HB   GLN  48           HB1      GLN  48 145.851   5.898  -1.960
 1070   1HG   GLN  48           HG2      GLN  48 146.100   7.778  -3.485
 1071   2HG   GLN  48           HG1      GLN  48 145.421   6.419  -4.376
 1072   1HE2  GLN  48          HE22      GLN  48 142.522   9.087  -3.276
 1073   2HE2  GLN  48          HE21      GLN  48 143.528   8.393  -2.100
 1074    H    PHE  49           HN       PHE  49 145.380   3.439  -2.123
 1075    HA   PHE  49           HA       PHE  49 145.974   2.749  -4.824
 1076   1HB   PHE  49           HB2      PHE  49 147.301   1.990  -2.878
 1077   2HB   PHE  49           HB1      PHE  49 145.950   0.997  -2.342
 1078    HD1  PHE  49           HD1      PHE  49 148.109   1.587  -5.349
 1079    HD2  PHE  49           HD2      PHE  49 145.846  -1.242  -3.041
 1080    HE1  PHE  49           HE1      PHE  49 148.917  -0.249  -6.805
 1081    HE2  PHE  49           HE2      PHE  49 146.651  -3.076  -4.496
 1082    HZ   PHE  49           HZ       PHE  49 148.188  -2.581  -6.381
 1083    H    LEU  50           HN       LEU  50 143.470   1.648  -2.589
 1084    HA   LEU  50           HA       LEU  50 142.353  -0.334  -4.396
 1085   1HB   LEU  50           HB2      LEU  50 141.015   1.159  -2.113
 1086   2HB   LEU  50           HB1      LEU  50 140.374  -0.278  -2.907
 1087    HG   LEU  50           HG       LEU  50 142.998  -0.128  -1.388
 1088   1HD1  LEU  50          HD11      LEU  50 141.004  -0.015   0.066
 1089   2HD1  LEU  50          HD13      LEU  50 140.359  -1.464  -0.706
 1090   3HD1  LEU  50          HD12      LEU  50 141.835  -1.560   0.253
 1091   1HD2  LEU  50          HD22      LEU  50 141.649  -2.288  -3.007
 1092   2HD2  LEU  50          HD21      LEU  50 143.352  -1.832  -2.964
 1093   3HD2  LEU  50          HD23      LEU  50 142.649  -2.735  -1.625
 1094    H    VAL  51           HN       VAL  51 141.678   3.082  -3.765
 1095    HA   VAL  51           HA       VAL  51 139.385   3.289  -5.467
 1096    HB   VAL  51           HB       VAL  51 141.400   5.344  -4.523
 1097   1HG1  VAL  51          HG11      VAL  51 138.852   5.671  -6.126
 1098   2HG1  VAL  51          HG13      VAL  51 139.559   6.985  -5.186
 1099   3HG1  VAL  51          HG12      VAL  51 140.461   6.273  -6.523
 1100   1HG2  VAL  51          HG22      VAL  51 139.835   4.131  -2.897
 1101   2HG2  VAL  51          HG21      VAL  51 139.749   5.892  -2.889
 1102   3HG2  VAL  51          HG23      VAL  51 138.509   4.952  -3.721
 1103    H    LEU  52           HN       LEU  52 142.827   3.327  -6.147
 1104    HA   LEU  52           HA       LEU  52 142.434   4.381  -8.874
 1105   1HB   LEU  52           HB2      LEU  52 144.867   3.321  -7.415
 1106   2HB   LEU  52           HB1      LEU  52 144.906   3.968  -9.052
 1107    HG   LEU  52           HG       LEU  52 143.868   5.522  -6.663
 1108   1HD1  LEU  52          HD11      LEU  52 146.609   5.532  -7.961
 1109   2HD1  LEU  52          HD13      LEU  52 146.059   6.712  -6.770
 1110   3HD1  LEU  52          HD12      LEU  52 146.226   5.016  -6.319
 1111   1HD2  LEU  52          HD23      LEU  52 144.398   6.154  -9.570
 1112   2HD2  LEU  52          HD22      LEU  52 143.011   6.589  -8.574
 1113   3HD2  LEU  52          HD21      LEU  52 144.540   7.431  -8.363
 1114    H    LYS  53           HN       LYS  53 141.519   1.534  -7.738
 1115    HA   LYS  53           HA       LYS  53 141.460  -0.656  -8.585
 1116   1HB   LYS  53           HB2      LYS  53 141.649   0.967 -11.144
 1117   2HB   LYS  53           HB1      LYS  53 141.130  -0.718 -11.051
 1118   1HG   LYS  53           HG2      LYS  53 139.272  -0.067  -9.560
 1119   2HG   LYS  53           HG1      LYS  53 139.786   1.617  -9.654
 1120   1HD   LYS  53           HD2      LYS  53 139.410   1.599 -12.093
 1121   2HD   LYS  53           HD1      LYS  53 138.891  -0.085 -12.001
 1122   1HE   LYS  53           HE2      LYS  53 137.105   0.653 -10.366
 1123   2HE   LYS  53           HE1      LYS  53 137.546   2.319 -10.741
 1124   1HZ   LYS  53           HZ3      LYS  53 137.214   1.568 -13.164
 1125   2HZ   LYS  53           HZ2      LYS  53 136.328   0.284 -12.490
 1126   3HZ   LYS  53           HZ1      LYS  53 135.845   1.890 -12.216
 1127    H    LYS  54           HN       LYS  54 144.066   0.151  -7.801
 1128    HA   LYS  54           HA       LYS  54 146.295  -0.530  -7.952
 1129   1HB   LYS  54           HB2      LYS  54 145.143  -2.575  -9.879
 1130   2HB   LYS  54           HB1      LYS  54 146.730  -2.649  -9.123
 1131   1HG   LYS  54           HG2      LYS  54 145.683  -2.708  -6.895
 1132   2HG   LYS  54           HG1      LYS  54 144.086  -2.626  -7.640
 1133   1HD   LYS  54           HD2      LYS  54 144.571  -4.742  -8.854
 1134   2HD   LYS  54           HD1      LYS  54 146.123  -4.839  -8.022
 1135   1HE   LYS  54           HE2      LYS  54 143.421  -4.763  -6.647
 1136   2HE   LYS  54           HE1      LYS  54 144.382  -6.219  -6.907
 1137   1HZ   LYS  54           HZ3      LYS  54 146.215  -4.937  -5.713
 1138   2HZ   LYS  54           HZ2      LYS  54 144.979  -3.900  -5.182
 1139   3HZ   LYS  54           HZ1      LYS  54 144.943  -5.549  -4.774
 1140    H    ASP  55           HN       ASP  55 145.059   1.394 -10.079
 1141    HA   ASP  55           HA       ASP  55 146.612   0.910 -12.481
 1142   1HB   ASP  55           HB2      ASP  55 144.594   2.355 -12.460
 1143   2HB   ASP  55           HB1      ASP  55 145.455   3.516 -11.453
 1144    H    GLU  56           HN       GLU  56 148.790   0.823 -12.318
 1145    HA   GLU  56           HA       GLU  56 150.377   2.046 -10.300
 1146   1HB   GLU  56           HB2      GLU  56 151.084   0.083 -11.603
 1147   2HB   GLU  56           HB1      GLU  56 151.219   1.090 -13.044
 1148   1HG   GLU  56           HG2      GLU  56 152.957   2.449 -11.962
 1149   2HG   GLU  56           HG1      GLU  56 152.789   1.508 -10.480
 1150    H    ASP  57           HN       ASP  57 149.691   3.205 -13.612
 1151    HA   ASP  57           HA       ASP  57 151.607   5.362 -13.503
 1152   1HB   ASP  57           HB2      ASP  57 149.165   4.899 -15.223
 1153   2HB   ASP  57           HB1      ASP  57 150.251   6.272 -15.439
 1154    H    LEU  58           HN       LEU  58 148.171   5.167 -12.753
 1155    HA   LEU  58           HA       LEU  58 147.902   8.023 -12.299
 1156   1HB   LEU  58           HB2      LEU  58 146.229   5.688 -11.339
 1157   2HB   LEU  58           HB1      LEU  58 145.796   7.369 -11.059
 1158    HG   LEU  58           HG       LEU  58 146.287   6.191 -13.813
 1159   1HD1  LEU  58          HD12      LEU  58 143.700   6.652 -12.299
 1160   2HD1  LEU  58          HD11      LEU  58 143.788   6.291 -14.023
 1161   3HD1  LEU  58          HD13      LEU  58 144.341   5.104 -12.844
 1162   1HD2  LEU  58          HD22      LEU  58 145.389   8.876 -12.768
 1163   2HD2  LEU  58          HD21      LEU  58 146.526   8.510 -14.063
 1164   3HD2  LEU  58          HD23      LEU  58 144.798   8.321 -14.331
 1165    H    PHE  59           HN       PHE  59 148.687   5.265 -10.234
 1166    HA   PHE  59           HA       PHE  59 148.650   6.692  -7.744
 1167   1HB   PHE  59           HB2      PHE  59 148.705   4.229  -7.860
 1168   2HB   PHE  59           HB1      PHE  59 150.309   4.292  -8.589
 1169    HD1  PHE  59           HD1      PHE  59 148.401   5.311  -5.538
 1170    HD2  PHE  59           HD2      PHE  59 152.239   4.378  -7.227
 1171    HE1  PHE  59           HE1      PHE  59 149.413   5.382  -3.275
 1172    HE2  PHE  59           HE2      PHE  59 153.252   4.452  -4.964
 1173    HZ   PHE  59           HZ       PHE  59 151.839   4.954  -2.988
 1174    H    ARG  60           HN       ARG  60 151.275   6.028 -10.069
 1175    HA   ARG  60           HA       ARG  60 153.363   7.267  -8.610
 1176   1HB   ARG  60           HB2      ARG  60 152.958   6.929 -11.588
 1177   2HB   ARG  60           HB1      ARG  60 154.444   7.562 -10.884
 1178   1HG   ARG  60           HG2      ARG  60 154.804   5.511  -9.650
 1179   2HG   ARG  60           HG1      ARG  60 153.238   4.881 -10.149
 1180   1HD   ARG  60           HD2      ARG  60 155.099   3.940 -11.507
 1181   2HD   ARG  60           HD1      ARG  60 153.963   4.862 -12.491
 1182    HE   ARG  60           HE       ARG  60 155.897   6.722 -11.780
 1183   1HH1  ARG  60          HH21      ARG  60 155.852   3.591 -13.226
 1184   2HH1  ARG  60          HH22      ARG  60 157.247   3.879 -14.209
 1185   1HH2  ARG  60          HH11      ARG  60 157.714   7.119 -13.059
 1186   2HH2  ARG  60          HH12      ARG  60 158.302   5.880 -14.115
 1187    H    GLU  61           HN       GLU  61 151.240   8.729 -11.133
 1188    HA   GLU  61           HA       GLU  61 152.460  11.313 -10.951
 1189   1HB   GLU  61           HB2      GLU  61 150.954  10.590 -12.813
 1190   2HB   GLU  61           HB1      GLU  61 149.594  10.639 -11.693
 1191   1HG   GLU  61           HG2      GLU  61 149.664  12.724 -12.956
 1192   2HG   GLU  61           HG1      GLU  61 150.077  13.058 -11.275
 1193    H    TRP  62           HN       TRP  62 149.745   9.795  -9.212
 1194    HA   TRP  62           HA       TRP  62 148.950  12.134  -7.779
 1195   1HB   TRP  62           HB2      TRP  62 147.460  10.252  -7.825
 1196   2HB   TRP  62           HB1      TRP  62 148.686   9.189  -7.138
 1197    HD1  TRP  62           HD1      TRP  62 146.356  12.080  -6.190
 1198    HE1  TRP  62           HE1      TRP  62 146.132  12.153  -3.620
 1199    HE3  TRP  62           HE3      TRP  62 149.801   8.535  -4.908
 1200    HZ2  TRP  62           HZ2      TRP  62 147.284  10.871  -1.316
 1201    HZ3  TRP  62           HZ3      TRP  62 150.204   7.973  -2.531
 1202    HH2  TRP  62           HH2      TRP  62 148.956   9.138  -0.737
 1203    H    LEU  63           HN       LEU  63 151.171   9.500  -6.822
 1204    HA   LEU  63           HA       LEU  63 151.744  10.618  -4.246
 1205   1HB   LEU  63           HB2      LEU  63 152.169   8.257  -4.800
 1206   2HB   LEU  63           HB1      LEU  63 153.395   8.744  -5.965
 1207    HG   LEU  63           HG       LEU  63 154.699   9.784  -4.127
 1208   1HD1  LEU  63          HD12      LEU  63 152.342   8.855  -2.513
 1209   2HD1  LEU  63          HD11      LEU  63 153.930   8.945  -1.758
 1210   3HD1  LEU  63          HD13      LEU  63 153.197  10.392  -2.443
 1211   1HD2  LEU  63          HD22      LEU  63 154.993   7.382  -4.849
 1212   2HD2  LEU  63          HD21      LEU  63 155.517   7.716  -3.198
 1213   3HD2  LEU  63          HD23      LEU  63 153.972   6.917  -3.488
 1214    H    LYS  64           HN       LYS  64 153.446  10.844  -7.360
 1215    HA   LYS  64           HA       LYS  64 155.654  12.363  -6.425
 1216   1HB   LYS  64           HB2      LYS  64 155.560  11.301  -8.669
 1217   2HB   LYS  64           HB1      LYS  64 154.310  12.443  -9.148
 1218   1HG   LYS  64           HG2      LYS  64 156.371  13.276 -10.040
 1219   2HG   LYS  64           HG1      LYS  64 155.985  14.306  -8.669
 1220   1HD   LYS  64           HD2      LYS  64 157.594  13.196  -7.271
 1221   2HD   LYS  64           HD1      LYS  64 157.812  11.900  -8.446
 1222   1HE   LYS  64           HE2      LYS  64 159.693  13.405  -8.638
 1223   2HE   LYS  64           HE1      LYS  64 158.680  13.629 -10.063
 1224   1HZ   LYS  64           HZ1      LYS  64 158.144  15.292  -7.717
 1225   2HZ   LYS  64           HZ3      LYS  64 159.514  15.656  -8.648
 1226   3HZ   LYS  64           HZ2      LYS  64 157.974  15.659  -9.368
 1227    H    ASP  65           HN       ASP  65 152.576  13.457  -7.831
 1228    HA   ASP  65           HA       ASP  65 153.162  16.257  -7.488
 1229   1HB   ASP  65           HB2      ASP  65 150.600  14.717  -7.941
 1230   2HB   ASP  65           HB1      ASP  65 150.623  16.474  -7.771
 1231    H    THR  66           HN       THR  66 151.743  13.804  -5.397
 1232    HA   THR  66           HA       THR  66 150.645  15.716  -3.529
 1233    HB   THR  66           HB       THR  66 151.285  12.785  -3.104
 1234    HG1  THR  66           HG1      THR  66 148.706  13.353  -3.423
 1235   1HG2  THR  66          HG23      THR  66 149.440  14.709  -1.661
 1236   2HG2  THR  66          HG22      THR  66 149.530  12.975  -1.356
 1237   3HG2  THR  66          HG21      THR  66 150.918  14.005  -1.008
 1238    H    CYS  67           HN       CYS  67 153.743  13.865  -3.604
 1239    HA   CYS  67           HA       CYS  67 154.610  15.573  -1.273
 1240   1HB   CYS  67           HB2      CYS  67 155.916  13.615  -0.487
 1241   2HB   CYS  67           HB1      CYS  67 154.178  13.313  -0.488
 1242    HG   CYS  67           HG       CYS  67 155.573  12.416  -3.069
 1243    H    GLY  68           HN       GLY  68 155.581  13.976  -4.274
 1244   1HA   GLY  68           HA2      GLY  68 157.288  14.992  -5.692
 1245   2HA   GLY  68           HA1      GLY  68 158.076  15.630  -4.247
 1246    H    ALA  69           HN       ALA  69 156.896  12.434  -3.896
 1247    HA   ALA  69           HA       ALA  69 159.367  11.269  -3.256
 1248   1HB   ALA  69           HB2      ALA  69 157.165  10.199  -2.826
 1249   2HB   ALA  69           HB1      ALA  69 156.995   9.890  -4.555
 1250   3HB   ALA  69           HB3      ALA  69 158.278   9.098  -3.640
 1251    H    ASN  70           HN       ASN  70 160.783   9.827  -4.521
 1252    HA   ASN  70           HA       ASN  70 161.089  10.796  -7.284
 1253   1HB   ASN  70           HB2      ASN  70 163.077  10.597  -5.875
 1254   2HB   ASN  70           HB1      ASN  70 162.746   8.885  -5.612
 1255   1HD2  ASN  70          HD22      ASN  70 163.730   9.902  -9.478
 1256   2HD2  ASN  70          HD21      ASN  70 162.670  10.899  -8.607
 1257    H    ALA  71           HN       ALA  71 161.664   9.125  -8.969
 1258    HA   ALA  71           HA       ALA  71 159.473   7.373  -9.436
 1259   1HB   ALA  71           HB1      ALA  71 162.242   7.489 -10.654
 1260   2HB   ALA  71           HB3      ALA  71 160.956   6.447 -11.261
 1261   3HB   ALA  71           HB2      ALA  71 160.761   8.199 -11.297
 1262    H    LYS  72           HN       LYS  72 162.648   6.783  -7.966
 1263    HA   LYS  72           HA       LYS  72 162.417   3.902  -8.041
 1264   1HB   LYS  72           HB2      LYS  72 164.583   5.090  -7.766
 1265   2HB   LYS  72           HB1      LYS  72 164.054   5.657  -6.183
 1266   1HG   LYS  72           HG2      LYS  72 163.840   3.311  -5.418
 1267   2HG   LYS  72           HG1      LYS  72 164.380   2.753  -7.001
 1268   1HD   LYS  72           HD2      LYS  72 166.521   3.938  -6.692
 1269   2HD   LYS  72           HD1      LYS  72 165.981   4.496  -5.108
 1270   1HE   LYS  72           HE2      LYS  72 165.697   2.092  -4.432
 1271   2HE   LYS  72           HE1      LYS  72 166.437   1.626  -5.963
 1272   1HZ   LYS  72           HZ1      LYS  72 168.163   3.461  -5.000
 1273   2HZ   LYS  72           HZ3      LYS  72 167.656   2.683  -3.580
 1274   3HZ   LYS  72           HZ2      LYS  72 168.344   1.779  -4.844
 1275    H    GLN  73           HN       GLN  73 161.662   6.369  -5.610
 1276    HA   GLN  73           HA       GLN  73 160.960   4.541  -3.524
 1277   1HB   GLN  73           HB2      GLN  73 160.170   7.418  -4.052
 1278   2HB   GLN  73           HB1      GLN  73 159.741   6.547  -2.579
 1279   1HG   GLN  73           HG2      GLN  73 162.131   6.129  -2.124
 1280   2HG   GLN  73           HG1      GLN  73 162.561   7.003  -3.594
 1281   1HE2  GLN  73          HE22      GLN  73 162.102   9.110  -0.263
 1282   2HE2  GLN  73          HE21      GLN  73 162.406   7.440  -0.317
 1283    H    SER  74           HN       SER  74 159.094   5.980  -6.170
 1284    HA   SER  74           HA       SER  74 156.535   5.158  -5.185
 1285   1HB   SER  74           HB2      SER  74 156.997   6.894  -6.977
 1286   2HB   SER  74           HB1      SER  74 157.311   5.557  -8.080
 1287    HG   SER  74           HG       SER  74 155.229   4.903  -7.879
 1288    H    ARG  75           HN       ARG  75 158.926   3.571  -7.320
 1289    HA   ARG  75           HA       ARG  75 157.248   1.421  -8.131
 1290   1HB   ARG  75           HB2      ARG  75 160.253   1.558  -7.761
 1291   2HB   ARG  75           HB1      ARG  75 159.424   0.164  -8.456
 1292   1HG   ARG  75           HG2      ARG  75 158.423   1.657 -10.182
 1293   2HG   ARG  75           HG1      ARG  75 159.356   3.001  -9.521
 1294   1HD   ARG  75           HD2      ARG  75 160.510   0.442 -10.669
 1295   2HD   ARG  75           HD1      ARG  75 160.515   2.020 -11.455
 1296    HE   ARG  75           HE       ARG  75 161.768   2.473  -9.017
 1297   1HH1  ARG  75          HH21      ARG  75 162.128   0.324 -11.686
 1298   2HH1  ARG  75          HH22      ARG  75 163.841   0.151 -11.490
 1299   1HH2  ARG  75          HH11      ARG  75 164.006   2.256  -8.740
 1300   2HH2  ARG  75          HH12      ARG  75 164.903   1.242  -9.820
 1301    H    ASP  76           HN       ASP  76 159.251   1.829  -5.204
 1302    HA   ASP  76           HA       ASP  76 158.875  -0.852  -4.271
 1303   1HB   ASP  76           HB2      ASP  76 159.537   1.724  -2.829
 1304   2HB   ASP  76           HB1      ASP  76 159.508   0.151  -2.031
 1305    H    CYS  77           HN       CYS  77 156.973   2.129  -3.731
 1306    HA   CYS  77           HA       CYS  77 155.271   0.976  -1.729
 1307   1HB   CYS  77           HB2      CYS  77 154.877   3.276  -3.655
 1308   2HB   CYS  77           HB1      CYS  77 153.705   2.848  -2.409
 1309    HG   CYS  77           HG       CYS  77 156.379   3.138  -1.099
 1310    H    PHE  78           HN       PHE  78 155.010   1.133  -5.303
 1311    HA   PHE  78           HA       PHE  78 152.356   0.140  -5.471
 1312   1HB   PHE  78           HB2      PHE  78 153.577   1.027  -7.417
 1313   2HB   PHE  78           HB1      PHE  78 154.669  -0.357  -7.368
 1314    HD1  PHE  78           HD1      PHE  78 151.243   0.772  -8.133
 1315    HD2  PHE  78           HD2      PHE  78 153.922  -2.586  -8.032
 1316    HE1  PHE  78           HE1      PHE  78 149.652  -0.541  -9.511
 1317    HE2  PHE  78           HE2      PHE  78 152.329  -3.898  -9.407
 1318    HZ   PHE  78           HZ       PHE  78 150.194  -2.876 -10.146
 1319    H    GLY  79           HN       GLY  79 155.376  -1.773  -5.810
 1320   1HA   GLY  79           HA2      GLY  79 154.078  -4.301  -5.721
 1321   2HA   GLY  79           HA1      GLY  79 155.781  -4.027  -5.355
 1322    H    CYS  80           HN       CYS  80 155.211  -2.182  -3.134
 1323    HA   CYS  80           HA       CYS  80 155.011  -4.153  -1.029
 1324   1HB   CYS  80           HB2      CYS  80 156.260  -2.011  -0.809
 1325   2HB   CYS  80           HB1      CYS  80 154.728  -1.141  -0.836
 1326    HG   CYS  80           HG       CYS  80 155.348  -3.234   1.409
 1327    H    LEU  81           HN       LEU  81 152.776  -1.549  -2.077
 1328    HA   LEU  81           HA       LEU  81 150.686  -2.411  -0.279
 1329   1HB   LEU  81           HB2      LEU  81 150.527  -0.726  -2.798
 1330   2HB   LEU  81           HB1      LEU  81 149.256  -0.875  -1.585
 1331    HG   LEU  81           HG       LEU  81 152.049   0.198  -1.067
 1332   1HD1  LEU  81          HD11      LEU  81 150.665   1.710  -2.451
 1333   2HD1  LEU  81          HD13      LEU  81 149.381   1.634  -1.244
 1334   3HD1  LEU  81          HD12      LEU  81 150.929   2.377  -0.840
 1335   1HD2  LEU  81          HD21      LEU  81 149.662  -0.362   0.687
 1336   2HD2  LEU  81          HD23      LEU  81 151.374  -0.627   1.016
 1337   3HD2  LEU  81          HD22      LEU  81 150.709   1.002   1.079
 1338    H    ARG  82           HN       ARG  82 151.433  -3.052  -3.695
 1339    HA   ARG  82           HA       ARG  82 149.023  -4.473  -4.283
 1340   1HB   ARG  82           HB2      ARG  82 150.602  -3.682  -6.029
 1341   2HB   ARG  82           HB1      ARG  82 151.760  -4.907  -5.505
 1342   1HG   ARG  82           HG2      ARG  82 150.176  -6.691  -6.041
 1343   2HG   ARG  82           HG1      ARG  82 148.945  -5.504  -6.466
 1344   1HD   ARG  82           HD2      ARG  82 150.357  -4.683  -8.305
 1345   2HD   ARG  82           HD1      ARG  82 151.612  -5.845  -7.869
 1346    HE   ARG  82           HE       ARG  82 149.360  -7.414  -8.250
 1347   1HH1  ARG  82          HH21      ARG  82 151.040  -4.999 -10.049
 1348   2HH1  ARG  82          HH22      ARG  82 150.660  -5.696 -11.589
 1349   1HH2  ARG  82          HH11      ARG  82 148.855  -8.335 -10.245
 1350   2HH2  ARG  82          HH12      ARG  82 149.423  -7.586 -11.700
 1351    H    GLU  83           HN       GLU  83 152.138  -5.609  -2.973
 1352    HA   GLU  83           HA       GLU  83 151.429  -8.392  -3.066
 1353   1HB   GLU  83           HB2      GLU  83 153.489  -6.854  -1.476
 1354   2HB   GLU  83           HB1      GLU  83 153.316  -8.606  -1.366
 1355   1HG   GLU  83           HG2      GLU  83 153.705  -7.153  -3.993
 1356   2HG   GLU  83           HG1      GLU  83 155.044  -7.803  -3.047
 1357    H    TRP  84           HN       TRP  84 151.075  -5.912  -0.510
 1358    HA   TRP  84           HA       TRP  84 150.229  -7.695   1.550
 1359   1HB   TRP  84           HB2      TRP  84 150.818  -5.267   1.863
 1360   2HB   TRP  84           HB1      TRP  84 149.289  -4.847   1.093
 1361    HD1  TRP  84           HD1      TRP  84 150.759  -6.270   4.285
 1362    HE1  TRP  84           HE1      TRP  84 148.913  -6.398   6.082
 1363    HE3  TRP  84           HE3      TRP  84 146.668  -5.134   1.443
 1364    HZ2  TRP  84           HZ2      TRP  84 146.090  -6.072   6.286
 1365    HZ3  TRP  84           HZ3      TRP  84 144.413  -5.055   2.468
 1366    HH2  TRP  84           HH2      TRP  84 144.122  -5.523   4.887
 1367    H    CYS  85           HN       CYS  85 148.424  -5.940  -0.969
 1368    HA   CYS  85           HA       CYS  85 145.812  -6.756  -0.193
 1369   1HB   CYS  85           HB2      CYS  85 147.020  -5.981  -2.849
 1370   2HB   CYS  85           HB1      CYS  85 145.319  -6.420  -2.708
 1371    HG   CYS  85           HG       CYS  85 144.904  -4.144  -1.849
 1372    H    ASP  86           HN       ASP  86 148.200  -8.325  -2.300
 1373    HA   ASP  86           HA       ASP  86 146.557 -10.466  -3.195
 1374   1HB   ASP  86           HB2      ASP  86 149.546 -10.276  -2.760
 1375   2HB   ASP  86           HB1      ASP  86 148.769 -11.684  -3.484
 1376    H    ALA  87           HN       ALA  87 148.312  -9.994  -0.173
 1377    HA   ALA  87           HA       ALA  87 147.844 -12.776   0.674
 1378   1HB   ALA  87           HB2      ALA  87 149.885 -11.322   1.287
 1379   2HB   ALA  87           HB1      ALA  87 148.814 -10.527   2.442
 1380   3HB   ALA  87           HB3      ALA  87 149.139 -12.254   2.583
 1381    H    PHE  88           HN       PHE  88 146.547  -9.558   1.388
 1382    HA   PHE  88           HA       PHE  88 144.554 -10.807   3.243
 1383   1HB   PHE  88           HB2      PHE  88 145.427  -7.933   2.863
 1384   2HB   PHE  88           HB1      PHE  88 144.146  -8.446   3.961
 1385    HD1  PHE  88           HD2      PHE  88 144.670  -9.966   5.876
 1386    HD2  PHE  88           HD1      PHE  88 147.743  -8.260   3.408
 1387    HE1  PHE  88           HE2      PHE  88 146.362 -10.514   7.604
 1388    HE2  PHE  88           HE1      PHE  88 149.436  -8.809   5.136
 1389    HZ   PHE  88           HZ       PHE  88 148.745  -9.932   7.235
 1390    H    LEU  89           HN       LEU  89 144.109  -7.761   1.548
 1391    HA   LEU  89           HA       LEU  89 141.510  -8.728   0.551
 1392   1HB   LEU  89           HB2      LEU  89 141.532  -6.514   1.519
 1393   2HB   LEU  89           HB1      LEU  89 142.879  -6.022   0.496
 1394    HG   LEU  89           HG       LEU  89 141.485  -6.157  -1.497
 1395   1HD1  LEU  89          HD11      LEU  89 139.493  -7.360   0.432
 1396   2HD1  LEU  89          HD13      LEU  89 138.965  -6.614  -1.077
 1397   3HD1  LEU  89          HD12      LEU  89 140.050  -8.002  -1.113
 1398   1HD2  LEU  89          HD22      LEU  89 141.381  -4.123   0.022
 1399   2HD2  LEU  89          HD21      LEU  89 139.989  -4.334  -1.039
 1400   3HD2  LEU  89          HD23      LEU  89 139.874  -4.776   0.665
   
  No H/Q in entry =        1400
  Start of MODEL   11
    1   1H    MET   1           HT1      MET   1 114.017  -6.102   9.134
    2   2H    MET   1           HT3      MET   1 113.687  -6.394   7.496
    3   3H    MET   1           HT2      MET   1 112.408  -6.196   8.597
    4    HA   MET   1           HA       MET   1 112.643  -8.263   9.502
    5   1HB   MET   1           HB2      MET   1 113.696  -8.532   6.668
    6   2HB   MET   1           HB1      MET   1 113.022  -9.848   7.629
    7   1HG   MET   1           HG2      MET   1 111.194  -9.130   6.331
    8   2HG   MET   1           HG1      MET   1 110.935  -8.317   7.874
    9   1HE   MET   1           HE1      MET   1 109.673  -7.647   5.134
   10   2HE   MET   1           HE3      MET   1 110.325  -6.264   4.244
   11   3HE   MET   1           HE2      MET   1 111.091  -7.845   4.106
   12    H    THR   2           HN       THR   2 114.374 -10.374   8.754
   13    HA   THR   2           HA       THR   2 116.676  -9.743  10.445
   14    HB   THR   2           HB       THR   2 117.208 -12.089  10.268
   15    HG1  THR   2           HG1      THR   2 115.621 -13.242   8.745
   16   1HG2  THR   2          HG23      THR   2 115.229 -11.484  11.643
   17   2HG2  THR   2          HG22      THR   2 114.195 -11.768  10.242
   18   3HG2  THR   2          HG21      THR   2 115.095 -13.104  10.959
   19    H    THR   3           HN       THR   3 118.923 -10.358   9.670
   20    HA   THR   3           HA       THR   3 119.523  -8.932   7.227
   21    HB   THR   3           HB       THR   3 121.863  -9.761   7.648
   22    HG1  THR   3           HG1      THR   3 121.033 -11.730   8.674
   23   1HG2  THR   3          HG23      THR   3 121.024  -7.675   8.670
   24   2HG2  THR   3          HG22      THR   3 120.417  -8.597  10.046
   25   3HG2  THR   3          HG21      THR   3 122.153  -8.503   9.745
   26    H    SER   4           HN       SER   4 120.364  -9.821   5.267
   27    HA   SER   4           HA       SER   4 119.216 -12.416   4.566
   28   1HB   SER   4           HB2      SER   4 120.036 -11.929   2.322
   29   2HB   SER   4           HB1      SER   4 119.289 -10.475   2.979
   30    HG   SER   4           HG       SER   4 121.822 -10.490   3.735
   31    H    GLN   5           HN       GLN   5 120.567 -14.102   3.540
   32    HA   GLN   5           HA       GLN   5 122.689 -14.975   5.224
   33   1HB   GLN   5           HB2      GLN   5 121.261 -16.416   3.713
   34   2HB   GLN   5           HB1      GLN   5 122.207 -15.816   2.350
   35   1HG   GLN   5           HG2      GLN   5 124.267 -16.673   3.405
   36   2HG   GLN   5           HG1      GLN   5 123.319 -17.276   4.762
   37   1HE2  GLN   5          HE22      GLN   5 123.449 -20.278   2.769
   38   2HE2  GLN   5          HE21      GLN   5 124.282 -19.443   3.989
   39    H    LYS   6           HN       LYS   6 122.686 -12.809   2.497
   40    HA   LYS   6           HA       LYS   6 125.359 -13.114   1.600
   41   1HB   LYS   6           HB2      LYS   6 123.553 -10.684   1.698
   42   2HB   LYS   6           HB1      LYS   6 125.113 -10.702   0.881
   43   1HG   LYS   6           HG2      LYS   6 124.345 -12.561  -0.552
   44   2HG   LYS   6           HG1      LYS   6 122.780 -12.540   0.264
   45   1HD   LYS   6           HD2      LYS   6 122.426 -10.208  -0.463
   46   2HD   LYS   6           HD1      LYS   6 123.988 -10.228  -1.283
   47   1HE   LYS   6           HE2      LYS   6 123.215 -12.045  -2.747
   48   2HE   LYS   6           HE1      LYS   6 121.659 -12.063  -1.917
   49   1HZ   LYS   6           HZ2      LYS   6 122.801  -9.750  -3.391
   50   2HZ   LYS   6           HZ1      LYS   6 121.566 -10.769  -3.958
   51   3HZ   LYS   6           HZ3      LYS   6 121.295  -9.782  -2.606
   52    H    HIS   7           HN       HIS   7 124.000 -11.252   4.304
   53    HA   HIS   7           HA       HIS   7 126.311  -9.733   4.930
   54   1HB   HIS   7           HB2      HIS   7 124.169  -9.231   5.957
   55   2HB   HIS   7           HB1      HIS   7 124.133 -10.807   6.743
   56    HD2  HIS   7           HD2      HIS   7 125.699 -11.008   9.081
   57    HE1  HIS   7           HE1      HIS   7 127.099  -7.028   9.083
   58    HE2  HIS   7           HE2      HIS   7 126.973  -9.172  10.421
   59    H    ARG   8           HN       ARG   8 125.321 -12.909   6.288
   60    HA   ARG   8           HA       ARG   8 127.709 -13.192   7.856
   61   1HB   ARG   8           HB2      ARG   8 125.660 -15.195   6.863
   62   2HB   ARG   8           HB1      ARG   8 126.993 -15.633   7.930
   63   1HG   ARG   8           HG2      ARG   8 125.099 -13.394   8.651
   64   2HG   ARG   8           HG1      ARG   8 124.689 -15.071   9.002
   65   1HD   ARG   8           HD2      ARG   8 126.924 -15.250  10.212
   66   2HD   ARG   8           HD1      ARG   8 127.071 -13.505  10.036
   67    HE   ARG   8           HE       ARG   8 124.561 -13.899  11.189
   68   1HH1  ARG   8          HH21      ARG   8 127.848 -14.703  11.863
   69   2HH1  ARG   8          HH22      ARG   8 127.625 -14.744  13.581
   70   1HH2  ARG   8          HH11      ARG   8 124.250 -13.961  13.429
   71   2HH2  ARG   8          HH12      ARG   8 125.587 -14.327  14.467
   72    H    ASP   9           HN       ASP   9 126.815 -14.049   4.576
   73    HA   ASP   9           HA       ASP   9 129.096 -15.768   4.108
   74   1HB   ASP   9           HB2      ASP   9 127.237 -14.317   2.226
   75   2HB   ASP   9           HB1      ASP   9 128.531 -15.377   1.675
   76    H    PHE  10           HN       PHE  10 128.498 -12.283   3.559
   77    HA   PHE  10           HA       PHE  10 130.969 -11.865   2.133
   78   1HB   PHE  10           HB2      PHE  10 128.964 -10.358   2.069
   79   2HB   PHE  10           HB1      PHE  10 129.333  -9.870   3.721
   80    HD1  PHE  10           HD1      PHE  10 130.398  -9.691   0.197
   81    HD2  PHE  10           HD2      PHE  10 131.289  -8.493   4.226
   82    HE1  PHE  10           HE1      PHE  10 131.989  -7.991  -0.659
   83    HE2  PHE  10           HE2      PHE  10 132.880  -6.796   3.370
   84    HZ   PHE  10           HZ       PHE  10 133.229  -6.543   0.928
   85    H    VAL  11           HN       VAL  11 130.046 -11.530   5.575
   86    HA   VAL  11           HA       VAL  11 132.729 -10.561   6.280
   87    HB   VAL  11           HB       VAL  11 131.891 -10.500   8.560
   88   1HG1  VAL  11          HG11      VAL  11 129.901  -9.578   6.468
   89   2HG1  VAL  11          HG13      VAL  11 129.817  -9.107   8.166
   90   3HG1  VAL  11          HG12      VAL  11 131.208  -8.638   7.188
   91   1HG2  VAL  11          HG23      VAL  11 129.709 -12.211   7.380
   92   2HG2  VAL  11          HG22      VAL  11 130.663 -12.490   8.837
   93   3HG2  VAL  11          HG21      VAL  11 129.405 -11.254   8.831
   94    H    ALA  12           HN       ALA  12 131.943 -13.481   5.262
   95    HA   ALA  12           HA       ALA  12 133.552 -14.928   7.356
   96   1HB   ALA  12           HB1      ALA  12 131.201 -15.701   7.200
   97   2HB   ALA  12           HB3      ALA  12 131.451 -16.067   5.493
   98   3HB   ALA  12           HB2      ALA  12 132.347 -16.956   6.726
   99    H    GLU  13           HN       GLU  13 133.657 -13.752   4.210
  100    HA   GLU  13           HA       GLU  13 136.029 -15.380   3.660
  101   1HB   GLU  13           HB2      GLU  13 135.081 -15.887   1.284
  102   2HB   GLU  13           HB1      GLU  13 134.569 -16.904   2.631
  103   1HG   GLU  13           HG2      GLU  13 132.461 -15.878   2.778
  104   2HG   GLU  13           HG1      GLU  13 132.984 -14.446   1.890
  105    HA   PRO  14           HA       PRO  14 137.598 -11.629   1.859
  106   1HB   PRO  14           HB2      PRO  14 138.087 -13.271  -0.615
  107   2HB   PRO  14           HB1      PRO  14 139.177 -12.145   0.220
  108   1HG   PRO  14           HG2      PRO  14 139.416 -14.797   0.499
  109   2HG   PRO  14           HG1      PRO  14 139.744 -13.682   1.838
  110   1HD   PRO  14           HD2      PRO  14 137.452 -15.546   1.483
  111   2HD   PRO  14           HD1      PRO  14 138.116 -14.840   2.973
  112    H    MET  15           HN       MET  15 137.055 -10.051   0.151
  113    HA   MET  15           HA       MET  15 134.297 -10.451  -0.868
  114   1HB   MET  15           HB2      MET  15 134.546  -7.992  -1.474
  115   2HB   MET  15           HB1      MET  15 134.636  -8.366   0.246
  116   1HG   MET  15           HG2      MET  15 137.019  -8.197   0.260
  117   2HG   MET  15           HG1      MET  15 137.085  -8.170  -1.504
  118   1HE   MET  15           HE1      MET  15 135.551  -6.668   1.550
  119   2HE   MET  15           HE3      MET  15 137.095  -5.812   1.658
  120   3HE   MET  15           HE2      MET  15 135.609  -4.918   1.353
  121    H    GLY  16           HN       GLY  16 137.569 -10.373  -2.002
  122   1HA   GLY  16           HA2      GLY  16 138.483 -10.575  -4.152
  123   2HA   GLY  16           HA1      GLY  16 137.000 -11.447  -4.539
  124    H    GLU  17           HN       GLU  17 136.482 -10.582  -6.516
  125    HA   GLU  17           HA       GLU  17 136.371  -7.605  -6.804
  126   1HB   GLU  17           HB2      GLU  17 136.365  -9.813  -8.882
  127   2HB   GLU  17           HB1      GLU  17 136.282  -8.089  -9.239
  128   1HG   GLU  17           HG2      GLU  17 138.461  -7.754  -8.116
  129   2HG   GLU  17           HG1      GLU  17 138.546  -9.484  -7.779
  130    H    LYS  18           HN       LYS  18 134.285  -9.220  -5.425
  131    HA   LYS  18           HA       LYS  18 132.038  -9.688  -7.094
  132   1HB   LYS  18           HB2      LYS  18 132.191  -8.831  -4.187
  133   2HB   LYS  18           HB1      LYS  18 130.702  -9.354  -4.969
  134   1HG   LYS  18           HG2      LYS  18 133.118 -11.139  -5.180
  135   2HG   LYS  18           HG1      LYS  18 132.251 -11.093  -3.648
  136   1HD   LYS  18           HD2      LYS  18 130.661 -11.431  -6.184
  137   2HD   LYS  18           HD1      LYS  18 131.543 -12.818  -5.548
  138   1HE   LYS  18           HE2      LYS  18 130.410 -12.542  -3.368
  139   2HE   LYS  18           HE1      LYS  18 129.521 -11.160  -4.008
  140   1HZ   LYS  18           HZ2      LYS  18 129.389 -13.615  -5.562
  141   2HZ   LYS  18           HZ1      LYS  18 128.584 -13.633  -4.066
  142   3HZ   LYS  18           HZ3      LYS  18 128.179 -12.469  -5.231
  143    HA   PRO  19           HA       PRO  19 130.854  -5.587  -8.299
  144   1HB   PRO  19           HB2      PRO  19 128.100  -5.849  -8.460
  145   2HB   PRO  19           HB1      PRO  19 129.229  -6.475  -9.677
  146   1HG   PRO  19           HG2      PRO  19 127.885  -7.918  -7.433
  147   2HG   PRO  19           HG1      PRO  19 128.152  -8.440  -9.107
  148   1HD   PRO  19           HD2      PRO  19 129.715  -9.324  -7.080
  149   2HD   PRO  19           HD1      PRO  19 130.370  -9.044  -8.708
  150    H    VAL  20           HN       VAL  20 129.942  -3.638  -7.499
  151    HA   VAL  20           HA       VAL  20 129.994  -3.233  -4.731
  152    HB   VAL  20           HB       VAL  20 130.179  -1.384  -6.301
  153   1HG1  VAL  20          HG11      VAL  20 128.488  -2.376  -7.922
  154   2HG1  VAL  20          HG13      VAL  20 127.225  -1.736  -6.871
  155   3HG1  VAL  20          HG12      VAL  20 128.353  -0.637  -7.666
  156   1HG2  VAL  20          HG22      VAL  20 129.213  -1.036  -3.967
  157   2HG2  VAL  20          HG21      VAL  20 128.829   0.223  -5.143
  158   3HG2  VAL  20          HG23      VAL  20 127.622  -0.994  -4.725
  159    H    GLY  21           HN       GLY  21 127.193  -3.952  -6.784
  160   1HA   GLY  21           HA2      GLY  21 125.180  -3.559  -4.808
  161   2HA   GLY  21           HA1      GLY  21 125.004  -4.583  -6.232
  162    H    SER  22           HN       SER  22 127.674  -5.794  -4.735
  163    HA   SER  22           HA       SER  22 126.145  -8.027  -3.610
  164   1HB   SER  22           HB2      SER  22 129.129  -7.489  -3.655
  165   2HB   SER  22           HB1      SER  22 128.372  -9.006  -3.181
  166    HG   SER  22           HG       SER  22 128.892  -8.008  -5.655
  167    H    LEU  23           HN       LEU  23 127.750  -5.158  -2.467
  168    HA   LEU  23           HA       LEU  23 128.187  -5.962   0.242
  169   1HB   LEU  23           HB2      LEU  23 127.653  -3.224  -0.941
  170   2HB   LEU  23           HB1      LEU  23 128.213  -3.502   0.708
  171    HG   LEU  23           HG       LEU  23 129.673  -4.506  -1.756
  172   1HD1  LEU  23          HD13      LEU  23 129.530  -1.994  -1.620
  173   2HD1  LEU  23          HD12      LEU  23 130.352  -2.086  -0.062
  174   3HD1  LEU  23          HD11      LEU  23 131.173  -2.628  -1.527
  175   1HD2  LEU  23          HD22      LEU  23 130.227  -4.523   1.210
  176   2HD2  LEU  23          HD21      LEU  23 130.472  -5.802   0.023
  177   3HD2  LEU  23          HD23      LEU  23 131.581  -4.436   0.086
  178    H    ALA  24           HN       ALA  24 126.887  -5.937   2.004
  179    HA   ALA  24           HA       ALA  24 124.062  -6.222   1.654
  180   1HB   ALA  24           HB2      ALA  24 125.409  -7.193   3.541
  181   2HB   ALA  24           HB1      ALA  24 125.521  -5.572   4.227
  182   3HB   ALA  24           HB3      ALA  24 123.949  -6.355   4.071
  183    H    GLY  25           HN       GLY  25 122.402  -4.796   1.841
  184   1HA   GLY  25           HA2      GLY  25 121.338  -2.769   2.644
  185   2HA   GLY  25           HA1      GLY  25 122.928  -2.036   2.842
  186    H    ILE  26           HN       ILE  26 123.612  -3.196   0.055
  187    HA   ILE  26           HA       ILE  26 122.453  -0.897  -1.465
  188    HB   ILE  26           HB       ILE  26 124.677  -2.795  -2.276
  189   1HG1  ILE  26          HG12      ILE  26 125.395  -1.654  -0.263
  190   2HG1  ILE  26          HG11      ILE  26 126.186  -0.881  -1.634
  191   1HG2  ILE  26          HG21      ILE  26 123.848  -0.055  -3.275
  192   2HG2  ILE  26          HG23      ILE  26 125.225  -0.986  -3.865
  193   3HG2  ILE  26          HG22      ILE  26 123.584  -1.582  -4.117
  194   1HD1  ILE  26          HD12      ILE  26 124.155   0.757  -1.589
  195   2HD1  ILE  26          HD11      ILE  26 123.902   0.140   0.044
  196   3HD1  ILE  26          HD13      ILE  26 125.414   0.944  -0.371
  197    H    GLY  27           HN       GLY  27 120.695  -1.356  -2.758
  198   1HA   GLY  27           HA2      GLY  27 120.143  -4.177  -3.449
  199   2HA   GLY  27           HA1      GLY  27 119.044  -2.816  -3.663
  200    H    GLU  28           HN       GLU  28 119.173  -4.394  -5.785
  201    HA   GLU  28           HA       GLU  28 121.276  -4.023  -7.644
  202   1HB   GLU  28           HB2      GLU  28 118.317  -4.500  -8.095
  203   2HB   GLU  28           HB1      GLU  28 119.528  -4.573  -9.376
  204   1HG   GLU  28           HG2      GLU  28 119.698  -6.221  -6.842
  205   2HG   GLU  28           HG1      GLU  28 118.963  -6.812  -8.333
  206    H    VAL  29           HN       VAL  29 118.368  -2.023  -7.089
  207    HA   VAL  29           HA       VAL  29 118.855  -0.261  -9.316
  208    HB   VAL  29           HB       VAL  29 117.293   0.099  -6.741
  209   1HG1  VAL  29          HG13      VAL  29 117.703   1.955  -9.088
  210   2HG1  VAL  29          HG12      VAL  29 116.222   2.017  -8.131
  211   3HG1  VAL  29          HG11      VAL  29 117.779   2.323  -7.364
  212   1HG2  VAL  29          HG23      VAL  29 116.438  -1.588  -8.339
  213   2HG2  VAL  29          HG22      VAL  29 115.358  -0.197  -8.250
  214   3HG2  VAL  29          HG21      VAL  29 116.452  -0.377  -9.622
  215    H    LEU  30           HN       LEU  30 119.680  -0.062  -5.872
  216    HA   LEU  30           HA       LEU  30 120.982   2.492  -6.027
  217   1HB   LEU  30           HB2      LEU  30 121.328   0.198  -4.076
  218   2HB   LEU  30           HB1      LEU  30 121.993   1.812  -3.839
  219    HG   LEU  30           HG       LEU  30 119.043   1.302  -4.309
  220   1HD1  LEU  30          HD12      LEU  30 120.606   1.435  -1.720
  221   2HD1  LEU  30          HD11      LEU  30 118.860   1.668  -1.805
  222   3HD1  LEU  30          HD13      LEU  30 119.567   0.128  -2.290
  223   1HD2  LEU  30          HD21      LEU  30 120.713   3.679  -3.471
  224   2HD2  LEU  30          HD23      LEU  30 119.448   3.589  -4.697
  225   3HD2  LEU  30          HD22      LEU  30 119.021   3.575  -2.990
  226    H    GLY  31           HN       GLY  31 122.121  -0.826  -6.426
  227   1HA   GLY  31           HA2      GLY  31 124.918  -0.265  -6.463
  228   2HA   GLY  31           HA1      GLY  31 124.157  -1.626  -7.295
  229    H    LYS  32           HN       LYS  32 122.421  -0.059  -8.949
  230    HA   LYS  32           HA       LYS  32 124.147   0.444 -11.174
  231   1HB   LYS  32           HB2      LYS  32 121.700  -0.149 -11.307
  232   2HB   LYS  32           HB1      LYS  32 121.333   1.490 -10.769
  233   1HG   LYS  32           HG2      LYS  32 122.541   2.409 -12.709
  234   2HG   LYS  32           HG1      LYS  32 122.917   0.774 -13.255
  235   1HD   LYS  32           HD2      LYS  32 120.501   0.287 -13.444
  236   2HD   LYS  32           HD1      LYS  32 120.132   1.930 -12.920
  237   1HE   LYS  32           HE2      LYS  32 121.821   1.286 -15.351
  238   2HE   LYS  32           HE1      LYS  32 120.089   1.608 -15.424
  239   1HZ   LYS  32           HZ1      LYS  32 120.946   3.680 -13.978
  240   2HZ   LYS  32           HZ3      LYS  32 122.292   3.433 -14.980
  241   3HZ   LYS  32           HZ2      LYS  32 120.764   3.716 -15.667
  242    H    LYS  33           HN       LYS  33 122.625   2.645  -8.811
  243    HA   LYS  33           HA       LYS  33 123.426   5.058 -10.135
  244   1HB   LYS  33           HB2      LYS  33 122.853   4.497  -7.211
  245   2HB   LYS  33           HB1      LYS  33 123.074   6.112  -7.884
  246   1HG   LYS  33           HG2      LYS  33 121.185   5.735  -9.426
  247   2HG   LYS  33           HG1      LYS  33 120.958   4.119  -8.753
  248   1HD   LYS  33           HD2      LYS  33 120.529   5.103  -6.530
  249   2HD   LYS  33           HD1      LYS  33 120.749   6.718  -7.203
  250   1HE   LYS  33           HE2      LYS  33 118.847   6.372  -8.717
  251   2HE   LYS  33           HE1      LYS  33 118.642   4.730  -8.103
  252   1HZ   LYS  33           HZ3      LYS  33 118.696   6.346  -5.881
  253   2HZ   LYS  33           HZ2      LYS  33 117.732   7.185  -7.001
  254   3HZ   LYS  33           HZ1      LYS  33 117.334   5.594  -6.557
  255    H    LEU  34           HN       LEU  34 124.963   3.248  -7.445
  256    HA   LEU  34           HA       LEU  34 127.222   4.981  -7.210
  257   1HB   LEU  34           HB2      LEU  34 126.894   2.032  -6.588
  258   2HB   LEU  34           HB1      LEU  34 128.344   2.943  -6.190
  259    HG   LEU  34           HG       LEU  34 125.631   3.910  -5.282
  260   1HD1  LEU  34          HD13      LEU  34 127.415   1.826  -3.998
  261   2HD1  LEU  34          HD12      LEU  34 126.231   2.755  -3.078
  262   3HD1  LEU  34          HD11      LEU  34 125.699   1.694  -4.381
  263   1HD2  LEU  34          HD23      LEU  34 128.490   4.290  -4.313
  264   2HD2  LEU  34          HD22      LEU  34 127.434   5.514  -5.007
  265   3HD2  LEU  34          HD21      LEU  34 127.077   4.846  -3.420
  266    H    GLU  35           HN       GLU  35 126.567   2.192  -9.258
  267    HA   GLU  35           HA       GLU  35 129.181   1.917 -10.377
  268   1HB   GLU  35           HB2      GLU  35 127.400   0.240 -10.713
  269   2HB   GLU  35           HB1      GLU  35 126.498   1.393 -11.696
  270   1HG   GLU  35           HG2      GLU  35 128.320   1.466 -13.335
  271   2HG   GLU  35           HG1      GLU  35 129.284   0.377 -12.334
  272    H    GLU  36           HN       GLU  36 126.465   4.009 -11.316
  273    HA   GLU  36           HA       GLU  36 127.760   5.082 -13.664
  274   1HB   GLU  36           HB2      GLU  36 125.522   6.141 -11.915
  275   2HB   GLU  36           HB1      GLU  36 126.060   6.941 -13.391
  276   1HG   GLU  36           HG2      GLU  36 125.567   4.895 -14.683
  277   2HG   GLU  36           HG1      GLU  36 125.024   4.096 -13.208
  278    H    ARG  37           HN       ARG  37 128.111   5.592 -10.294
  279    HA   ARG  37           HA       ARG  37 129.341   8.263 -10.600
  280   1HB   ARG  37           HB2      ARG  37 128.875   6.471  -8.206
  281   2HB   ARG  37           HB1      ARG  37 129.705   8.019  -8.099
  282   1HG   ARG  37           HG2      ARG  37 126.970   7.810  -9.359
  283   2HG   ARG  37           HG1      ARG  37 127.150   7.950  -7.614
  284   1HD   ARG  37           HD2      ARG  37 128.531  10.031  -8.000
  285   2HD   ARG  37           HD1      ARG  37 128.099   9.932  -9.706
  286    HE   ARG  37           HE       ARG  37 125.658   9.831  -8.411
  287   1HH1  ARG  37          HH21      ARG  37 128.419  11.899  -8.374
  288   2HH1  ARG  37          HH22      ARG  37 127.508  13.325  -8.005
  289   1HH2  ARG  37          HH11      ARG  37 124.457  11.683  -7.934
  290   2HH2  ARG  37          HH12      ARG  37 125.267  13.203  -7.755
  291    H    GLY  38           HN       GLY  38 130.450   5.190 -11.184
  292   1HA   GLY  38           HA2      GLY  38 132.764   4.914 -11.891
  293   2HA   GLY  38           HA1      GLY  38 133.266   6.072 -10.668
  294    H    PHE  39           HN       PHE  39 131.013   3.983  -9.279
  295    HA   PHE  39           HA       PHE  39 133.231   2.358  -8.075
  296   1HB   PHE  39           HB2      PHE  39 130.415   2.892  -7.112
  297   2HB   PHE  39           HB1      PHE  39 131.602   1.910  -6.263
  298    HD1  PHE  39           HD2      PHE  39 133.571   2.939  -5.216
  299    HD2  PHE  39           HD1      PHE  39 130.622   5.303  -7.238
  300    HE1  PHE  39           HE2      PHE  39 134.515   4.991  -4.189
  301    HE2  PHE  39           HE1      PHE  39 131.557   7.357  -6.216
  302    HZ   PHE  39           HZ       PHE  39 133.508   7.203  -4.688
  303    H    ASP  40           HN       ASP  40 133.132   1.034 -10.129
  304    HA   ASP  40           HA       ASP  40 130.713  -0.539 -10.580
  305   1HB   ASP  40           HB2      ASP  40 132.026  -1.649 -12.329
  306   2HB   ASP  40           HB1      ASP  40 132.208   0.101 -12.442
  307    H    LYS  41           HN       LYS  41 133.323  -0.843  -8.384
  308    HA   LYS  41           HA       LYS  41 132.522  -3.682  -7.894
  309   1HB   LYS  41           HB2      LYS  41 135.370  -2.675  -8.096
  310   2HB   LYS  41           HB1      LYS  41 134.905  -4.274  -7.504
  311   1HG   LYS  41           HG2      LYS  41 133.770  -4.735  -9.653
  312   2HG   LYS  41           HG1      LYS  41 134.263  -3.152 -10.249
  313   1HD   LYS  41           HD2      LYS  41 136.634  -3.791  -9.973
  314   2HD   LYS  41           HD1      LYS  41 136.121  -5.378  -9.394
  315   1HE   LYS  41           HE2      LYS  41 135.312  -4.283 -12.091
  316   2HE   LYS  41           HE1      LYS  41 136.736  -5.297 -11.851
  317   1HZ   LYS  41           HZ2      LYS  41 135.031  -6.809 -10.626
  318   2HZ   LYS  41           HZ1      LYS  41 133.897  -5.985 -11.588
  319   3HZ   LYS  41           HZ3      LYS  41 135.154  -6.857 -12.320
  320    H    ALA  42           HN       ALA  42 133.016  -4.440  -5.751
  321    HA   ALA  42           HA       ALA  42 132.267  -2.581  -3.730
  322   1HB   ALA  42           HB3      ALA  42 133.432  -5.361  -3.564
  323   2HB   ALA  42           HB2      ALA  42 132.841  -4.469  -2.162
  324   3HB   ALA  42           HB1      ALA  42 131.733  -4.901  -3.464
  325    H    TYR  43           HN       TYR  43 135.518  -3.986  -4.405
  326    HA   TYR  43           HA       TYR  43 136.710  -2.872  -2.093
  327   1HB   TYR  43           HB2      TYR  43 138.869  -3.245  -3.092
  328   2HB   TYR  43           HB1      TYR  43 137.816  -4.596  -3.488
  329    HD1  TYR  43           HD1      TYR  43 139.103  -1.348  -4.843
  330    HD2  TYR  43           HD2      TYR  43 137.503  -5.235  -5.731
  331    HE1  TYR  43           HE1      TYR  43 139.573  -0.994  -7.244
  332    HE2  TYR  43           HE2      TYR  43 137.986  -4.877  -8.135
  333    HH   TYR  43           HH       TYR  43 139.857  -3.229  -9.413
  334    H    VAL  44           HN       VAL  44 135.674  -1.223  -4.948
  335    HA   VAL  44           HA       VAL  44 137.471   1.068  -4.543
  336    HB   VAL  44           HB       VAL  44 134.869   0.952  -6.110
  337   1HG1  VAL  44          HG11      VAL  44 135.877   3.221  -5.493
  338   2HG1  VAL  44          HG13      VAL  44 137.253   2.774  -6.498
  339   3HG1  VAL  44          HG12      VAL  44 135.652   2.926  -7.215
  340   1HG2  VAL  44          HG23      VAL  44 137.724   0.445  -7.006
  341   2HG2  VAL  44          HG22      VAL  44 136.422  -0.744  -6.949
  342   3HG2  VAL  44          HG21      VAL  44 136.339   0.600  -8.087
  343    H    VAL  45           HN       VAL  45 134.276   0.040  -3.682
  344    HA   VAL  45           HA       VAL  45 133.468   2.556  -2.420
  345    HB   VAL  45           HB       VAL  45 132.304  -0.240  -2.204
  346   1HG1  VAL  45          HG12      VAL  45 131.379   2.451  -1.181
  347   2HG1  VAL  45          HG11      VAL  45 130.260   1.111  -1.434
  348   3HG1  VAL  45          HG13      VAL  45 131.579   0.952  -0.275
  349   1HG2  VAL  45          HG23      VAL  45 131.707   2.163  -3.939
  350   2HG2  VAL  45          HG22      VAL  45 132.049   0.508  -4.445
  351   3HG2  VAL  45          HG21      VAL  45 130.514   0.894  -3.666
  352    H    LEU  46           HN       LEU  46 134.846  -0.529  -1.406
  353    HA   LEU  46           HA       LEU  46 134.702  -0.141   1.422
  354   1HB   LEU  46           HB2      LEU  46 135.377  -2.292   0.331
  355   2HB   LEU  46           HB1      LEU  46 136.864  -1.525  -0.206
  356    HG   LEU  46           HG       LEU  46 137.335  -1.027   2.266
  357   1HD1  LEU  46          HD12      LEU  46 134.983  -2.897   2.525
  358   2HD1  LEU  46          HD11      LEU  46 136.200  -2.758   3.790
  359   3HD1  LEU  46          HD13      LEU  46 135.249  -1.350   3.327
  360   1HD2  LEU  46          HD21      LEU  46 137.491  -3.645   0.861
  361   2HD2  LEU  46          HD23      LEU  46 138.769  -2.657   1.560
  362   3HD2  LEU  46          HD22      LEU  46 137.785  -3.685   2.599
  363    H    GLY  47           HN       GLY  47 136.945   0.892  -1.073
  364   1HA   GLY  47           HA2      GLY  47 138.999   1.989   0.553
  365   2HA   GLY  47           HA1      GLY  47 138.623   2.536  -1.081
  366    H    GLN  48           HN       GLN  48 135.967   3.469  -0.647
  367    HA   GLN  48           HA       GLN  48 136.474   6.095   0.349
  368   1HB   GLN  48           HB2      GLN  48 134.593   5.477  -1.189
  369   2HB   GLN  48           HB1      GLN  48 133.794   4.677   0.162
  370   1HG   GLN  48           HG2      GLN  48 132.875   6.921  -0.090
  371   2HG   GLN  48           HG1      GLN  48 133.811   6.849   1.402
  372   1HE2  GLN  48          HE22      GLN  48 135.706   9.622   0.356
  373   2HE2  GLN  48          HE21      GLN  48 134.868   8.835   1.607
  374    H    PHE  49           HN       PHE  49 135.023   3.236   1.885
  375    HA   PHE  49           HA       PHE  49 134.295   4.450   4.362
  376   1HB   PHE  49           HB2      PHE  49 133.559   2.195   3.660
  377   2HB   PHE  49           HB1      PHE  49 135.215   1.610   3.802
  378    HD1  PHE  49           HD1      PHE  49 132.597   3.399   5.803
  379    HD2  PHE  49           HD2      PHE  49 135.891   0.642   5.828
  380    HE1  PHE  49           HE1      PHE  49 132.200   2.947   8.208
  381    HE2  PHE  49           HE2      PHE  49 135.496   0.191   8.231
  382    HZ   PHE  49           HZ       PHE  49 133.650   1.344   9.423
  383    H    LEU  50           HN       LEU  50 137.297   2.985   3.234
  384    HA   LEU  50           HA       LEU  50 138.697   3.251   5.759
  385   1HB   LEU  50           HB2      LEU  50 139.818   3.111   2.941
  386   2HB   LEU  50           HB1      LEU  50 140.752   2.896   4.421
  387    HG   LEU  50           HG       LEU  50 138.425   1.151   3.541
  388   1HD1  LEU  50          HD13      LEU  50 140.518   0.908   2.195
  389   2HD1  LEU  50          HD12      LEU  50 141.392   0.532   3.679
  390   3HD1  LEU  50          HD11      LEU  50 140.118  -0.548   3.107
  391   1HD2  LEU  50          HD22      LEU  50 140.139   1.248   6.021
  392   2HD2  LEU  50          HD21      LEU  50 138.404   0.962   5.876
  393   3HD2  LEU  50          HD23      LEU  50 139.545  -0.311   5.449
  394    H    VAL  51           HN       VAL  51 138.372   5.326   2.916
  395    HA   VAL  51           HA       VAL  51 140.236   7.332   3.775
  396    HB   VAL  51           HB       VAL  51 137.878   7.429   1.876
  397   1HG1  VAL  51          HG11      VAL  51 139.916   9.543   2.606
  398   2HG1  VAL  51          HG13      VAL  51 139.040   9.566   1.074
  399   3HG1  VAL  51          HG12      VAL  51 138.159   9.689   2.597
  400   1HG2  VAL  51          HG21      VAL  51 139.861   6.019   1.282
  401   2HG2  VAL  51          HG23      VAL  51 139.615   7.363   0.169
  402   3HG2  VAL  51          HG22      VAL  51 140.875   7.457   1.401
  403    H    LEU  52           HN       LEU  52 136.837   6.761   4.530
  404    HA   LEU  52           HA       LEU  52 136.525   9.414   5.768
  405   1HB   LEU  52           HB2      LEU  52 134.725   6.979   5.719
  406   2HB   LEU  52           HB1      LEU  52 134.279   8.530   6.424
  407    HG   LEU  52           HG       LEU  52 135.137   8.177   3.536
  408   1HD1  LEU  52          HD12      LEU  52 132.402   8.186   4.820
  409   2HD1  LEU  52          HD11      LEU  52 132.647   8.504   3.103
  410   3HD1  LEU  52          HD13      LEU  52 133.103   6.942   3.787
  411   1HD2  LEU  52          HD23      LEU  52 134.062  10.471   5.184
  412   2HD2  LEU  52          HD22      LEU  52 135.416  10.459   4.054
  413   3HD2  LEU  52          HD21      LEU  52 133.765  10.419   3.446
  414    H    LYS  53           HN       LYS  53 138.370   7.020   6.781
  415    HA   LYS  53           HA       LYS  53 138.985   6.176   8.891
  416   1HB   LYS  53           HB2      LYS  53 137.930   8.932   9.592
  417   2HB   LYS  53           HB1      LYS  53 138.897   7.929  10.675
  418   1HG   LYS  53           HG2      LYS  53 140.727   7.895   9.019
  419   2HG   LYS  53           HG1      LYS  53 139.764   8.901   7.935
  420   1HD   LYS  53           HD2      LYS  53 139.711  10.688   9.633
  421   2HD   LYS  53           HD1      LYS  53 140.675   9.688  10.720
  422   1HE   LYS  53           HE2      LYS  53 141.564  10.573   7.960
  423   2HE   LYS  53           HE1      LYS  53 142.050  11.353   9.465
  424   1HZ   LYS  53           HZ3      LYS  53 142.487   8.481   8.867
  425   2HZ   LYS  53           HZ2      LYS  53 143.657   9.690   8.631
  426   3HZ   LYS  53           HZ1      LYS  53 143.086   9.351  10.195
  427    H    LYS  54           HN       LYS  54 136.361   5.368   8.062
  428    HA   LYS  54           HA       LYS  54 134.454   4.326   8.914
  429   1HB   LYS  54           HB2      LYS  54 135.878   4.589  11.580
  430   2HB   LYS  54           HB1      LYS  54 134.570   3.478  11.191
  431   1HG   LYS  54           HG2      LYS  54 136.015   2.447   9.438
  432   2HG   LYS  54           HG1      LYS  54 137.335   3.496   9.951
  433   1HD   LYS  54           HD2      LYS  54 137.204   2.534  12.229
  434   2HD   LYS  54           HD1      LYS  54 135.906   1.466  11.694
  435   1HE   LYS  54           HE2      LYS  54 137.393   0.403  10.075
  436   2HE   LYS  54           HE1      LYS  54 138.691   1.520  10.494
  437   1HZ   LYS  54           HZ3      LYS  54 137.625   0.240  12.802
  438   2HZ   LYS  54           HZ2      LYS  54 138.172  -0.902  11.669
  439   3HZ   LYS  54           HZ1      LYS  54 139.228   0.298  12.248
  440    H    ASP  55           HN       ASP  55 134.773   7.433   9.048
  441    HA   ASP  55           HA       ASP  55 133.177   8.243  11.327
  442   1HB   ASP  55           HB2      ASP  55 133.824   9.549   8.675
  443   2HB   ASP  55           HB1      ASP  55 132.769  10.320   9.861
  444    H    GLU  56           HN       GLU  56 131.170   7.316  11.561
  445    HA   GLU  56           HA       GLU  56 129.558   6.343   9.417
  446   1HB   GLU  56           HB2      GLU  56 129.376   5.598  11.784
  447   2HB   GLU  56           HB1      GLU  56 128.654   7.156  12.187
  448   1HG   GLU  56           HG2      GLU  56 126.802   6.735  10.640
  449   2HG   GLU  56           HG1      GLU  56 127.539   5.211  10.143
  450    H    ASP  57           HN       ASP  57 129.443   9.453  11.153
  451    HA   ASP  57           HA       ASP  57 126.988  10.339   9.925
  452   1HB   ASP  57           HB2      ASP  57 129.283  11.836  11.214
  453   2HB   ASP  57           HB1      ASP  57 127.810  12.627  10.652
  454    H    LEU  58           HN       LEU  58 130.395  10.740   9.085
  455    HA   LEU  58           HA       LEU  58 129.844  12.470   6.814
  456   1HB   LEU  58           HB2      LEU  58 132.259  10.728   7.406
  457   2HB   LEU  58           HB1      LEU  58 132.181  11.929   6.121
  458    HG   LEU  58           HG       LEU  58 131.844  12.515   9.080
  459   1HD1  LEU  58          HD12      LEU  58 134.160  11.856   8.374
  460   2HD1  LEU  58          HD11      LEU  58 134.143  13.186   7.218
  461   3HD1  LEU  58          HD13      LEU  58 134.055  13.520   8.947
  462   1HD2  LEU  58          HD21      LEU  58 131.643  14.180   6.576
  463   2HD2  LEU  58          HD23      LEU  58 130.665  14.246   8.044
  464   3HD2  LEU  58          HD22      LEU  58 132.290  14.925   8.038
  465    H    PHE  59           HN       PHE  59 130.207   8.991   7.250
  466    HA   PHE  59           HA       PHE  59 130.121   8.305   4.458
  467   1HB   PHE  59           HB2      PHE  59 130.918   6.698   6.091
  468   2HB   PHE  59           HB1      PHE  59 129.378   6.742   6.945
  469    HD1  PHE  59           HD1      PHE  59 130.912   5.907   3.638
  470    HD2  PHE  59           HD2      PHE  59 127.625   5.285   6.334
  471    HE1  PHE  59           HE1      PHE  59 130.062   4.086   2.182
  472    HE2  PHE  59           HE2      PHE  59 126.774   3.467   4.881
  473    HZ   PHE  59           HZ       PHE  59 127.992   2.865   2.804
  474    H    ARG  60           HN       ARG  60 127.595   8.654   6.936
  475    HA   ARG  60           HA       ARG  60 125.414   7.716   5.386
  476   1HB   ARG  60           HB2      ARG  60 125.601   9.712   7.644
  477   2HB   ARG  60           HB1      ARG  60 124.056   9.289   6.909
  478   1HG   ARG  60           HG2      ARG  60 124.315   6.977   7.513
  479   2HG   ARG  60           HG1      ARG  60 125.977   7.230   8.026
  480   1HD   ARG  60           HD2      ARG  60 125.277   8.612   9.868
  481   2HD   ARG  60           HD1      ARG  60 123.617   8.659   9.294
  482    HE   ARG  60           HE       ARG  60 124.848   6.646  10.978
  483   1HH1  ARG  60          HH21      ARG  60 122.650   6.978   8.335
  484   2HH1  ARG  60          HH22      ARG  60 121.918   5.430   8.597
  485   1HH2  ARG  60          HH11      ARG  60 123.904   4.650  11.323
  486   2HH2  ARG  60          HH12      ARG  60 122.628   4.115  10.282
  487    H    GLU  61           HN       GLU  61 126.586  11.110   5.766
  488    HA   GLU  61           HA       GLU  61 124.634  12.204   3.976
  489   1HB   GLU  61           HB2      GLU  61 127.397  13.157   4.780
  490   2HB   GLU  61           HB1      GLU  61 126.280  14.114   3.803
  491   1HG   GLU  61           HG2      GLU  61 124.614  14.055   5.595
  492   2HG   GLU  61           HG1      GLU  61 125.670  13.028   6.567
  493    H    TRP  62           HN       TRP  62 127.898  10.888   3.480
  494    HA   TRP  62           HA       TRP  62 128.146  11.625   0.740
  495   1HB   TRP  62           HB2      TRP  62 130.101  10.856   1.920
  496   2HB   TRP  62           HB1      TRP  62 129.330   9.319   2.311
  497    HD1  TRP  62           HD1      TRP  62 130.804  11.261  -0.653
  498    HE1  TRP  62           HE1      TRP  62 131.338   9.596  -2.548
  499    HE3  TRP  62           HE3      TRP  62 128.777   7.002   1.314
  500    HZ2  TRP  62           HZ2      TRP  62 130.951   6.820  -3.153
  501    HZ3  TRP  62           HZ3      TRP  62 128.882   4.869   0.061
  502    HH2  TRP  62           HH2      TRP  62 129.961   4.774  -2.168
  503    H    LEU  63           HN       LEU  63 126.922   8.605   2.204
  504    HA   LEU  63           HA       LEU  63 126.348   7.380  -0.329
  505   1HB   LEU  63           HB2      LEU  63 126.641   6.077   1.744
  506   2HB   LEU  63           HB1      LEU  63 125.186   6.812   2.412
  507    HG   LEU  63           HG       LEU  63 123.854   5.827   0.571
  508   1HD1  LEU  63          HD11      LEU  63 126.576   4.896  -0.311
  509   2HD1  LEU  63          HD13      LEU  63 125.163   3.911  -0.686
  510   3HD1  LEU  63          HD12      LEU  63 125.262   5.567  -1.276
  511   1HD2  LEU  63          HD21      LEU  63 125.588   3.877   2.112
  512   2HD2  LEU  63          HD23      LEU  63 124.074   4.591   2.667
  513   3HD2  LEU  63          HD22      LEU  63 124.072   3.458   1.315
  514    H    LYS  64           HN       LYS  64 124.249   9.026   2.037
  515    HA   LYS  64           HA       LYS  64 121.827   8.742   0.553
  516   1HB   LYS  64           HB2      LYS  64 121.946   9.524   2.931
  517   2HB   LYS  64           HB1      LYS  64 122.568  11.069   2.344
  518   1HG   LYS  64           HG2      LYS  64 120.537  11.460   1.060
  519   2HG   LYS  64           HG1      LYS  64 119.929   9.858   1.469
  520   1HD   LYS  64           HD2      LYS  64 118.843  11.449   2.930
  521   2HD   LYS  64           HD1      LYS  64 119.992  10.523   3.895
  522   1HE   LYS  64           HE2      LYS  64 121.517  12.314   4.021
  523   2HE   LYS  64           HE1      LYS  64 120.808  13.142   2.635
  524   1HZ   LYS  64           HZ3      LYS  64 118.790  13.482   3.971
  525   2HZ   LYS  64           HZ2      LYS  64 119.571  12.789   5.310
  526   3HZ   LYS  64           HZ1      LYS  64 120.148  14.241   4.642
  527    H    ASP  65           HN       ASP  65 124.186  11.397   0.615
  528    HA   ASP  65           HA       ASP  65 122.865  12.976  -1.394
  529   1HB   ASP  65           HB2      ASP  65 124.622  13.809   0.230
  530   2HB   ASP  65           HB1      ASP  65 125.825  12.965  -0.748
  531    H    THR  66           HN       THR  66 125.229  10.371  -1.498
  532    HA   THR  66           HA       THR  66 125.839  10.755  -4.310
  533    HB   THR  66           HB       THR  66 126.407   8.457  -2.421
  534    HG1  THR  66           HG1      THR  66 127.713  10.795  -3.224
  535   1HG2  THR  66          HG22      THR  66 127.286   8.994  -5.266
  536   2HG2  THR  66          HG21      THR  66 128.117   7.864  -4.197
  537   3HG2  THR  66          HG23      THR  66 126.439   7.574  -4.655
  538    H    CYS  67           HN       CYS  67 123.589   8.626  -2.509
  539    HA   CYS  67           HA       CYS  67 122.484   7.786  -5.177
  540   1HB   CYS  67           HB2      CYS  67 122.259   5.532  -4.431
  541   2HB   CYS  67           HB1      CYS  67 123.912   6.019  -4.057
  542    HG   CYS  67           HG       CYS  67 122.636   6.637  -1.584
  543    H    GLY  68           HN       GLY  68 121.770   8.165  -1.699
  544   1HA   GLY  68           HA2      GLY  68 119.668   9.367  -1.120
  545   2HA   GLY  68           HA1      GLY  68 118.877   8.507  -2.440
  546    H    ALA  69           HN       ALA  69 121.134   6.649  -0.599
  547    HA   ALA  69           HA       ALA  69 119.309   4.646   0.135
  548   1HB   ALA  69           HB2      ALA  69 121.809   4.461   0.245
  549   2HB   ALA  69           HB1      ALA  69 121.780   5.460   1.698
  550   3HB   ALA  69           HB3      ALA  69 121.007   3.876   1.700
  551    H    ASN  70           HN       ASN  70 118.229   4.179   2.159
  552    HA   ASN  70           HA       ASN  70 117.389   6.629   3.597
  553   1HB   ASN  70           HB2      ASN  70 116.391   3.767   3.733
  554   2HB   ASN  70           HB1      ASN  70 115.676   5.131   4.593
  555   1HD2  ASN  70          HD22      ASN  70 114.342   4.474   0.951
  556   2HD2  ASN  70          HD21      ASN  70 114.979   3.310   2.009
  557    H    ALA  71           HN       ALA  71 117.055   6.268   6.061
  558    HA   ALA  71           HA       ALA  71 119.591   5.949   7.292
  559   1HB   ALA  71           HB2      ALA  71 117.555   7.187   8.201
  560   2HB   ALA  71           HB1      ALA  71 116.946   5.612   8.713
  561   3HB   ALA  71           HB3      ALA  71 118.460   6.229   9.374
  562    H    LYS  72           HN       LYS  72 116.992   3.574   6.797
  563    HA   LYS  72           HA       LYS  72 118.127   1.624   8.602
  564   1HB   LYS  72           HB2      LYS  72 116.194   1.379   6.286
  565   2HB   LYS  72           HB1      LYS  72 116.652   0.016   7.310
  566   1HG   LYS  72           HG2      LYS  72 115.703   1.011   9.247
  567   2HG   LYS  72           HG1      LYS  72 115.590   2.594   8.478
  568   1HD   LYS  72           HD2      LYS  72 113.381   1.501   8.584
  569   2HD   LYS  72           HD1      LYS  72 113.899   1.716   6.912
  570   1HE   LYS  72           HE2      LYS  72 114.469  -0.575   6.678
  571   2HE   LYS  72           HE1      LYS  72 114.440  -0.845   8.420
  572   1HZ   LYS  72           HZ2      LYS  72 112.037  -0.317   8.357
  573   2HZ   LYS  72           HZ1      LYS  72 112.121  -0.277   6.660
  574   3HZ   LYS  72           HZ3      LYS  72 112.447  -1.719   7.490
  575    H    GLN  73           HN       GLN  73 118.444   2.218   5.130
  576    HA   GLN  73           HA       GLN  73 120.006  -0.110   4.556
  577   1HB   GLN  73           HB2      GLN  73 119.767   2.573   3.178
  578   2HB   GLN  73           HB1      GLN  73 120.704   1.231   2.519
  579   1HG   GLN  73           HG2      GLN  73 118.742  -0.167   2.387
  580   2HG   GLN  73           HG1      GLN  73 117.777   1.018   3.270
  581   1HE2  GLN  73          HE22      GLN  73 116.756   2.229   0.099
  582   2HE2  GLN  73          HE21      GLN  73 116.277   1.471   1.541
  583    H    SER  74           HN       SER  74 120.911   3.203   5.508
  584    HA   SER  74           HA       SER  74 123.711   2.888   5.145
  585   1HB   SER  74           HB2      SER  74 122.093   4.666   6.978
  586   2HB   SER  74           HB1      SER  74 123.843   4.780   6.826
  587    HG   SER  74           HG       SER  74 123.545   5.158   4.599
  588    H    ARG  75           HN       ARG  75 121.626   2.197   7.986
  589    HA   ARG  75           HA       ARG  75 123.768   1.657   9.785
  590   1HB   ARG  75           HB2      ARG  75 120.939   0.577   9.664
  591   2HB   ARG  75           HB1      ARG  75 122.048   0.236  10.993
  592   1HG   ARG  75           HG2      ARG  75 122.293   2.667  11.404
  593   2HG   ARG  75           HG1      ARG  75 121.156   2.994  10.096
  594   1HD   ARG  75           HD2      ARG  75 119.472   1.564  11.338
  595   2HD   ARG  75           HD1      ARG  75 120.600   1.543  12.693
  596    HE   ARG  75           HE       ARG  75 120.314   4.234  12.148
  597   1HH1  ARG  75          HH21      ARG  75 118.202   1.570  12.700
  598   2HH1  ARG  75          HH22      ARG  75 116.961   2.532  13.431
  599   1HH2  ARG  75          HH11      ARG  75 118.702   5.508  13.099
  600   2HH2  ARG  75          HH12      ARG  75 117.245   4.757  13.658
  601    H    ASP  76           HN       ASP  76 122.098  -0.431   7.430
  602    HA   ASP  76           HA       ASP  76 123.406  -2.844   8.239
  603   1HB   ASP  76           HB2      ASP  76 122.078  -2.000   5.653
  604   2HB   ASP  76           HB1      ASP  76 122.681  -3.632   5.943
  605    H    CYS  77           HN       CYS  77 124.232  -0.386   5.769
  606    HA   CYS  77           HA       CYS  77 126.451  -1.896   4.714
  607   1HB   CYS  77           HB2      CYS  77 125.777   1.059   4.669
  608   2HB   CYS  77           HB1      CYS  77 127.165   0.370   3.826
  609    HG   CYS  77           HG       CYS  77 124.266   0.164   2.916
  610    H    PHE  78           HN       PHE  78 126.144   0.584   7.269
  611    HA   PHE  78           HA       PHE  78 128.928   0.925   7.727
  612   1HB   PHE  78           HB2      PHE  78 127.228   2.405   8.705
  613   2HB   PHE  78           HB1      PHE  78 126.633   1.079   9.704
  614    HD1  PHE  78           HD1      PHE  78 129.424   3.425   9.137
  615    HD2  PHE  78           HD2      PHE  78 127.876   0.290  11.631
  616    HE1  PHE  78           HE1      PHE  78 131.117   3.966  10.867
  617    HE2  PHE  78           HE2      PHE  78 129.569   0.828  13.360
  618    HZ   PHE  78           HZ       PHE  78 131.192   2.666  12.978
  619    H    GLY  79           HN       GLY  79 126.674  -1.119   9.631
  620   1HA   GLY  79           HA2      GLY  79 128.719  -2.451  11.086
  621   2HA   GLY  79           HA1      GLY  79 127.083  -3.065  10.859
  622    H    CYS  80           HN       CYS  80 127.318  -3.124   7.918
  623    HA   CYS  80           HA       CYS  80 128.421  -5.786   7.666
  624   1HB   CYS  80           HB2      CYS  80 126.607  -4.967   6.203
  625   2HB   CYS  80           HB1      CYS  80 127.709  -3.780   5.506
  626    HG   CYS  80           HG       CYS  80 127.697  -5.950   3.990
  627    H    LEU  81           HN       LEU  81 129.539  -2.598   6.477
  628    HA   LEU  81           HA       LEU  81 132.026  -3.671   5.478
  629   1HB   LEU  81           HB2      LEU  81 131.223  -0.843   6.227
  630   2HB   LEU  81           HB1      LEU  81 132.684  -1.274   5.338
  631    HG   LEU  81           HG       LEU  81 129.865  -1.939   4.436
  632   1HD1  LEU  81          HD12      LEU  81 131.755   0.289   3.632
  633   2HD1  LEU  81          HD11      LEU  81 130.321  -0.160   2.707
  634   3HD1  LEU  81          HD13      LEU  81 130.153   0.455   4.352
  635   1HD2  LEU  81          HD23      LEU  81 132.621  -2.450   3.330
  636   2HD2  LEU  81          HD22      LEU  81 131.201  -3.497   3.330
  637   3HD2  LEU  81          HD21      LEU  81 131.300  -2.152   2.199
  638    H    ARG  82           HN       ARG  82 131.042  -2.113   8.527
  639    HA   ARG  82           HA       ARG  82 133.674  -1.924   9.625
  640   1HB   ARG  82           HB2      ARG  82 131.680  -0.743  10.563
  641   2HB   ARG  82           HB1      ARG  82 131.091  -2.297  11.163
  642   1HG   ARG  82           HG2      ARG  82 133.101  -2.583  12.517
  643   2HG   ARG  82           HG1      ARG  82 133.785  -1.095  11.864
  644   1HD   ARG  82           HD2      ARG  82 131.902   0.183  12.844
  645   2HD   ARG  82           HD1      ARG  82 131.252  -1.310  13.521
  646    HE   ARG  82           HE       ARG  82 133.881  -1.187  14.449
  647   1HH1  ARG  82          HH21      ARG  82 131.034   0.755  14.535
  648   2HH1  ARG  82          HH22      ARG  82 131.459   1.546  16.016
  649   1HH2  ARG  82          HH11      ARG  82 134.460  -0.160  16.372
  650   2HH2  ARG  82          HH12      ARG  82 133.404   1.030  17.056
  651    H    GLU  83           HN       GLU  83 131.260  -4.540   9.765
  652    HA   GLU  83           HA       GLU  83 132.803  -6.162  11.571
  653   1HB   GLU  83           HB2      GLU  83 130.557  -6.810   9.645
  654   2HB   GLU  83           HB1      GLU  83 131.292  -8.016  10.702
  655   1HG   GLU  83           HG2      GLU  83 130.140  -5.410  11.727
  656   2HG   GLU  83           HG1      GLU  83 129.210  -6.905  11.637
  657    H    TRP  84           HN       TRP  84 132.643  -5.980   8.003
  658    HA   TRP  84           HA       TRP  84 134.263  -8.278   7.493
  659   1HB   TRP  84           HB2      TRP  84 132.950  -6.998   5.759
  660   2HB   TRP  84           HB1      TRP  84 134.162  -5.722   5.862
  661    HD1  TRP  84           HD1      TRP  84 133.606  -9.240   4.591
  662    HE1  TRP  84           HE1      TRP  84 135.595  -9.947   3.115
  663    HE3  TRP  84           HE3      TRP  84 136.764  -5.328   5.451
  664    HZ2  TRP  84           HZ2      TRP  84 138.188  -8.986   2.401
  665    HZ3  TRP  84           HZ3      TRP  84 138.990  -5.250   4.362
  666    HH2  TRP  84           HH2      TRP  84 139.706  -7.073   2.837
  667    H    CYS  85           HN       CYS  85 135.069  -4.847   7.992
  668    HA   CYS  85           HA       CYS  85 137.878  -5.077   7.598
  669   1HB   CYS  85           HB2      CYS  85 136.251  -3.193   9.330
  670   2HB   CYS  85           HB1      CYS  85 137.985  -3.014   9.065
  671    HG   CYS  85           HG       CYS  85 137.450  -1.931   6.909
  672    H    ASP  86           HN       ASP  86 135.874  -5.543  10.480
  673    HA   ASP  86           HA       ASP  86 137.957  -5.881  12.380
  674   1HB   ASP  86           HB2      ASP  86 135.171  -7.054  12.228
  675   2HB   ASP  86           HB1      ASP  86 136.235  -7.287  13.616
  676    H    ALA  87           HN       ALA  87 136.629  -8.130   9.996
  677    HA   ALA  87           HA       ALA  87 138.084 -10.406  11.179
  678   1HB   ALA  87           HB3      ALA  87 135.816 -10.562  10.003
  679   2HB   ALA  87           HB2      ALA  87 136.705 -10.352   8.491
  680   3HB   ALA  87           HB1      ALA  87 137.033 -11.745   9.520
  681    H    PHE  88           HN       PHE  88 138.403  -8.263   8.363
  682    HA   PHE  88           HA       PHE  88 140.932  -9.690   7.623
  683   1HB   PHE  88           HB2      PHE  88 139.227  -7.723   6.073
  684   2HB   PHE  88           HB1      PHE  88 140.726  -8.441   5.483
  685    HD1  PHE  88           HD2      PHE  88 140.876 -10.895   5.084
  686    HD2  PHE  88           HD1      PHE  88 137.181  -9.001   6.170
  687    HE1  PHE  88           HE2      PHE  88 139.624 -12.902   4.338
  688    HE2  PHE  88           HE1      PHE  88 135.929 -11.006   5.428
  689    HZ   PHE  88           HZ       PHE  88 137.151 -12.953   4.505
  690    H    LEU  89           HN       LEU  89 140.165  -6.309   6.908
  691    HA   LEU  89           HA       LEU  89 142.783  -5.527   8.008
  692   1HB   LEU  89           HB2      LEU  89 142.186  -4.548   5.881
  693   2HB   LEU  89           HB1      LEU  89 140.633  -4.002   6.507
  694    HG   LEU  89           HG       LEU  89 141.747  -2.423   8.012
  695   1HD1  LEU  89          HD11      LEU  89 144.239  -3.787   6.977
  696   2HD1  LEU  89          HD13      LEU  89 144.300  -2.163   7.664
  697   3HD1  LEU  89          HD12      LEU  89 143.756  -3.516   8.652
  698   1HD2  LEU  89          HD22      LEU  89 141.331  -1.829   5.585
  699   2HD2  LEU  89          HD21      LEU  89 142.610  -0.895   6.361
  700   3HD2  LEU  89          HD23      LEU  89 143.021  -2.220   5.271
  701   1H    MET   1           HT1      MET   1 168.882  -1.107  -3.769
  702   2H    MET   1           HT3      MET   1 169.086  -0.065  -2.446
  703   3H    MET   1           HT2      MET   1 170.357  -0.294  -3.550
  704    HA   MET   1           HA       MET   1 170.912  -2.343  -2.742
  705   1HB   MET   1           HB2      MET   1 169.661  -0.895  -0.387
  706   2HB   MET   1           HB1      MET   1 170.831  -2.208  -0.265
  707   1HG   MET   1           HG2      MET   1 172.162  -0.274  -0.083
  708   2HG   MET   1           HG1      MET   1 172.337  -0.728  -1.778
  709   1HE   MET   1           HE1      MET   1 172.975   1.993  -0.456
  710   2HE   MET   1           HE3      MET   1 171.815   3.310  -0.682
  711   3HE   MET   1           HE2      MET   1 171.578   2.134   0.608
  712    H    THR   2           HN       THR   2 169.861  -3.747  -0.509
  713    HA   THR   2           HA       THR   2 167.704  -5.212  -1.836
  714    HB   THR   2           HB       THR   2 167.926  -6.794  -0.027
  715    HG1  THR   2           HG1      THR   2 169.597  -6.004   1.630
  716   1HG2  THR   2          HG23      THR   2 169.765  -6.731  -1.700
  717   2HG2  THR   2          HG22      THR   2 170.654  -5.628  -0.648
  718   3HG2  THR   2          HG21      THR   2 170.321  -7.277  -0.118
  719    H    THR   3           HN       THR   3 165.693  -5.779  -0.543
  720    HA   THR   3           HA       THR   3 164.378  -3.348   0.309
  721    HB   THR   3           HB       THR   3 162.495  -4.909   0.902
  722    HG1  THR   3           HG1      THR   3 164.022  -6.651   1.401
  723   1HG2  THR   3          HG23      THR   3 162.740  -3.992  -1.376
  724   2HG2  THR   3          HG22      THR   3 163.774  -5.353  -1.808
  725   3HG2  THR   3          HG21      THR   3 162.077  -5.625  -1.414
  726    H    SER   4           HN       SER   4 163.634  -2.843   2.431
  727    HA   SER   4           HA       SER   4 165.448  -3.703   4.552
  728   1HB   SER   4           HB2      SER   4 164.255  -2.092   5.934
  729   2HB   SER   4           HB1      SER   4 164.572  -1.362   4.362
  730    HG   SER   4           HG       SER   4 162.284  -2.673   4.188
  731    H    GLN   5           HN       GLN   5 164.589  -4.516   6.627
  732    HA   GLN   5           HA       GLN   5 163.078  -6.908   6.323
  733   1HB   GLN   5           HB2      GLN   5 164.696  -6.359   8.187
  734   2HB   GLN   5           HB1      GLN   5 163.447  -5.326   8.882
  735   1HG   GLN   5           HG2      GLN   5 161.916  -7.257   9.002
  736   2HG   GLN   5           HG1      GLN   5 163.167  -8.291   8.315
  737   1HE2  GLN   5          HE22      GLN   5 163.753  -8.916  11.819
  738   2HE2  GLN   5          HE21      GLN   5 162.857  -9.476  10.491
  739    H    LYS   6           HN       LYS   6 162.058  -3.611   6.782
  740    HA   LYS   6           HA       LYS   6 159.533  -4.025   8.005
  741   1HB   LYS   6           HB2      LYS   6 160.477  -1.941   6.019
  742   2HB   LYS   6           HB1      LYS   6 158.914  -1.873   6.833
  743   1HG   LYS   6           HG2      LYS   6 160.050  -1.861   9.025
  744   2HG   LYS   6           HG1      LYS   6 161.616  -1.925   8.213
  745   1HD   LYS   6           HD2      LYS   6 161.123   0.210   7.081
  746   2HD   LYS   6           HD1      LYS   6 159.559   0.280   7.891
  747   1HE   LYS   6           HE2      LYS   6 160.682   0.343  10.080
  748   2HE   LYS   6           HE1      LYS   6 162.252   0.242   9.284
  749   1HZ   LYS   6           HZ2      LYS   6 160.263   2.414   8.901
  750   2HZ   LYS   6           HZ1      LYS   6 161.676   2.528   9.836
  751   3HZ   LYS   6           HZ3      LYS   6 161.786   2.320   8.156
  752    H    HIS   7           HN       HIS   7 160.551  -4.246   4.606
  753    HA   HIS   7           HA       HIS   7 157.969  -4.402   3.441
  754   1HB   HIS   7           HB2      HIS   7 159.949  -4.115   2.067
  755   2HB   HIS   7           HB1      HIS   7 160.580  -5.678   2.581
  756    HD2  HIS   7           HD2      HIS   7 159.461  -7.905   1.267
  757    HE1  HIS   7           HE1      HIS   7 156.871  -5.742  -1.265
  758    HE2  HIS   7           HE2      HIS   7 157.834  -8.028  -0.764
  759    H    ARG   8           HN       ARG   8 160.079  -7.106   4.515
  760    HA   ARG   8           HA       ARG   8 158.115  -9.115   3.922
  761   1HB   ARG   8           HB2      ARG   8 160.556  -9.108   5.721
  762   2HB   ARG   8           HB1      ARG   8 159.571 -10.543   5.444
  763   1HG   ARG   8           HG2      ARG   8 160.726  -8.984   3.129
  764   2HG   ARG   8           HG1      ARG   8 161.688 -10.197   3.969
  765   1HD   ARG   8           HD2      ARG   8 159.790 -11.842   3.541
  766   2HD   ARG   8           HD1      ARG   8 159.075 -10.623   2.490
  767    HE   ARG   8           HE       ARG   8 161.701 -10.894   1.585
  768   1HH1  ARG   8          HH21      ARG   8 158.948 -12.907   2.111
  769   2HH1  ARG   8          HH22      ARG   8 159.384 -14.051   0.886
  770   1HH2  ARG   8          HH11      ARG   8 162.289 -12.387  -0.015
  771   2HH2  ARG   8          HH12      ARG   8 161.272 -13.757  -0.316
  772    H    ASP   9           HN       ASP   9 158.827  -7.137   6.726
  773    HA   ASP   9           HA       ASP   9 157.172  -8.648   8.561
  774   1HB   ASP   9           HB2      ASP   9 158.229  -5.824   8.650
  775   2HB   ASP   9           HB1      ASP   9 157.285  -6.543   9.952
  776    H    PHE  10           HN       PHE  10 156.564  -5.807   6.479
  777    HA   PHE  10           HA       PHE  10 153.931  -5.317   7.551
  778   1HB   PHE  10           HB2      PHE  10 155.327  -3.663   6.285
  779   2HB   PHE  10           HB1      PHE  10 155.027  -4.594   4.821
  780    HD1  PHE  10           HD1      PHE  10 153.538  -2.382   7.365
  781    HD2  PHE  10           HD2      PHE  10 152.810  -4.650   3.789
  782    HE1  PHE  10           HE1      PHE  10 151.393  -1.178   7.037
  783    HE2  PHE  10           HE2      PHE  10 150.666  -3.447   3.462
  784    HZ   PHE  10           HZ       PHE  10 149.959  -1.711   5.085
  785    H    VAL  11           HN       VAL  11 155.111  -7.184   4.737
  786    HA   VAL  11           HA       VAL  11 152.366  -7.870   3.945
  787    HB   VAL  11           HB       VAL  11 153.409  -9.138   2.156
  788   1HG1  VAL  11          HG11      VAL  11 154.731  -6.474   2.740
  789   2HG1  VAL  11          HG13      VAL  11 154.871  -7.311   1.194
  790   3HG1  VAL  11          HG12      VAL  11 153.294  -6.762   1.760
  791   1HG2  VAL  11          HG23      VAL  11 155.862  -8.768   3.864
  792   2HG2  VAL  11          HG22      VAL  11 155.230 -10.250   3.152
  793   3HG2  VAL  11          HG21      VAL  11 156.018  -9.048   2.129
  794    H    ALA  12           HN       ALA  12 153.898  -8.834   6.564
  795    HA   ALA  12           HA       ALA  12 153.110 -11.725   6.285
  796   1HB   ALA  12           HB1      ALA  12 155.548 -11.391   6.602
  797   2HB   ALA  12           HB3      ALA  12 155.218 -10.528   8.104
  798   3HB   ALA  12           HB2      ALA  12 154.813 -12.238   7.961
  799    H    GLU  13           HN       GLU  13 152.256  -8.815   7.740
  800    HA   GLU  13           HA       GLU  13 150.476 -10.237   9.583
  801   1HB   GLU  13           HB2      GLU  13 151.243  -8.637  11.493
  802   2HB   GLU  13           HB1      GLU  13 152.211 -10.071  11.156
  803   1HG   GLU  13           HG2      GLU  13 153.884  -8.850  10.050
  804   2HG   GLU  13           HG1      GLU  13 152.829  -7.461   9.775
  805    HA   PRO  14           HA       PRO  14 147.586  -7.030   8.514
  806   1HB   PRO  14           HB2      PRO  14 147.355  -6.552  11.477
  807   2HB   PRO  14           HB1      PRO  14 146.070  -6.727  10.263
  808   1HG   PRO  14           HG2      PRO  14 146.720  -8.731  11.910
  809   2HG   PRO  14           HG1      PRO  14 146.222  -9.024  10.234
  810   1HD   PRO  14           HD2      PRO  14 148.926  -9.288  11.449
  811   2HD   PRO  14           HD1      PRO  14 148.258 -10.060   9.992
  812    H    MET  15           HN       MET  15 147.389  -4.649   8.574
  813    HA   MET  15           HA       MET  15 149.986  -3.351   9.193
  814   1HB   MET  15           HB2      MET  15 148.891  -1.404   7.970
  815   2HB   MET  15           HB1      MET  15 149.140  -2.865   7.014
  816   1HG   MET  15           HG2      MET  15 146.850  -3.506   7.207
  817   2HG   MET  15           HG1      MET  15 146.549  -2.301   8.461
  818   1HE   MET  15           HE1      MET  15 147.886  -2.946   5.044
  819   2HE   MET  15           HE3      MET  15 146.177  -2.922   4.588
  820   3HE   MET  15           HE2      MET  15 147.269  -1.673   3.993
  821    H    GLY  16           HN       GLY  16 146.756  -3.545  10.408
  822   1HA   GLY  16           HA2      GLY  16 145.686  -2.472  12.201
  823   2HA   GLY  16           HA1      GLY  16 147.307  -2.318  12.876
  824    H    GLU  17           HN       GLU  17 147.280  -0.228  13.623
  825    HA   GLU  17           HA       GLU  17 146.411   1.955  11.769
  826   1HB   GLU  17           HB2      GLU  17 146.859   1.950  14.770
  827   2HB   GLU  17           HB1      GLU  17 146.345   3.348  13.825
  828   1HG   GLU  17           HG2      GLU  17 144.329   2.115  13.101
  829   2HG   GLU  17           HG1      GLU  17 144.840   0.723  14.057
  830    H    LYS  18           HN       LYS  18 149.054   0.595  11.598
  831    HA   LYS  18           HA       LYS  18 151.108   2.138  12.800
  832   1HB   LYS  18           HB2      LYS  18 151.038   0.648  10.157
  833   2HB   LYS  18           HB1      LYS  18 152.512   1.307  10.862
  834   1HG   LYS  18           HG2      LYS  18 150.786  -0.465  12.578
  835   2HG   LYS  18           HG1      LYS  18 151.772  -1.223  11.331
  836   1HD   LYS  18           HD2      LYS  18 153.068   0.799  13.151
  837   2HD   LYS  18           HD1      LYS  18 152.756  -0.821  13.773
  838   1HE   LYS  18           HE2      LYS  18 153.999  -1.791  11.867
  839   2HE   LYS  18           HE1      LYS  18 154.319  -0.169  11.255
  840   1HZ   LYS  18           HZ2      LYS  18 155.035  -0.667  14.030
  841   2HZ   LYS  18           HZ1      LYS  18 155.980  -1.459  12.862
  842   3HZ   LYS  18           HZ3      LYS  18 155.849   0.232  12.841
  843    HA   PRO  19           HA       PRO  19 150.768   6.022  10.682
  844   1HB   PRO  19           HB2      PRO  19 153.422   6.816  10.588
  845   2HB   PRO  19           HB1      PRO  19 152.413   6.897  12.046
  846   1HG   PRO  19           HG2      PRO  19 154.407   4.822  11.244
  847   2HG   PRO  19           HG1      PRO  19 154.121   5.551  12.834
  848   1HD   PRO  19           HD2      PRO  19 153.178   3.088  12.212
  849   2HD   PRO  19           HD1      PRO  19 152.277   4.189  13.277
  850    H    VAL  20           HN       VAL  20 151.104   7.030   8.644
  851    HA   VAL  20           HA       VAL  20 151.265   5.370   6.396
  852    HB   VAL  20           HB       VAL  20 150.313   7.602   6.275
  853   1HG1  VAL  20          HG11      VAL  20 152.017   8.599   7.883
  854   2HG1  VAL  20          HG13      VAL  20 153.129   8.688   6.518
  855   3HG1  VAL  20          HG12      VAL  20 151.622   9.602   6.488
  856   1HG2  VAL  20          HG22      VAL  20 151.392   6.527   4.235
  857   2HG2  VAL  20          HG21      VAL  20 151.219   8.281   4.160
  858   3HG2  VAL  20          HG23      VAL  20 152.787   7.564   4.530
  859    H    GLY  21           HN       GLY  21 153.874   7.183   7.964
  860   1HA   GLY  21           HA2      GLY  21 155.886   6.703   6.003
  861   2HA   GLY  21           HA1      GLY  21 156.201   7.072   7.696
  862    H    SER  22           HN       SER  22 154.258   4.411   7.826
  863    HA   SER  22           HA       SER  22 156.548   2.654   8.346
  864   1HB   SER  22           HB2      SER  22 153.565   2.107   8.427
  865   2HB   SER  22           HB1      SER  22 154.819   1.029   9.031
  866    HG   SER  22           HG       SER  22 153.704   3.225  10.177
  867    H    LEU  23           HN       LEU  23 154.264   3.246   5.789
  868    HA   LEU  23           HA       LEU  23 154.434   0.717   4.468
  869   1HB   LEU  23           HB2      LEU  23 153.921   3.490   3.360
  870   2HB   LEU  23           HB1      LEU  23 153.685   1.999   2.451
  871    HG   LEU  23           HG       LEU  23 152.328   2.585   5.100
  872   1HD1  LEU  23          HD13      LEU  23 151.681   4.181   3.261
  873   2HD1  LEU  23          HD12      LEU  23 151.124   2.792   2.328
  874   3HD1  LEU  23          HD11      LEU  23 150.349   3.192   3.860
  875   1HD2  LEU  23          HD22      LEU  23 152.179   0.357   3.070
  876   2HD2  LEU  23          HD21      LEU  23 152.211   0.261   4.830
  877   3HD2  LEU  23          HD23      LEU  23 150.740   0.764   4.002
  878    H    ALA  24           HN       ALA  24 155.867  -0.084   3.011
  879    HA   ALA  24           HA       ALA  24 158.568   0.854   3.060
  880   1HB   ALA  24           HB2      ALA  24 157.844  -1.499   2.565
  881   2HB   ALA  24           HB1      ALA  24 157.306  -0.947   0.979
  882   3HB   ALA  24           HB3      ALA  24 159.013  -0.862   1.409
  883    H    GLY  25           HN       GLY  25 159.696   2.177   1.722
  884   1HA   GLY  25           HA2      GLY  25 160.154   3.281  -0.394
  885   2HA   GLY  25           HA1      GLY  25 158.451   3.128  -0.821
  886    H    ILE  26           HN       ILE  26 157.835   4.074   2.061
  887    HA   ILE  26           HA       ILE  26 158.009   6.987   1.410
  888    HB   ILE  26           HB       ILE  26 156.419   5.616   3.601
  889   1HG1  ILE  26          HG12      ILE  26 155.633   4.751   1.479
  890   2HG1  ILE  26          HG11      ILE  26 154.472   5.954   2.038
  891   1HG2  ILE  26          HG21      ILE  26 156.205   8.358   2.320
  892   2HG2  ILE  26          HG23      ILE  26 155.135   7.725   3.572
  893   3HG2  ILE  26          HG22      ILE  26 156.836   8.022   3.932
  894   1HD1  ILE  26          HD12      ILE  26 155.869   7.628   0.602
  895   2HD1  ILE  26          HD11      ILE  26 156.499   6.177  -0.178
  896   3HD1  ILE  26          HD13      ILE  26 154.771   6.523  -0.221
  897    H    GLY  27           HN       GLY  27 159.642   8.131   2.407
  898   1HA   GLY  27           HA2      GLY  27 160.980   6.932   4.757
  899   2HA   GLY  27           HA1      GLY  27 161.555   8.311   3.821
  900    H    GLU  28           HN       GLU  28 161.677   8.701   6.433
  901    HA   GLU  28           HA       GLU  28 159.360   9.568   7.803
  902   1HB   GLU  28           HB2      GLU  28 162.238  10.483   8.037
  903   2HB   GLU  28           HB1      GLU  28 160.969  10.949   9.170
  904   1HG   GLU  28           HG2      GLU  28 161.647   8.069   8.522
  905   2HG   GLU  28           HG1      GLU  28 162.332   8.944   9.891
  906    H    VAL  29           HN       VAL  29 161.521  11.398   5.627
  907    HA   VAL  29           HA       VAL  29 160.231  13.935   6.079
  908    HB   VAL  29           HB       VAL  29 161.896  12.880   3.773
  909   1HG1  VAL  29          HG13      VAL  29 160.632  15.586   4.228
  910   2HG1  VAL  29          HG12      VAL  29 162.125  15.428   3.300
  911   3HG1  VAL  29          HG11      VAL  29 160.658  14.614   2.757
  912   1HG2  VAL  29          HG23      VAL  29 163.045  13.143   5.951
  913   2HG2  VAL  29          HG22      VAL  29 163.629  14.327   4.780
  914   3HG2  VAL  29          HG21      VAL  29 162.494  14.816   6.037
  915    H    LEU  30           HN       LEU  30 159.818  11.439   3.596
  916    HA   LEU  30           HA       LEU  30 157.763  12.810   2.137
  917   1HB   LEU  30           HB2      LEU  30 158.399   9.856   2.367
  918   2HB   LEU  30           HB1      LEU  30 157.290  10.545   1.183
  919    HG   LEU  30           HG       LEU  30 160.169  11.449   1.454
  920   1HD1  LEU  30          HD12      LEU  30 158.964   9.267  -0.265
  921   2HD1  LEU  30          HD11      LEU  30 160.524  10.017  -0.610
  922   3HD1  LEU  30          HD13      LEU  30 160.290   9.123   0.891
  923   1HD2  LEU  30          HD21      LEU  30 157.943  11.902  -0.541
  924   2HD2  LEU  30          HD23      LEU  30 159.008  13.084   0.217
  925   3HD2  LEU  30          HD22      LEU  30 159.625  12.030  -1.049
  926    H    GLY  31           HN       GLY  31 157.693  10.555   4.852
  927   1HA   GLY  31           HA2      GLY  31 154.879  10.083   4.884
  928   2HA   GLY  31           HA1      GLY  31 155.924   9.998   6.305
  929    H    LYS  32           HN       LYS  32 156.863  12.703   6.174
  930    HA   LYS  32           HA       LYS  32 154.808  14.028   7.661
  931   1HB   LYS  32           HB2      LYS  32 157.280  14.498   7.818
  932   2HB   LYS  32           HB1      LYS  32 157.169  15.314   6.259
  933   1HG   LYS  32           HG2      LYS  32 155.500  16.875   7.188
  934   2HG   LYS  32           HG1      LYS  32 155.609  16.063   8.750
  935   1HD   LYS  32           HD2      LYS  32 158.010  16.628   8.875
  936   2HD   LYS  32           HD1      LYS  32 157.892  17.456   7.322
  937   1HE   LYS  32           HE2      LYS  32 156.219  18.185   9.738
  938   2HE   LYS  32           HE1      LYS  32 157.736  18.984   9.326
  939   1HZ   LYS  32           HZ1      LYS  32 156.445  19.081   6.994
  940   2HZ   LYS  32           HZ3      LYS  32 155.136  19.189   8.068
  941   3HZ   LYS  32           HZ2      LYS  32 156.397  20.323   8.152
  942    H    LYS  33           HN       LYS  33 155.829  14.326   4.249
  943    HA   LYS  33           HA       LYS  33 154.141  16.565   3.648
  944   1HB   LYS  33           HB2      LYS  33 155.220  14.355   1.877
  945   2HB   LYS  33           HB1      LYS  33 154.411  15.801   1.269
  946   1HG   LYS  33           HG2      LYS  33 156.116  17.213   2.364
  947   2HG   LYS  33           HG1      LYS  33 156.927  15.766   2.964
  948   1HD   LYS  33           HD2      LYS  33 157.285  15.005   0.639
  949   2HD   LYS  33           HD1      LYS  33 156.487  16.462   0.046
  950   1HE   LYS  33           HE2      LYS  33 158.202  17.862   1.103
  951   2HE   LYS  33           HE1      LYS  33 158.988  16.424   1.758
  952   1HZ   LYS  33           HZ3      LYS  33 158.692  15.936  -0.928
  953   2HZ   LYS  33           HZ2      LYS  33 159.196  17.556  -0.839
  954   3HZ   LYS  33           HZ1      LYS  33 160.130  16.332  -0.121
  955    H    LEU  34           HN       LEU  34 153.603  13.047   3.183
  956    HA   LEU  34           HA       LEU  34 150.956  13.316   2.145
  957   1HB   LEU  34           HB2      LEU  34 152.281  11.061   3.679
  958   2HB   LEU  34           HB1      LEU  34 150.675  10.930   2.976
  959    HG   LEU  34           HG       LEU  34 153.026  11.776   1.280
  960   1HD1  LEU  34          HD13      LEU  34 152.169   8.975   2.046
  961   2HD1  LEU  34          HD12      LEU  34 153.097   9.314   0.585
  962   3HD1  LEU  34          HD11      LEU  34 153.778   9.686   2.168
  963   1HD2  LEU  34          HD23      LEU  34 150.333  10.471   0.734
  964   2HD2  LEU  34          HD22      LEU  34 150.854  12.077   0.238
  965   3HD2  LEU  34          HD21      LEU  34 151.590  10.654  -0.485
  966    H    GLU  35           HN       GLU  35 152.212  13.110   5.431
  967    HA   GLU  35           HA       GLU  35 149.705  12.885   6.778
  968   1HB   GLU  35           HB2      GLU  35 151.864  12.566   7.922
  969   2HB   GLU  35           HB1      GLU  35 152.235  14.277   7.711
  970   1HG   GLU  35           HG2      GLU  35 150.292  14.891   9.084
  971   2HG   GLU  35           HG1      GLU  35 149.857  13.189   9.252
  972    H    GLU  36           HN       GLU  36 151.476  15.744   5.644
  973    HA   GLU  36           HA       GLU  36 149.630  17.664   6.758
  974   1HB   GLU  36           HB2      GLU  36 151.617  17.841   4.474
  975   2HB   GLU  36           HB1      GLU  36 150.676  19.219   5.048
  976   1HG   GLU  36           HG2      GLU  36 151.623  18.929   7.309
  977   2HG   GLU  36           HG1      GLU  36 152.568  17.554   6.736
  978    H    ARG  37           HN       ARG  37 149.553  15.565   4.051
  979    HA   ARG  37           HA       ARG  37 147.503  17.137   2.612
  980   1HB   ARG  37           HB2      ARG  37 148.810  14.463   2.069
  981   2HB   ARG  37           HB1      ARG  37 147.548  15.139   1.044
  982   1HG   ARG  37           HG2      ARG  37 150.028  16.729   1.707
  983   2HG   ARG  37           HG1      ARG  37 150.032  15.562   0.389
  984   1HD   ARG  37           HD2      ARG  37 148.024  16.756  -0.574
  985   2HD   ARG  37           HD1      ARG  37 148.247  18.003   0.652
  986    HE   ARG  37           HE       ARG  37 150.734  17.809  -0.539
  987   1HH1  ARG  37          HH21      ARG  37 147.484  18.272  -1.602
  988   2HH1  ARG  37          HH22      ARG  37 147.932  19.232  -2.972
  989   1HH2  ARG  37          HH11      ARG  37 151.332  19.055  -2.321
  990   2HH2  ARG  37          HH12      ARG  37 150.109  19.677  -3.378
  991    H    GLY  38           HN       GLY  38 147.363  15.196   5.299
  992   1HA   GLY  38           HA2      GLY  38 145.188  14.771   6.305
  993   2HA   GLY  38           HA1      GLY  38 144.503  14.531   4.705
  994    H    PHE  39           HN       PHE  39 147.456  12.910   4.841
  995    HA   PHE  39           HA       PHE  39 146.034  10.327   5.406
  996   1HB   PHE  39           HB2      PHE  39 148.629  10.884   3.958
  997   2HB   PHE  39           HB1      PHE  39 147.924   9.290   4.193
  998    HD1  PHE  39           HD2      PHE  39 145.876   8.626   3.008
  999    HD2  PHE  39           HD1      PHE  39 147.650  12.488   2.423
 1000    HE1  PHE  39           HE2      PHE  39 144.465   8.968   0.997
 1001    HE2  PHE  39           HE1      PHE  39 146.241  12.836   0.414
 1002    HZ   PHE  39           HZ       PHE  39 144.645  11.074  -0.301
 1003    H    ASP  40           HN       ASP  40 146.301  10.900   7.760
 1004    HA   ASP  40           HA       ASP  40 149.021  10.938   8.828
 1005   1HB   ASP  40           HB2      ASP  40 147.922  11.021  11.019
 1006   2HB   ASP  40           HB1      ASP  40 147.179  12.180   9.917
 1007    H    LYS  41           HN       LYS  41 146.931   8.417   7.831
 1008    HA   LYS  41           HA       LYS  41 148.644   6.470   9.322
 1009   1HB   LYS  41           HB2      LYS  41 145.623   6.384   9.169
 1010   2HB   LYS  41           HB1      LYS  41 146.637   5.071   9.776
 1011   1HG   LYS  41           HG2      LYS  41 147.593   6.601  11.472
 1012   2HG   LYS  41           HG1      LYS  41 146.552   7.896  10.883
 1013   1HD   LYS  41           HD2      LYS  41 144.561   6.547  11.455
 1014   2HD   LYS  41           HD1      LYS  41 145.621   5.272  12.058
 1015   1HE   LYS  41           HE2      LYS  41 145.708   8.101  13.112
 1016   2HE   LYS  41           HE1      LYS  41 144.718   6.836  13.841
 1017   1HZ   LYS  41           HZ2      LYS  41 146.955   5.529  13.767
 1018   2HZ   LYS  41           HZ1      LYS  41 147.638   7.084  13.732
 1019   3HZ   LYS  41           HZ3      LYS  41 146.642   6.627  15.026
 1020    H    ALA  42           HN       ALA  42 148.675   4.341   8.381
 1021    HA   ALA  42           HA       ALA  42 149.042   4.401   5.557
 1022   1HB   ALA  42           HB3      ALA  42 148.856   2.102   7.505
 1023   2HB   ALA  42           HB2      ALA  42 149.296   1.907   5.808
 1024   3HB   ALA  42           HB1      ALA  42 150.318   2.866   6.880
 1025    H    TYR  43           HN       TYR  43 146.346   2.943   7.456
 1026    HA   TYR  43           HA       TYR  43 145.156   1.699   5.209
 1027   1HB   TYR  43           HB2      TYR  43 143.123   1.474   6.479
 1028   2HB   TYR  43           HB1      TYR  43 144.495   1.192   7.541
 1029    HD1  TYR  43           HD1      TYR  43 142.085   3.852   6.457
 1030    HD2  TYR  43           HD2      TYR  43 144.720   2.415   9.532
 1031    HE1  TYR  43           HE1      TYR  43 141.234   5.589   7.998
 1032    HE2  TYR  43           HE2      TYR  43 143.858   4.151  11.074
 1033    HH   TYR  43           HH       TYR  43 141.417   5.533  11.116
 1034    H    VAL  44           HN       VAL  44 145.247   5.072   5.974
 1035    HA   VAL  44           HA       VAL  44 142.886   5.728   4.354
 1036    HB   VAL  44           HB       VAL  44 145.174   7.547   5.189
 1037   1HG1  VAL  44          HG11      VAL  44 143.582   8.292   3.336
 1038   2HG1  VAL  44          HG13      VAL  44 142.300   8.249   4.546
 1039   3HG1  VAL  44          HG12      VAL  44 143.662   9.352   4.740
 1040   1HG2  VAL  44          HG23      VAL  44 142.545   6.940   6.581
 1041   2HG2  VAL  44          HG22      VAL  44 144.156   6.531   7.171
 1042   3HG2  VAL  44          HG21      VAL  44 143.665   8.220   7.052
 1043    H    VAL  45           HN       VAL  45 146.321   5.455   4.005
 1044    HA   VAL  45           HA       VAL  45 146.435   6.482   1.261
 1045    HB   VAL  45           HB       VAL  45 148.447   4.871   2.865
 1046   1HG1  VAL  45          HG12      VAL  45 148.580   6.206   0.157
 1047   2HG1  VAL  45          HG11      VAL  45 150.029   5.860   1.100
 1048   3HG1  VAL  45          HG13      VAL  45 148.985   4.541   0.574
 1049   1HG2  VAL  45          HG23      VAL  45 148.031   7.824   2.371
 1050   2HG2  VAL  45          HG22      VAL  45 148.176   6.985   3.915
 1051   3HG2  VAL  45          HG21      VAL  45 149.591   7.178   2.880
 1052    H    LEU  46           HN       LEU  46 146.248   3.336   2.850
 1053    HA   LEU  46           HA       LEU  46 146.603   1.688   0.543
 1054   1HB   LEU  46           HB2      LEU  46 146.526   0.818   2.889
 1055   2HB   LEU  46           HB1      LEU  46 144.817   1.228   2.960
 1056    HG   LEU  46           HG       LEU  46 144.514  -0.290   0.914
 1057   1HD1  LEU  46          HD12      LEU  46 147.351  -0.961   1.682
 1058   2HD1  LEU  46          HD11      LEU  46 146.316  -2.125   0.858
 1059   3HD1  LEU  46          HD13      LEU  46 146.702  -0.590   0.084
 1060   1HD2  LEU  46          HD21      LEU  46 145.031  -1.088   3.733
 1061   2HD2  LEU  46          HD23      LEU  46 143.598  -1.314   2.737
 1062   3HD2  LEU  46          HD22      LEU  46 144.970  -2.402   2.558
 1063    H    GLY  47           HN       GLY  47 143.852   3.384   1.929
 1064   1HA   GLY  47           HA2      GLY  47 141.779   2.342   0.295
 1065   2HA   GLY  47           HA1      GLY  47 141.757   3.944   1.032
 1066    H    GLN  48           HN       GLN  48 144.005   5.083  -0.280
 1067    HA   GLN  48           HA       GLN  48 142.819   5.955  -2.722
 1068   1HB   GLN  48           HB2      GLN  48 144.592   7.199  -1.463
 1069   2HB   GLN  48           HB1      GLN  48 145.766   5.993  -1.986
 1070   1HG   GLN  48           HG2      GLN  48 145.890   7.913  -3.479
 1071   2HG   GLN  48           HG1      GLN  48 145.209   6.549  -4.364
 1072   1HE2  GLN  48          HE22      GLN  48 142.427   8.502  -5.256
 1073   2HE2  GLN  48          HE21      GLN  48 143.615   7.384  -5.725
 1074    H    PHE  49           HN       PHE  49 145.285   3.484  -2.062
 1075    HA   PHE  49           HA       PHE  49 145.887   2.792  -4.762
 1076   1HB   PHE  49           HB2      PHE  49 147.205   2.025  -2.812
 1077   2HB   PHE  49           HB1      PHE  49 145.848   1.032  -2.288
 1078    HD1  PHE  49           HD1      PHE  49 147.988   1.637  -5.308
 1079    HD2  PHE  49           HD2      PHE  49 145.769  -1.209  -2.978
 1080    HE1  PHE  49           HE1      PHE  49 148.798  -0.192  -6.772
 1081    HE2  PHE  49           HE2      PHE  49 146.577  -3.037  -4.441
 1082    HZ   PHE  49           HZ       PHE  49 148.093  -2.529  -6.341
 1083    H    LEU  50           HN       LEU  50 143.385   1.678  -2.535
 1084    HA   LEU  50           HA       LEU  50 142.296  -0.324  -4.326
 1085   1HB   LEU  50           HB2      LEU  50 140.943   1.179  -2.060
 1086   2HB   LEU  50           HB1      LEU  50 140.313  -0.271  -2.839
 1087    HG   LEU  50           HG       LEU  50 142.948  -0.084  -1.340
 1088   1HD1  LEU  50          HD13      LEU  50 140.894   0.036   0.080
 1089   2HD1  LEU  50          HD12      LEU  50 140.375  -1.506  -0.597
 1090   3HD1  LEU  50          HD11      LEU  50 141.846  -1.420   0.373
 1091   1HD2  LEU  50          HD22      LEU  50 141.611  -2.262  -2.939
 1092   2HD2  LEU  50          HD21      LEU  50 143.314  -1.808  -2.880
 1093   3HD2  LEU  50          HD23      LEU  50 142.595  -2.704  -1.545
 1094    H    VAL  51           HN       VAL  51 141.586   3.094  -3.755
 1095    HA   VAL  51           HA       VAL  51 139.308   3.235  -5.488
 1096    HB   VAL  51           HB       VAL  51 141.261   5.342  -4.534
 1097   1HG1  VAL  51          HG11      VAL  51 138.757   5.588  -6.215
 1098   2HG1  VAL  51          HG13      VAL  51 139.392   6.931  -5.265
 1099   3HG1  VAL  51          HG12      VAL  51 140.362   6.234  -6.562
 1100   1HG2  VAL  51          HG21      VAL  51 139.776   4.214  -2.863
 1101   2HG2  VAL  51          HG23      VAL  51 139.444   5.938  -3.027
 1102   3HG2  VAL  51          HG22      VAL  51 138.379   4.759  -3.792
 1103    H    LEU  52           HN       LEU  52 142.771   3.391  -6.112
 1104    HA   LEU  52           HA       LEU  52 142.376   4.377  -8.861
 1105   1HB   LEU  52           HB2      LEU  52 144.838   3.378  -7.406
 1106   2HB   LEU  52           HB1      LEU  52 144.849   4.047  -9.035
 1107    HG   LEU  52           HG       LEU  52 143.804   5.542  -6.610
 1108   1HD1  LEU  52          HD12      LEU  52 146.528   5.507  -7.918
 1109   2HD1  LEU  52          HD11      LEU  52 145.992   6.825  -6.878
 1110   3HD1  LEU  52          HD13      LEU  52 146.141   5.192  -6.229
 1111   1HD2  LEU  52          HD23      LEU  52 144.289   6.239  -9.513
 1112   2HD2  LEU  52          HD22      LEU  52 142.883   6.594  -8.510
 1113   3HD2  LEU  52          HD21      LEU  52 144.376   7.496  -8.279
 1114    H    LYS  53           HN       LYS  53 141.520   1.537  -7.692
 1115    HA   LYS  53           HA       LYS  53 141.476  -0.661  -8.533
 1116   1HB   LYS  53           HB2      LYS  53 141.677   0.987 -11.068
 1117   2HB   LYS  53           HB1      LYS  53 141.219  -0.716 -11.020
 1118   1HG   LYS  53           HG2      LYS  53 139.308  -0.164  -9.557
 1119   2HG   LYS  53           HG1      LYS  53 139.762   1.540  -9.610
 1120   1HD   LYS  53           HD2      LYS  53 139.450   1.553 -12.057
 1121   2HD   LYS  53           HD1      LYS  53 138.992  -0.150 -12.007
 1122   1HE   LYS  53           HE2      LYS  53 137.537   2.058 -10.523
 1123   2HE   LYS  53           HE1      LYS  53 137.015   1.380 -12.065
 1124   1HZ   LYS  53           HZ3      LYS  53 137.442  -0.222  -9.604
 1125   2HZ   LYS  53           HZ2      LYS  53 135.929   0.370 -10.104
 1126   3HZ   LYS  53           HZ1      LYS  53 136.765  -0.754 -11.064
 1127    H    LYS  54           HN       LYS  54 144.094   0.200  -7.751
 1128    HA   LYS  54           HA       LYS  54 146.324  -0.476  -7.906
 1129   1HB   LYS  54           HB2      LYS  54 145.227  -2.587  -9.790
 1130   2HB   LYS  54           HB1      LYS  54 146.762  -2.640  -8.930
 1131   1HG   LYS  54           HG2      LYS  54 145.512  -2.553  -6.772
 1132   2HG   LYS  54           HG1      LYS  54 144.004  -2.633  -7.679
 1133   1HD   LYS  54           HD2      LYS  54 144.708  -4.790  -8.659
 1134   2HD   LYS  54           HD1      LYS  54 146.205  -4.716  -7.730
 1135   1HE   LYS  54           HE2      LYS  54 144.955  -4.759  -5.634
 1136   2HE   LYS  54           HE1      LYS  54 143.428  -4.722  -6.516
 1137   1HZ   LYS  54           HZ3      LYS  54 145.119  -6.813  -7.442
 1138   2HZ   LYS  54           HZ2      LYS  54 144.835  -6.954  -5.772
 1139   3HZ   LYS  54           HZ1      LYS  54 143.529  -6.897  -6.858
 1140    H    ASP  55           HN       ASP  55 145.051   1.361 -10.101
 1141    HA   ASP  55           HA       ASP  55 146.576   0.818 -12.501
 1142   1HB   ASP  55           HB2      ASP  55 145.229   3.293 -11.407
 1143   2HB   ASP  55           HB1      ASP  55 146.119   3.317 -12.930
 1144    H    GLU  56           HN       GLU  56 148.792   0.675 -12.310
 1145    HA   GLU  56           HA       GLU  56 150.347   2.017 -10.331
 1146   1HB   GLU  56           HB2      GLU  56 151.045  -0.046 -11.535
 1147   2HB   GLU  56           HB1      GLU  56 151.277   0.917 -12.994
 1148   1HG   GLU  56           HG2      GLU  56 152.964   2.285 -11.862
 1149   2HG   GLU  56           HG1      GLU  56 152.698   1.400 -10.359
 1150    H    ASP  57           HN       ASP  57 149.687   2.889 -13.725
 1151    HA   ASP  57           HA       ASP  57 151.556   5.081 -13.799
 1152   1HB   ASP  57           HB2      ASP  57 149.075   4.461 -15.423
 1153   2HB   ASP  57           HB1      ASP  57 150.141   5.824 -15.769
 1154    H    LEU  58           HN       LEU  58 148.130   4.862 -12.997
 1155    HA   LEU  58           HA       LEU  58 147.812   7.732 -12.641
 1156   1HB   LEU  58           HB2      LEU  58 146.171   5.429 -11.535
 1157   2HB   LEU  58           HB1      LEU  58 145.703   7.125 -11.448
 1158    HG   LEU  58           HG       LEU  58 146.192   5.576 -14.014
 1159   1HD1  LEU  58          HD12      LEU  58 144.140   4.913 -12.729
 1160   2HD1  LEU  58          HD11      LEU  58 143.593   6.588 -12.818
 1161   3HD1  LEU  58          HD13      LEU  58 143.775   5.639 -14.294
 1162   1HD2  LEU  58          HD21      LEU  58 145.548   8.455 -13.393
 1163   2HD2  LEU  58          HD23      LEU  58 146.627   7.793 -14.622
 1164   3HD2  LEU  58          HD22      LEU  58 144.884   7.734 -14.860
 1165    H    PHE  59           HN       PHE  59 148.631   5.043 -10.516
 1166    HA   PHE  59           HA       PHE  59 148.590   6.542  -8.059
 1167   1HB   PHE  59           HB2      PHE  59 148.555   4.115  -8.013
 1168   2HB   PHE  59           HB1      PHE  59 150.093   4.038  -8.870
 1169    HD1  PHE  59           HD1      PHE  59 148.511   5.298  -5.722
 1170    HD2  PHE  59           HD2      PHE  59 152.129   4.053  -7.678
 1171    HE1  PHE  59           HE1      PHE  59 149.711   5.372  -3.552
 1172    HE2  PHE  59           HE2      PHE  59 153.329   4.129  -5.509
 1173    HZ   PHE  59           HZ       PHE  59 152.120   4.787  -3.445
 1174    H    ARG  60           HN       ARG  60 151.155   5.848 -10.425
 1175    HA   ARG  60           HA       ARG  60 153.315   6.981  -8.976
 1176   1HB   ARG  60           HB2      ARG  60 152.778   6.673 -11.933
 1177   2HB   ARG  60           HB1      ARG  60 154.278   7.381 -11.334
 1178   1HG   ARG  60           HG2      ARG  60 154.842   5.372 -10.145
 1179   2HG   ARG  60           HG1      ARG  60 153.261   4.668 -10.453
 1180   1HD   ARG  60           HD2      ARG  60 153.700   4.522 -12.811
 1181   2HD   ARG  60           HD1      ARG  60 155.176   5.467 -12.667
 1182    HE   ARG  60           HE       ARG  60 154.871   2.607 -12.321
 1183   1HH1  ARG  60          HH21      ARG  60 156.507   5.328 -10.957
 1184   2HH1  ARG  60          HH22      ARG  60 157.718   4.359 -10.186
 1185   1HH2  ARG  60          HH11      ARG  60 156.434   1.355 -11.327
 1186   2HH2  ARG  60          HH12      ARG  60 157.676   2.119 -10.392
 1187    H    GLU  61           HN       GLU  61 151.188   8.576 -11.421
 1188    HA   GLU  61           HA       GLU  61 152.449  11.135 -11.157
 1189   1HB   GLU  61           HB2      GLU  61 149.649  10.345 -12.002
 1190   2HB   GLU  61           HB1      GLU  61 150.275  11.989 -12.117
 1191   1HG   GLU  61           HG2      GLU  61 152.079  11.232 -13.588
 1192   2HG   GLU  61           HG1      GLU  61 151.530   9.562 -13.430
 1193    H    TRP  62           HN       TRP  62 149.748   9.594  -9.441
 1194    HA   TRP  62           HA       TRP  62 148.939  11.894  -7.962
 1195   1HB   TRP  62           HB2      TRP  62 147.491   9.969  -8.004
 1196   2HB   TRP  62           HB1      TRP  62 148.755   8.937  -7.334
 1197    HD1  TRP  62           HD1      TRP  62 146.385  11.789  -6.350
 1198    HE1  TRP  62           HE1      TRP  62 146.176  11.837  -3.781
 1199    HE3  TRP  62           HE3      TRP  62 149.888   8.274  -5.108
 1200    HZ2  TRP  62           HZ2      TRP  62 147.355  10.561  -1.494
 1201    HZ3  TRP  62           HZ3      TRP  62 150.315   7.710  -2.735
 1202    HH2  TRP  62           HH2      TRP  62 149.056   8.850  -0.930
 1203    H    LEU  63           HN       LEU  63 151.233   9.290  -7.109
 1204    HA   LEU  63           HA       LEU  63 151.852  10.414  -4.538
 1205   1HB   LEU  63           HB2      LEU  63 152.242   8.041  -5.080
 1206   2HB   LEU  63           HB1      LEU  63 153.457   8.511  -6.266
 1207    HG   LEU  63           HG       LEU  63 154.801   9.551  -4.463
 1208   1HD1  LEU  63          HD11      LEU  63 152.431   8.703  -2.813
 1209   2HD1  LEU  63          HD13      LEU  63 154.029   8.762  -2.067
 1210   3HD1  LEU  63          HD12      LEU  63 153.332  10.218  -2.770
 1211   1HD2  LEU  63          HD21      LEU  63 153.975   6.674  -3.980
 1212   2HD2  LEU  63          HD23      LEU  63 155.239   7.226  -5.078
 1213   3HD2  LEU  63          HD22      LEU  63 155.439   7.418  -3.337
 1214    H    LYS  64           HN       LYS  64 153.594  10.511  -7.652
 1215    HA   LYS  64           HA       LYS  64 155.775  12.102  -6.731
 1216   1HB   LYS  64           HB2      LYS  64 155.706  10.935  -8.947
 1217   2HB   LYS  64           HB1      LYS  64 154.557  12.154  -9.503
 1218   1HG   LYS  64           HG2      LYS  64 156.181  13.928  -9.139
 1219   2HG   LYS  64           HG1      LYS  64 157.315  12.788  -8.416
 1220   1HD   LYS  64           HD2      LYS  64 158.007  13.158 -10.701
 1221   2HD   LYS  64           HD1      LYS  64 157.339  11.530 -10.596
 1222   1HE   LYS  64           HE2      LYS  64 155.350  12.142 -11.701
 1223   2HE   LYS  64           HE1      LYS  64 155.585  13.860 -11.378
 1224   1HZ   LYS  64           HZ3      LYS  64 157.537  13.790 -12.843
 1225   2HZ   LYS  64           HZ2      LYS  64 157.187  12.170 -13.218
 1226   3HZ   LYS  64           HZ1      LYS  64 156.101  13.401 -13.655
 1227    H    ASP  65           HN       ASP  65 152.720  13.063  -8.272
 1228    HA   ASP  65           HA       ASP  65 153.213  15.892  -8.096
 1229   1HB   ASP  65           HB2      ASP  65 151.499  14.777  -9.591
 1230   2HB   ASP  65           HB1      ASP  65 150.515  14.514  -8.151
 1231    H    THR  66           HN       THR  66 151.818  13.520  -5.905
 1232    HA   THR  66           HA       THR  66 150.774  15.521  -4.077
 1233    HB   THR  66           HB       THR  66 151.194  12.536  -3.776
 1234    HG1  THR  66           HG1      THR  66 149.128  14.221  -4.623
 1235   1HG2  THR  66          HG22      THR  66 149.851  14.575  -1.991
 1236   2HG2  THR  66          HG21      THR  66 149.563  12.841  -1.863
 1237   3HG2  THR  66          HG23      THR  66 151.175  13.490  -1.572
 1238    H    CYS  67           HN       CYS  67 153.786  13.593  -4.217
 1239    HA   CYS  67           HA       CYS  67 154.767  15.221  -1.888
 1240   1HB   CYS  67           HB2      CYS  67 155.782  13.299  -0.907
 1241   2HB   CYS  67           HB1      CYS  67 154.119  12.849  -1.282
 1242    HG   CYS  67           HG       CYS  67 155.424  11.944  -3.648
 1243    H    GLY  68           HN       GLY  68 155.739  13.287  -4.736
 1244   1HA   GLY  68           HA2      GLY  68 157.398  14.330  -6.267
 1245   2HA   GLY  68           HA1      GLY  68 158.254  14.928  -4.848
 1246    H    ALA  69           HN       ALA  69 156.947  11.734  -4.574
 1247    HA   ALA  69           HA       ALA  69 159.392  10.488  -3.971
 1248   1HB   ALA  69           HB2      ALA  69 157.113   9.520  -3.576
 1249   2HB   ALA  69           HB1      ALA  69 156.999   9.184  -5.304
 1250   3HB   ALA  69           HB3      ALA  69 158.227   8.379  -4.329
 1251    H    ASN  70           HN       ASN  70 160.804   9.124  -5.249
 1252    HA   ASN  70           HA       ASN  70 160.990   9.998  -8.075
 1253   1HB   ASN  70           HB2      ASN  70 162.860   8.341  -6.352
 1254   2HB   ASN  70           HB1      ASN  70 163.199   8.865  -8.001
 1255   1HD2  ASN  70          HD22      ASN  70 164.223  11.353  -5.135
 1256   2HD2  ASN  70          HD21      ASN  70 164.112   9.665  -5.002
 1257    H    ALA  71           HN       ALA  71 161.723   8.162  -9.630
 1258    HA   ALA  71           HA       ALA  71 159.586   6.322  -9.942
 1259   1HB   ALA  71           HB2      ALA  71 161.218   7.133 -11.724
 1260   2HB   ALA  71           HB1      ALA  71 162.354   5.940 -11.096
 1261   3HB   ALA  71           HB3      ALA  71 160.813   5.418 -11.778
 1262    H    LYS  72           HN       LYS  72 162.718   5.917  -8.319
 1263    HA   LYS  72           HA       LYS  72 162.494   3.041  -8.113
 1264   1HB   LYS  72           HB2      LYS  72 164.112   5.078  -6.564
 1265   2HB   LYS  72           HB1      LYS  72 164.240   3.338  -6.297
 1266   1HG   LYS  72           HG2      LYS  72 165.047   2.948  -8.496
 1267   2HG   LYS  72           HG1      LYS  72 164.558   4.551  -9.047
 1268   1HD   LYS  72           HD2      LYS  72 166.995   4.445  -8.681
 1269   2HD   LYS  72           HD1      LYS  72 166.235   5.579  -7.564
 1270   1HE   LYS  72           HE2      LYS  72 166.403   4.068  -5.743
 1271   2HE   LYS  72           HE1      LYS  72 166.727   2.697  -6.804
 1272   1HZ   LYS  72           HZ2      LYS  72 168.810   3.833  -7.460
 1273   2HZ   LYS  72           HZ1      LYS  72 168.514   5.003  -6.265
 1274   3HZ   LYS  72           HZ3      LYS  72 168.768   3.385  -5.823
 1275    H    GLN  73           HN       GLN  73 161.588   5.726  -5.998
 1276    HA   GLN  73           HA       GLN  73 160.788   4.114  -3.774
 1277   1HB   GLN  73           HB2      GLN  73 159.997   6.894  -4.665
 1278   2HB   GLN  73           HB1      GLN  73 159.457   6.181  -3.145
 1279   1HG   GLN  73           HG2      GLN  73 161.730   5.965  -2.359
 1280   2HG   GLN  73           HG1      GLN  73 162.371   6.430  -3.936
 1281   1HE2  GLN  73          HE22      GLN  73 162.564   9.721  -2.648
 1282   2HE2  GLN  73          HE21      GLN  73 163.424   8.378  -3.227
 1283    H    SER  74           HN       SER  74 159.003   5.339  -6.601
 1284    HA   SER  74           HA       SER  74 156.426   4.517  -5.732
 1285   1HB   SER  74           HB2      SER  74 157.602   4.912  -8.488
 1286   2HB   SER  74           HB1      SER  74 155.901   4.553  -8.212
 1287    HG   SER  74           HG       SER  74 155.798   6.434  -6.926
 1288    H    ARG  75           HN       ARG  75 158.952   2.754  -7.574
 1289    HA   ARG  75           HA       ARG  75 157.325   0.498  -8.194
 1290   1HB   ARG  75           HB2      ARG  75 160.317   0.739  -7.765
 1291   2HB   ARG  75           HB1      ARG  75 159.533  -0.736  -8.331
 1292   1HG   ARG  75           HG2      ARG  75 158.587   0.507 -10.250
 1293   2HG   ARG  75           HG1      ARG  75 159.399   1.970  -9.692
 1294   1HD   ARG  75           HD2      ARG  75 161.583   0.701  -9.834
 1295   2HD   ARG  75           HD1      ARG  75 160.696  -0.597 -10.633
 1296    HE   ARG  75           HE       ARG  75 160.046   1.631 -12.130
 1297   1HH1  ARG  75          HH21      ARG  75 162.944   0.161 -10.988
 1298   2HH1  ARG  75          HH22      ARG  75 163.897   0.664 -12.345
 1299   1HH2  ARG  75          HH11      ARG  75 161.270   2.303 -13.913
 1300   2HH2  ARG  75          HH12      ARG  75 162.948   1.879 -14.002
 1301    H    ASP  76           HN       ASP  76 159.272   1.275  -5.315
 1302    HA   ASP  76           HA       ASP  76 158.912  -1.268  -4.053
 1303   1HB   ASP  76           HB2      ASP  76 159.581   1.480  -2.973
 1304   2HB   ASP  76           HB1      ASP  76 159.564   0.026  -1.972
 1305    H    CYS  77           HN       CYS  77 157.054   1.783  -3.860
 1306    HA   CYS  77           HA       CYS  77 155.320   0.833  -1.760
 1307   1HB   CYS  77           HB2      CYS  77 155.014   3.008  -3.847
 1308   2HB   CYS  77           HB1      CYS  77 153.820   2.707  -2.583
 1309    HG   CYS  77           HG       CYS  77 156.501   4.099  -2.187
 1310    H    PHE  78           HN       PHE  78 155.127   0.788  -5.329
 1311    HA   PHE  78           HA       PHE  78 152.456  -0.169  -5.504
 1312   1HB   PHE  78           HB2      PHE  78 153.708   0.651  -7.451
 1313   2HB   PHE  78           HB1      PHE  78 154.807  -0.723  -7.335
 1314    HD1  PHE  78           HD1      PHE  78 151.367   0.340  -8.153
 1315    HD2  PHE  78           HD2      PHE  78 154.122  -2.952  -7.999
 1316    HE1  PHE  78           HE1      PHE  78 149.815  -1.022  -9.525
 1317    HE2  PHE  78           HE2      PHE  78 152.568  -4.316  -9.370
 1318    HZ   PHE  78           HZ       PHE  78 150.414  -3.352 -10.132
 1319    H    GLY  79           HN       GLY  79 155.460  -2.115  -5.771
 1320   1HA   GLY  79           HA2      GLY  79 154.141  -4.627  -5.613
 1321   2HA   GLY  79           HA1      GLY  79 155.847  -4.362  -5.258
 1322    H    CYS  80           HN       CYS  80 155.282  -2.446  -3.082
 1323    HA   CYS  80           HA       CYS  80 155.059  -4.360  -0.925
 1324   1HB   CYS  80           HB2      CYS  80 156.332  -2.255  -0.698
 1325   2HB   CYS  80           HB1      CYS  80 154.834  -1.338  -0.853
 1326    HG   CYS  80           HG       CYS  80 155.351  -1.709   1.711
 1327    H    LEU  81           HN       LEU  81 152.852  -1.797  -2.105
 1328    HA   LEU  81           HA       LEU  81 150.731  -2.586  -0.312
 1329   1HB   LEU  81           HB2      LEU  81 150.676  -1.006  -2.899
 1330   2HB   LEU  81           HB1      LEU  81 149.332  -1.128  -1.764
 1331    HG   LEU  81           HG       LEU  81 152.084  -0.067  -1.058
 1332   1HD1  LEU  81          HD12      LEU  81 149.505   1.366  -1.742
 1333   2HD1  LEU  81          HD11      LEU  81 150.887   2.148  -0.976
 1334   3HD1  LEU  81          HD13      LEU  81 151.044   1.471  -2.596
 1335   1HD2  LEU  81          HD23      LEU  81 149.528  -0.499   0.473
 1336   2HD2  LEU  81          HD22      LEU  81 151.196  -0.730   0.992
 1337   3HD2  LEU  81          HD21      LEU  81 150.528   0.895   0.886
 1338    H    ARG  82           HN       ARG  82 151.538  -3.364  -3.692
 1339    HA   ARG  82           HA       ARG  82 149.138  -4.818  -4.239
 1340   1HB   ARG  82           HB2      ARG  82 150.749  -4.071  -5.995
 1341   2HB   ARG  82           HB1      ARG  82 151.870  -5.318  -5.441
 1342   1HG   ARG  82           HG2      ARG  82 150.233  -7.062  -5.930
 1343   2HG   ARG  82           HG1      ARG  82 149.040  -5.848  -6.390
 1344   1HD   ARG  82           HD2      ARG  82 150.523  -5.107  -8.229
 1345   2HD   ARG  82           HD1      ARG  82 151.690  -6.351  -7.777
 1346    HE   ARG  82           HE       ARG  82 149.289  -7.726  -8.156
 1347   1HH1  ARG  82          HH21      ARG  82 151.360  -5.632  -9.946
 1348   2HH1  ARG  82          HH22      ARG  82 150.886  -6.263 -11.488
 1349   1HH2  ARG  82          HH11      ARG  82 148.651  -8.559 -10.158
 1350   2HH2  ARG  82          HH12      ARG  82 149.352  -7.922 -11.608
 1351    H    GLU  83           HN       GLU  83 152.255  -5.870  -2.877
 1352    HA   GLU  83           HA       GLU  83 151.542  -8.656  -2.841
 1353   1HB   GLU  83           HB2      GLU  83 153.629  -7.055  -1.341
 1354   2HB   GLU  83           HB1      GLU  83 153.452  -8.802  -1.164
 1355   1HG   GLU  83           HG2      GLU  83 153.822  -7.446  -3.846
 1356   2HG   GLU  83           HG1      GLU  83 155.164  -8.076  -2.892
 1357    H    TRP  84           HN       TRP  84 151.196  -6.031  -0.440
 1358    HA   TRP  84           HA       TRP  84 150.339  -7.688   1.726
 1359   1HB   TRP  84           HB2      TRP  84 150.959  -5.248   1.904
 1360   2HB   TRP  84           HB1      TRP  84 149.425  -4.857   1.125
 1361    HD1  TRP  84           HD1      TRP  84 150.913  -6.111   4.369
 1362    HE1  TRP  84           HE1      TRP  84 149.085  -6.171   6.186
 1363    HE3  TRP  84           HE3      TRP  84 146.801  -5.132   1.511
 1364    HZ2  TRP  84           HZ2      TRP  84 146.258  -5.848   6.398
 1365    HZ3  TRP  84           HZ3      TRP  84 144.552  -5.014   2.547
 1366    HH2  TRP  84           HH2      TRP  84 144.275  -5.371   4.988
 1367    H    CYS  85           HN       CYS  85 148.557  -6.032  -0.873
 1368    HA   CYS  85           HA       CYS  85 145.942  -6.783  -0.039
 1369   1HB   CYS  85           HB2      CYS  85 147.075  -6.246  -2.800
 1370   2HB   CYS  85           HB1      CYS  85 145.355  -6.484  -2.485
 1371    HG   CYS  85           HG       CYS  85 145.253  -4.124  -1.769
 1372    H    ASP  86           HN       ASP  86 148.321  -8.454  -2.061
 1373    HA   ASP  86           HA       ASP  86 146.702 -10.634  -2.890
 1374   1HB   ASP  86           HB2      ASP  86 149.676 -10.431  -2.368
 1375   2HB   ASP  86           HB1      ASP  86 148.918 -11.870  -3.051
 1376    H    ALA  87           HN       ALA  87 148.370 -10.048   0.170
 1377    HA   ALA  87           HA       ALA  87 147.874 -12.807   1.087
 1378   1HB   ALA  87           HB3      ALA  87 149.914 -11.398   1.717
 1379   2HB   ALA  87           HB2      ALA  87 148.832 -10.494   2.778
 1380   3HB   ALA  87           HB1      ALA  87 149.090 -12.219   3.043
 1381    H    PHE  88           HN       PHE  88 146.553  -9.564   1.677
 1382    HA   PHE  88           HA       PHE  88 144.535 -10.772   3.533
 1383   1HB   PHE  88           HB2      PHE  88 145.323  -7.884   3.053
 1384   2HB   PHE  88           HB1      PHE  88 144.070  -8.415   4.175
 1385    HD1  PHE  88           HD2      PHE  88 144.661  -9.791   6.168
 1386    HD2  PHE  88           HD1      PHE  88 147.666  -8.152   3.575
 1387    HE1  PHE  88           HE2      PHE  88 146.389 -10.200   7.904
 1388    HE2  PHE  88           HE1      PHE  88 149.391  -8.562   5.306
 1389    HZ   PHE  88           HZ       PHE  88 148.750  -9.581   7.472
 1390    H    LEU  89           HN       LEU  89 144.093  -7.824   1.620
 1391    HA   LEU  89           HA       LEU  89 141.522  -8.891   0.660
 1392   1HB   LEU  89           HB2      LEU  89 141.515  -6.598   1.424
 1393   2HB   LEU  89           HB1      LEU  89 142.877  -6.190   0.386
 1394    HG   LEU  89           HG       LEU  89 141.511  -6.536  -1.614
 1395   1HD1  LEU  89          HD11      LEU  89 139.473  -7.483   0.407
 1396   2HD1  LEU  89          HD13      LEU  89 138.995  -6.916  -1.192
 1397   3HD1  LEU  89          HD12      LEU  89 140.051  -8.316  -1.038
 1398   1HD2  LEU  89          HD22      LEU  89 141.417  -4.343  -0.344
 1399   2HD2  LEU  89          HD21      LEU  89 140.014  -4.664  -1.363
 1400   3HD2  LEU  89          HD23      LEU  89 139.913  -4.907   0.381
   
  No H/Q in entry =        1400
  Start of MODEL   12
    1   1H    MET   1           HT1      MET   1 114.569  -8.335  13.424
    2   2H    MET   1           HT3      MET   1 113.257  -7.332  13.035
    3   3H    MET   1           HT2      MET   1 113.172  -8.999  12.722
    4    HA   MET   1           HA       MET   1 113.683  -8.315  10.645
    5   1HB   MET   1           HB2      MET   1 115.266  -6.312  10.313
    6   2HB   MET   1           HB1      MET   1 113.664  -5.963  10.954
    7   1HG   MET   1           HG2      MET   1 114.638  -6.018  13.270
    8   2HG   MET   1           HG1      MET   1 116.235  -6.205  12.550
    9   1HE   MET   1           HE1      MET   1 117.628  -4.535  11.654
   10   2HE   MET   1           HE3      MET   1 116.633  -4.423  10.196
   11   3HE   MET   1           HE2      MET   1 117.164  -2.959  11.018
   12    H    THR   2           HN       THR   2 114.770 -10.442  11.025
   13    HA   THR   2           HA       THR   2 117.529 -10.602  11.798
   14    HB   THR   2           HB       THR   2 115.960 -12.479  10.004
   15    HG1  THR   2           HG1      THR   2 115.547 -11.851  12.485
   16   1HG2  THR   2          HG22      THR   2 118.568 -12.705  11.507
   17   2HG2  THR   2          HG21      THR   2 117.640 -14.129  11.035
   18   3HG2  THR   2          HG23      THR   2 118.257 -13.030   9.801
   19    H    THR   3           HN       THR   3 119.404 -10.600  10.532
   20    HA   THR   3           HA       THR   3 119.330  -9.037   8.105
   21    HB   THR   3           HB       THR   3 121.754  -9.491   8.008
   22    HG1  THR   3           HG1      THR   3 121.045 -11.380   9.983
   23   1HG2  THR   3          HG21      THR   3 120.707  -7.851   9.674
   24   2HG2  THR   3          HG23      THR   3 120.974  -9.092  10.898
   25   3HG2  THR   3          HG22      THR   3 122.345  -8.396  10.035
   26    H    SER   4           HN       SER   4 120.134  -9.801   5.987
   27    HA   SER   4           HA       SER   4 118.917 -12.360   5.265
   28   1HB   SER   4           HB2      SER   4 120.412 -10.251   3.693
   29   2HB   SER   4           HB1      SER   4 119.817 -11.739   2.963
   30    HG   SER   4           HG       SER   4 118.466  -9.493   3.788
   31    H    GLN   5           HN       GLN   5 120.231 -13.898   3.862
   32    HA   GLN   5           HA       GLN   5 122.460 -14.897   5.358
   33   1HB   GLN   5           HB2      GLN   5 121.438 -15.537   2.580
   34   2HB   GLN   5           HB1      GLN   5 122.754 -16.419   3.355
   35   1HG   GLN   5           HG2      GLN   5 121.281 -17.043   5.210
   36   2HG   GLN   5           HG1      GLN   5 119.964 -16.104   4.504
   37   1HE2  GLN   5          HE22      GLN   5 119.621 -19.700   3.440
   38   2HE2  GLN   5          HE21      GLN   5 119.712 -18.931   4.951
   39    H    LYS   6           HN       LYS   6 122.257 -12.542   2.815
   40    HA   LYS   6           HA       LYS   6 124.854 -12.834   1.690
   41   1HB   LYS   6           HB2      LYS   6 123.001 -10.459   1.970
   42   2HB   LYS   6           HB1      LYS   6 124.510 -10.406   1.056
   43   1HG   LYS   6           HG2      LYS   6 123.730 -12.272  -0.353
   44   2HG   LYS   6           HG1      LYS   6 122.220 -12.329   0.555
   45   1HD   LYS   6           HD2      LYS   6 121.715 -10.013  -0.138
   46   2HD   LYS   6           HD1      LYS   6 123.224  -9.960  -1.053
   47   1HE   LYS   6           HE2      LYS   6 122.452 -11.841  -2.450
   48   2HE   LYS   6           HE1      LYS   6 120.946 -11.905  -1.533
   49   1HZ   LYS   6           HZ3      LYS   6 121.167  -9.292  -2.277
   50   2HZ   LYS   6           HZ2      LYS   6 121.712 -10.140  -3.646
   51   3HZ   LYS   6           HZ1      LYS   6 120.170 -10.456  -3.006
   52    H    HIS   7           HN       HIS   7 123.666 -11.001   4.501
   53    HA   HIS   7           HA       HIS   7 126.056  -9.558   5.004
   54   1HB   HIS   7           HB2      HIS   7 123.977  -9.020   6.160
   55   2HB   HIS   7           HB1      HIS   7 123.975 -10.596   6.949
   56    HD2  HIS   7           HD2      HIS   7 125.704 -10.823   9.167
   57    HE1  HIS   7           HE1      HIS   7 127.168  -6.867   9.055
   58    HE2  HIS   7           HE2      HIS   7 127.112  -9.012  10.401
   59    H    ARG   8           HN       ARG   8 125.035 -12.721   6.374
   60    HA   ARG   8           HA       ARG   8 127.515 -13.100   7.782
   61   1HB   ARG   8           HB2      ARG   8 125.323 -15.024   6.959
   62   2HB   ARG   8           HB1      ARG   8 126.720 -15.505   7.926
   63   1HG   ARG   8           HG2      ARG   8 126.124 -13.818   9.627
   64   2HG   ARG   8           HG1      ARG   8 124.722 -13.346   8.666
   65   1HD   ARG   8           HD2      ARG   8 123.851 -15.673   8.850
   66   2HD   ARG   8           HD1      ARG   8 125.222 -16.082   9.877
   67    HE   ARG   8           HE       ARG   8 124.043 -13.858  11.091
   68   1HH1  ARG   8          HH21      ARG   8 123.109 -17.026  10.096
   69   2HH1  ARG   8          HH22      ARG   8 121.881 -17.186  11.307
   70   1HH2  ARG   8          HH11      ARG   8 122.447 -14.050  12.672
   71   2HH2  ARG   8          HH12      ARG   8 121.506 -15.501  12.764
   72    H    ASP   9           HN       ASP   9 126.364 -13.937   4.570
   73    HA   ASP   9           HA       ASP   9 128.550 -15.732   3.965
   74   1HB   ASP   9           HB2      ASP   9 126.614 -14.227   2.202
   75   2HB   ASP   9           HB1      ASP   9 127.825 -15.339   1.574
   76    H    PHE  10           HN       PHE  10 127.971 -12.258   3.441
   77    HA   PHE  10           HA       PHE  10 130.329 -11.842   1.850
   78   1HB   PHE  10           HB2      PHE  10 128.381 -10.253   2.048
   79   2HB   PHE  10           HB1      PHE  10 128.973  -9.821   3.653
   80    HD1  PHE  10           HD2      PHE  10 131.110  -8.633   3.937
   81    HD2  PHE  10           HD1      PHE  10 129.588  -9.600   0.037
   82    HE1  PHE  10           HE2      PHE  10 132.737  -7.066   2.914
   83    HE2  PHE  10           HE1      PHE  10 131.217  -8.035  -0.986
   84    HZ   PHE  10           HZ       PHE  10 132.792  -6.768   0.452
   85    H    VAL  11           HN       VAL  11 129.737 -11.485   5.366
   86    HA   VAL  11           HA       VAL  11 132.556 -10.761   5.815
   87    HB   VAL  11           HB       VAL  11 131.918 -10.567   8.149
   88   1HG1  VAL  11          HG12      VAL  11 129.738  -9.557   6.294
   89   2HG1  VAL  11          HG11      VAL  11 130.025  -8.965   7.931
   90   3HG1  VAL  11          HG13      VAL  11 131.243  -8.721   6.678
   91   1HG2  VAL  11          HG22      VAL  11 129.492 -12.094   7.220
   92   2HG2  VAL  11          HG21      VAL  11 130.575 -12.469   8.558
   93   3HG2  VAL  11          HG23      VAL  11 129.444 -11.123   8.691
   94    H    ALA  12           HN       ALA  12 131.448 -13.571   4.881
   95    HA   ALA  12           HA       ALA  12 132.883 -15.217   6.943
   96   1HB   ALA  12           HB2      ALA  12 130.681 -15.886   4.989
   97   2HB   ALA  12           HB1      ALA  12 131.624 -17.131   5.808
   98   3HB   ALA  12           HB3      ALA  12 130.648 -16.001   6.747
   99    H    GLU  13           HN       GLU  13 133.174 -13.961   3.788
  100    HA   GLU  13           HA       GLU  13 135.548 -15.631   3.333
  101   1HB   GLU  13           HB2      GLU  13 134.779 -16.237   0.999
  102   2HB   GLU  13           HB1      GLU  13 133.889 -17.047   2.287
  103   1HG   GLU  13           HG2      GLU  13 132.076 -15.441   2.103
  104   2HG   GLU  13           HG1      GLU  13 132.976 -14.508   0.909
  105    HA   PRO  14           HA       PRO  14 137.312 -11.907   1.642
  106   1HB   PRO  14           HB2      PRO  14 137.741 -13.556  -0.842
  107   2HB   PRO  14           HB1      PRO  14 138.864 -12.448  -0.025
  108   1HG   PRO  14           HG2      PRO  14 139.067 -15.080   0.300
  109   2HG   PRO  14           HG1      PRO  14 139.354 -13.964   1.648
  110   1HD   PRO  14           HD2      PRO  14 137.050 -15.797   1.201
  111   2HD   PRO  14           HD1      PRO  14 137.682 -15.126   2.721
  112    H    MET  15           HN       MET  15 136.858 -10.258  -0.036
  113    HA   MET  15           HA       MET  15 134.083 -10.469  -1.031
  114   1HB   MET  15           HB2      MET  15 134.562  -8.049  -1.745
  115   2HB   MET  15           HB1      MET  15 134.568  -8.373  -0.011
  116   1HG   MET  15           HG2      MET  15 136.915  -8.291   0.125
  117   2HG   MET  15           HG1      MET  15 137.120  -8.545  -1.609
  118   1HE   MET  15           HE3      MET  15 135.312  -6.355   0.936
  119   2HE   MET  15           HE2      MET  15 136.996  -5.921   1.213
  120   3HE   MET  15           HE1      MET  15 135.877  -4.714   0.583
  121    H    GLY  16           HN       GLY  16 137.316 -10.743  -2.236
  122   1HA   GLY  16           HA2      GLY  16 138.160 -10.992  -4.418
  123   2HA   GLY  16           HA1      GLY  16 136.641 -11.841  -4.711
  124    H    GLU  17           HN       GLU  17 136.130 -11.031  -6.732
  125    HA   GLU  17           HA       GLU  17 136.056  -8.063  -7.096
  126   1HB   GLU  17           HB2      GLU  17 136.063 -10.366  -9.065
  127   2HB   GLU  17           HB1      GLU  17 135.818  -8.683  -9.534
  128   1HG   GLU  17           HG2      GLU  17 137.986  -8.076  -8.535
  129   2HG   GLU  17           HG1      GLU  17 138.241  -9.755  -8.056
  130    H    LYS  18           HN       LYS  18 133.959  -9.621  -5.627
  131    HA   LYS  18           HA       LYS  18 131.650  -9.992  -7.250
  132   1HB   LYS  18           HB2      LYS  18 131.951  -9.230  -4.330
  133   2HB   LYS  18           HB1      LYS  18 130.392  -9.583  -5.066
  134   1HG   LYS  18           HG2      LYS  18 131.368 -11.812  -5.803
  135   2HG   LYS  18           HG1      LYS  18 132.754 -11.450  -4.772
  136   1HD   LYS  18           HD2      LYS  18 131.136 -11.125  -2.858
  137   2HD   LYS  18           HD1      LYS  18 129.863 -11.738  -3.913
  138   1HE   LYS  18           HE2      LYS  18 132.378 -13.224  -3.096
  139   2HE   LYS  18           HE1      LYS  18 130.738 -13.566  -2.544
  140   1HZ   LYS  18           HZ1      LYS  18 130.328 -13.689  -5.127
  141   2HZ   LYS  18           HZ3      LYS  18 131.975 -14.092  -5.138
  142   3HZ   LYS  18           HZ2      LYS  18 130.878 -15.035  -4.247
  143    HA   PRO  19           HA       PRO  19 130.601  -5.816  -8.345
  144   1HB   PRO  19           HB2      PRO  19 127.843  -5.948  -8.444
  145   2HB   PRO  19           HB1      PRO  19 128.905  -6.640  -9.686
  146   1HG   PRO  19           HG2      PRO  19 127.559  -7.997  -7.387
  147   2HG   PRO  19           HG1      PRO  19 127.722  -8.534  -9.069
  148   1HD   PRO  19           HD2      PRO  19 129.318  -9.513  -7.116
  149   2HD   PRO  19           HD1      PRO  19 129.923  -9.257  -8.768
  150    H    VAL  20           HN       VAL  20 129.681  -3.837  -7.545
  151    HA   VAL  20           HA       VAL  20 129.861  -3.441  -4.765
  152    HB   VAL  20           HB       VAL  20 130.079  -1.564  -6.251
  153   1HG1  VAL  20          HG11      VAL  20 128.517  -2.482  -8.002
  154   2HG1  VAL  20          HG13      VAL  20 127.166  -1.948  -7.000
  155   3HG1  VAL  20          HG12      VAL  20 128.290  -0.766  -7.671
  156   1HG2  VAL  20          HG22      VAL  20 128.925  -1.272  -3.956
  157   2HG2  VAL  20          HG21      VAL  20 128.758   0.045  -5.116
  158   3HG2  VAL  20          HG23      VAL  20 127.431  -1.090  -4.873
  159    H    GLY  21           HN       GLY  21 126.980  -4.009  -6.747
  160   1HA   GLY  21           HA2      GLY  21 125.031  -3.569  -4.732
  161   2HA   GLY  21           HA1      GLY  21 124.792  -4.603  -6.138
  162    H    SER  22           HN       SER  22 127.466  -5.854  -4.667
  163    HA   SER  22           HA       SER  22 125.906  -8.044  -3.496
  164   1HB   SER  22           HB2      SER  22 128.891  -7.534  -3.665
  165   2HB   SER  22           HB1      SER  22 128.173  -8.996  -2.997
  166    HG   SER  22           HG       SER  22 128.800  -8.790  -5.395
  167    H    LEU  23           HN       LEU  23 127.466  -5.146  -2.419
  168    HA   LEU  23           HA       LEU  23 127.947  -5.897   0.305
  169   1HB   LEU  23           HB2      LEU  23 127.313  -3.171  -0.859
  170   2HB   LEU  23           HB1      LEU  23 127.981  -3.463   0.746
  171    HG   LEU  23           HG       LEU  23 129.301  -4.295  -1.857
  172   1HD1  LEU  23          HD11      LEU  23 129.750  -1.946   0.002
  173   2HD1  LEU  23          HD13      LEU  23 130.952  -2.479  -1.174
  174   3HD1  LEU  23          HD12      LEU  23 129.378  -1.904  -1.721
  175   1HD2  LEU  23          HD22      LEU  23 129.989  -4.631   1.061
  176   2HD2  LEU  23          HD21      LEU  23 130.179  -5.773  -0.270
  177   3HD2  LEU  23          HD23      LEU  23 131.296  -4.421  -0.103
  178    H    ALA  24           HN       ALA  24 126.644  -5.859   2.070
  179    HA   ALA  24           HA       ALA  24 123.810  -6.125   1.707
  180   1HB   ALA  24           HB3      ALA  24 125.407  -5.595   4.228
  181   2HB   ALA  24           HB2      ALA  24 123.722  -6.109   4.188
  182   3HB   ALA  24           HB1      ALA  24 124.986  -7.181   3.584
  183    H    GLY  25           HN       GLY  25 122.193  -4.653   1.852
  184   1HA   GLY  25           HA2      GLY  25 121.172  -2.586   2.632
  185   2HA   GLY  25           HA1      GLY  25 122.780  -1.898   2.848
  186    H    ILE  26           HN       ILE  26 123.451  -3.158   0.095
  187    HA   ILE  26           HA       ILE  26 122.423  -0.853  -1.504
  188    HB   ILE  26           HB       ILE  26 124.567  -2.878  -2.226
  189   1HG1  ILE  26          HG12      ILE  26 125.336  -1.693  -0.261
  190   2HG1  ILE  26          HG11      ILE  26 126.153  -0.998  -1.658
  191   1HG2  ILE  26          HG21      ILE  26 123.519  -1.669  -4.115
  192   2HG2  ILE  26          HG23      ILE  26 123.909  -0.135  -3.337
  193   3HG2  ILE  26          HG22      ILE  26 125.204  -1.194  -3.896
  194   1HD1  ILE  26          HD12      ILE  26 124.174   0.708  -1.671
  195   2HD1  ILE  26          HD11      ILE  26 123.916   0.166  -0.013
  196   3HD1  ILE  26          HD13      ILE  26 125.451   0.901  -0.471
  197    H    GLY  27           HN       GLY  27 120.595  -1.310  -2.713
  198   1HA   GLY  27           HA2      GLY  27 120.028  -4.133  -3.409
  199   2HA   GLY  27           HA1      GLY  27 118.909  -2.778  -3.561
  200    H    GLU  28           HN       GLU  28 118.959  -4.286  -5.727
  201    HA   GLU  28           HA       GLU  28 121.000  -3.915  -7.641
  202   1HB   GLU  28           HB2      GLU  28 118.011  -4.249  -8.016
  203   2HB   GLU  28           HB1      GLU  28 119.180  -4.330  -9.335
  204   1HG   GLU  28           HG2      GLU  28 119.321  -6.080  -6.868
  205   2HG   GLU  28           HG1      GLU  28 118.546  -6.576  -8.372
  206    H    VAL  29           HN       VAL  29 118.188  -1.842  -6.924
  207    HA   VAL  29           HA       VAL  29 118.682  -0.026  -9.108
  208    HB   VAL  29           HB       VAL  29 117.193   0.314  -6.489
  209   1HG1  VAL  29          HG13      VAL  29 117.583   2.195  -8.816
  210   2HG1  VAL  29          HG12      VAL  29 116.129   2.277  -7.819
  211   3HG1  VAL  29          HG11      VAL  29 117.714   2.532  -7.089
  212   1HG2  VAL  29          HG22      VAL  29 116.374  -0.307  -9.337
  213   2HG2  VAL  29          HG21      VAL  29 116.098  -1.282  -7.894
  214   3HG2  VAL  29          HG23      VAL  29 115.223   0.232  -8.115
  215    H    LEU  30           HN       LEU  30 119.605   0.016  -5.680
  216    HA   LEU  30           HA       LEU  30 120.972   2.543  -5.790
  217   1HB   LEU  30           HB2      LEU  30 121.414   0.194  -3.921
  218   2HB   LEU  30           HB1      LEU  30 121.995   1.836  -3.657
  219    HG   LEU  30           HG       LEU  30 119.076   1.053  -3.928
  220   1HD1  LEU  30          HD13      LEU  30 120.859   1.567  -1.541
  221   2HD1  LEU  30          HD12      LEU  30 119.110   1.762  -1.444
  222   3HD1  LEU  30          HD11      LEU  30 119.800   0.189  -1.842
  223   1HD2  LEU  30          HD21      LEU  30 120.531   3.667  -3.535
  224   2HD2  LEU  30          HD23      LEU  30 119.158   3.305  -4.582
  225   3HD2  LEU  30          HD22      LEU  30 118.922   3.457  -2.844
  226    H    GLY  31           HN       GLY  31 122.023  -0.809  -6.234
  227   1HA   GLY  31           HA2      GLY  31 124.822  -0.327  -6.365
  228   2HA   GLY  31           HA1      GLY  31 123.999  -1.663  -7.173
  229    H    LYS  32           HN       LYS  32 122.290  -0.032  -8.818
  230    HA   LYS  32           HA       LYS  32 124.029   0.385 -11.056
  231   1HB   LYS  32           HB2      LYS  32 121.585  -0.166 -11.187
  232   2HB   LYS  32           HB1      LYS  32 121.233   1.480 -10.658
  233   1HG   LYS  32           HG2      LYS  32 122.446   2.372 -12.612
  234   2HG   LYS  32           HG1      LYS  32 122.796   0.727 -13.145
  235   1HD   LYS  32           HD2      LYS  32 120.397   0.258 -13.353
  236   2HD   LYS  32           HD1      LYS  32 120.014   1.879 -12.771
  237   1HE   LYS  32           HE2      LYS  32 121.072   2.884 -14.709
  238   2HE   LYS  32           HE1      LYS  32 121.658   1.312 -15.255
  239   1HZ   LYS  32           HZ3      LYS  32 119.148   0.710 -15.156
  240   2HZ   LYS  32           HZ2      LYS  32 118.925   2.391 -15.277
  241   3HZ   LYS  32           HZ1      LYS  32 119.762   1.552 -16.494
  242    H    LYS  33           HN       LYS  33 122.577   2.686  -8.736
  243    HA   LYS  33           HA       LYS  33 123.455   5.037 -10.141
  244   1HB   LYS  33           HB2      LYS  33 122.775   4.555  -7.231
  245   2HB   LYS  33           HB1      LYS  33 123.145   6.150  -7.887
  246   1HG   LYS  33           HG2      LYS  33 121.304   5.913  -9.511
  247   2HG   LYS  33           HG1      LYS  33 120.928   4.320  -8.853
  248   1HD   LYS  33           HD2      LYS  33 120.473   5.333  -6.651
  249   2HD   LYS  33           HD1      LYS  33 120.842   6.928  -7.308
  250   1HE   LYS  33           HE2      LYS  33 118.620   5.092  -8.247
  251   2HE   LYS  33           HE1      LYS  33 118.413   6.562  -7.296
  252   1HZ   LYS  33           HZ3      LYS  33 119.543   7.759  -9.155
  253   2HZ   LYS  33           HZ2      LYS  33 119.433   6.333 -10.072
  254   3HZ   LYS  33           HZ1      LYS  33 118.022   7.119  -9.547
  255    H    LEU  34           HN       LEU  34 124.919   3.247  -7.401
  256    HA   LEU  34           HA       LEU  34 127.212   4.928  -7.148
  257   1HB   LEU  34           HB2      LEU  34 126.821   1.976  -6.571
  258   2HB   LEU  34           HB1      LEU  34 128.281   2.856  -6.145
  259    HG   LEU  34           HG       LEU  34 125.563   3.821  -5.252
  260   1HD1  LEU  34          HD13      LEU  34 127.408   1.891  -3.810
  261   2HD1  LEU  34          HD12      LEU  34 125.970   2.636  -3.114
  262   3HD1  LEU  34          HD11      LEU  34 125.814   1.508  -4.460
  263   1HD2  LEU  34          HD23      LEU  34 128.433   4.296  -4.370
  264   2HD2  LEU  34          HD22      LEU  34 127.254   5.485  -4.918
  265   3HD2  LEU  34          HD21      LEU  34 127.058   4.713  -3.350
  266    H    GLU  35           HN       GLU  35 126.513   2.134  -9.177
  267    HA   GLU  35           HA       GLU  35 129.106   1.809 -10.327
  268   1HB   GLU  35           HB2      GLU  35 127.301   0.154 -10.594
  269   2HB   GLU  35           HB1      GLU  35 126.391   1.295 -11.583
  270   1HG   GLU  35           HG2      GLU  35 128.184   1.305 -13.260
  271   2HG   GLU  35           HG1      GLU  35 129.148   0.221 -12.257
  272    H    GLU  36           HN       GLU  36 126.399   3.910 -11.295
  273    HA   GLU  36           HA       GLU  36 127.688   4.896 -13.681
  274   1HB   GLU  36           HB2      GLU  36 125.497   6.063 -11.937
  275   2HB   GLU  36           HB1      GLU  36 126.035   6.800 -13.446
  276   1HG   GLU  36           HG2      GLU  36 125.468   4.733 -14.667
  277   2HG   GLU  36           HG1      GLU  36 124.927   3.993 -13.159
  278    H    ARG  37           HN       ARG  37 128.077   5.511 -10.326
  279    HA   ARG  37           HA       ARG  37 129.360   8.143 -10.753
  280   1HB   ARG  37           HB2      ARG  37 128.886   6.476  -8.272
  281   2HB   ARG  37           HB1      ARG  37 129.710   8.034  -8.257
  282   1HG   ARG  37           HG2      ARG  37 126.915   7.583  -9.340
  283   2HG   ARG  37           HG1      ARG  37 127.258   8.200  -7.729
  284   1HD   ARG  37           HD2      ARG  37 128.742   9.948  -9.152
  285   2HD   ARG  37           HD1      ARG  37 127.541   9.562 -10.380
  286    HE   ARG  37           HE       ARG  37 127.135  11.319  -8.202
  287   1HH1  ARG  37          HH21      ARG  37 125.600   8.595  -9.667
  288   2HH1  ARG  37          HH22      ARG  37 124.069   8.901  -8.924
  289   1HH2  ARG  37          HH11      ARG  37 125.144  11.740  -7.258
  290   2HH2  ARG  37          HH12      ARG  37 123.807  10.685  -7.571
  291    H    GLY  38           HN       GLY  38 130.413   5.030 -11.220
  292   1HA   GLY  38           HA2      GLY  38 132.725   4.690 -11.902
  293   2HA   GLY  38           HA1      GLY  38 133.241   5.872 -10.709
  294    H    PHE  39           HN       PHE  39 130.928   3.838  -9.304
  295    HA   PHE  39           HA       PHE  39 133.105   2.232  -8.007
  296   1HB   PHE  39           HB2      PHE  39 130.265   2.850  -7.176
  297   2HB   PHE  39           HB1      PHE  39 131.350   1.801  -6.270
  298    HD1  PHE  39           HD1      PHE  39 130.608   5.243  -7.285
  299    HD2  PHE  39           HD2      PHE  39 133.294   2.720  -5.093
  300    HE1  PHE  39           HE1      PHE  39 131.594   7.243  -6.200
  301    HE2  PHE  39           HE2      PHE  39 134.289   4.718  -4.007
  302    HZ   PHE  39           HZ       PHE  39 133.440   6.982  -4.562
  303    H    ASP  40           HN       ASP  40 133.013   0.933 -10.113
  304    HA   ASP  40           HA       ASP  40 130.613  -0.691 -10.531
  305   1HB   ASP  40           HB2      ASP  40 131.931  -1.748 -12.326
  306   2HB   ASP  40           HB1      ASP  40 132.009   0.010 -12.435
  307    H    LYS  41           HN       LYS  41 133.367  -0.942  -8.494
  308    HA   LYS  41           HA       LYS  41 132.758  -3.848  -8.034
  309   1HB   LYS  41           HB2      LYS  41 135.484  -2.523  -7.954
  310   2HB   LYS  41           HB1      LYS  41 135.145  -4.210  -7.581
  311   1HG   LYS  41           HG2      LYS  41 134.443  -2.988 -10.256
  312   2HG   LYS  41           HG1      LYS  41 136.021  -3.707  -9.944
  313   1HD   LYS  41           HD2      LYS  41 134.804  -5.823  -9.240
  314   2HD   LYS  41           HD1      LYS  41 133.324  -5.087  -9.855
  315   1HE   LYS  41           HE2      LYS  41 135.841  -5.501 -11.487
  316   2HE   LYS  41           HE1      LYS  41 134.418  -6.541 -11.547
  317   1HZ   LYS  41           HZ3      LYS  41 133.350  -4.100 -11.878
  318   2HZ   LYS  41           HZ2      LYS  41 134.835  -3.923 -12.683
  319   3HZ   LYS  41           HZ1      LYS  41 133.754  -5.149 -13.146
  320    H    ALA  42           HN       ALA  42 132.957  -4.547  -5.879
  321    HA   ALA  42           HA       ALA  42 132.176  -2.643  -3.895
  322   1HB   ALA  42           HB3      ALA  42 131.718  -5.139  -3.904
  323   2HB   ALA  42           HB2      ALA  42 133.376  -5.362  -3.349
  324   3HB   ALA  42           HB1      ALA  42 132.224  -4.469  -2.355
  325    H    TYR  43           HN       TYR  43 135.370  -4.134  -4.534
  326    HA   TYR  43           HA       TYR  43 136.622  -3.154  -2.185
  327   1HB   TYR  43           HB2      TYR  43 138.766  -3.477  -3.318
  328   2HB   TYR  43           HB1      TYR  43 137.691  -4.841  -3.595
  329    HD1  TYR  43           HD1      TYR  43 138.959  -1.682  -5.113
  330    HD2  TYR  43           HD2      TYR  43 137.090  -5.487  -5.793
  331    HE1  TYR  43           HE1      TYR  43 139.258  -1.394  -7.555
  332    HE2  TYR  43           HE2      TYR  43 137.382  -5.195  -8.237
  333    HH   TYR  43           HH       TYR  43 139.166  -3.743  -9.708
  334    H    VAL  44           HN       VAL  44 135.609  -1.377  -4.980
  335    HA   VAL  44           HA       VAL  44 137.462   0.857  -4.492
  336    HB   VAL  44           HB       VAL  44 134.914   0.732  -6.156
  337   1HG1  VAL  44          HG13      VAL  44 135.560   3.045  -5.450
  338   2HG1  VAL  44          HG12      VAL  44 137.150   2.782  -6.155
  339   3HG1  VAL  44          HG11      VAL  44 135.723   2.801  -7.185
  340   1HG2  VAL  44          HG23      VAL  44 137.843   0.550  -6.936
  341   2HG2  VAL  44          HG22      VAL  44 136.677  -0.772  -6.980
  342   3HG2  VAL  44          HG21      VAL  44 136.489   0.603  -8.066
  343    H    VAL  45           HN       VAL  45 134.270  -0.161  -3.627
  344    HA   VAL  45           HA       VAL  45 133.437   2.345  -2.381
  345    HB   VAL  45           HB       VAL  45 132.363  -0.480  -2.085
  346   1HG1  VAL  45          HG11      VAL  45 131.389   2.203  -1.088
  347   2HG1  VAL  45          HG13      VAL  45 130.296   0.835  -1.300
  348   3HG1  VAL  45          HG12      VAL  45 131.641   0.722  -0.165
  349   1HG2  VAL  45          HG21      VAL  45 132.194   0.446  -4.371
  350   2HG2  VAL  45          HG23      VAL  45 130.603   0.322  -3.621
  351   3HG2  VAL  45          HG22      VAL  45 131.406   1.887  -3.727
  352    H    LEU  46           HN       LEU  46 134.835  -0.726  -1.269
  353    HA   LEU  46           HA       LEU  46 134.731  -0.168   1.529
  354   1HB   LEU  46           HB2      LEU  46 135.346  -2.403   0.618
  355   2HB   LEU  46           HB1      LEU  46 136.841  -1.721  -0.017
  356    HG   LEU  46           HG       LEU  46 137.501  -1.091   2.306
  357   1HD1  LEU  46          HD12      LEU  46 134.819  -2.297   2.907
  358   2HD1  LEU  46          HD11      LEU  46 136.106  -2.445   4.100
  359   3HD1  LEU  46          HD13      LEU  46 135.571  -0.851   3.577
  360   1HD2  LEU  46          HD23      LEU  46 137.836  -3.492   1.118
  361   2HD2  LEU  46          HD22      LEU  46 138.438  -3.131   2.730
  362   3HD2  LEU  46          HD21      LEU  46 136.923  -4.006   2.538
  363    H    GLY  47           HN       GLY  47 136.994   0.684  -1.020
  364   1HA   GLY  47           HA2      GLY  47 139.079   1.812   0.516
  365   2HA   GLY  47           HA1      GLY  47 138.641   2.363  -1.102
  366    H    GLN  48           HN       GLN  48 136.025   3.308  -0.613
  367    HA   GLN  48           HA       GLN  48 136.547   5.922   0.406
  368   1HB   GLN  48           HB2      GLN  48 134.641   5.242  -1.123
  369   2HB   GLN  48           HB1      GLN  48 133.838   4.569   0.294
  370   1HG   GLN  48           HG2      GLN  48 132.979   6.789   0.039
  371   2HG   GLN  48           HG1      GLN  48 134.119   6.857   1.384
  372   1HE2  GLN  48          HE22      GLN  48 135.715   8.233  -2.141
  373   2HE2  GLN  48          HE21      GLN  48 134.939   6.724  -2.107
  374    H    PHE  49           HN       PHE  49 135.049   3.073   1.937
  375    HA   PHE  49           HA       PHE  49 134.360   4.299   4.417
  376   1HB   PHE  49           HB2      PHE  49 133.569   2.059   3.732
  377   2HB   PHE  49           HB1      PHE  49 135.212   1.439   3.860
  378    HD1  PHE  49           HD1      PHE  49 132.335   2.788   5.766
  379    HD2  PHE  49           HD2      PHE  49 136.208   0.945   5.991
  380    HE1  PHE  49           HE1      PHE  49 131.973   2.320   8.176
  381    HE2  PHE  49           HE2      PHE  49 135.850   0.480   8.399
  382    HZ   PHE  49           HZ       PHE  49 133.731   1.167   9.492
  383    H    LEU  50           HN       LEU  50 137.331   2.786   3.280
  384    HA   LEU  50           HA       LEU  50 138.741   3.028   5.799
  385   1HB   LEU  50           HB2      LEU  50 139.827   2.877   2.970
  386   2HB   LEU  50           HB1      LEU  50 140.803   2.710   4.427
  387    HG   LEU  50           HG       LEU  50 138.445   0.916   3.755
  388   1HD1  LEU  50          HD12      LEU  50 140.430   0.777   2.166
  389   2HD1  LEU  50          HD11      LEU  50 141.388   0.237   3.540
  390   3HD1  LEU  50          HD13      LEU  50 140.018  -0.727   2.986
  391   1HD2  LEU  50          HD21      LEU  50 140.512   0.987   5.958
  392   2HD2  LEU  50          HD23      LEU  50 138.769   0.749   6.082
  393   3HD2  LEU  50          HD22      LEU  50 139.792  -0.548   5.477
  394    H    VAL  51           HN       VAL  51 138.410   5.153   2.982
  395    HA   VAL  51           HA       VAL  51 140.312   7.117   3.848
  396    HB   VAL  51           HB       VAL  51 137.909   7.358   2.018
  397   1HG1  VAL  51          HG13      VAL  51 140.105   9.312   2.736
  398   2HG1  VAL  51          HG12      VAL  51 139.220   9.425   1.213
  399   3HG1  VAL  51          HG11      VAL  51 138.363   9.581   2.747
  400   1HG2  VAL  51          HG21      VAL  51 139.856   5.833   1.394
  401   2HG2  VAL  51          HG23      VAL  51 139.501   7.120   0.241
  402   3HG2  VAL  51          HG22      VAL  51 140.862   7.279   1.352
  403    H    LEU  52           HN       LEU  52 136.962   6.558   4.729
  404    HA   LEU  52           HA       LEU  52 136.673   9.239   5.914
  405   1HB   LEU  52           HB2      LEU  52 134.886   6.800   5.931
  406   2HB   LEU  52           HB1      LEU  52 134.451   8.350   6.647
  407    HG   LEU  52           HG       LEU  52 135.224   7.971   3.738
  408   1HD1  LEU  52          HD11      LEU  52 132.547   8.048   5.129
  409   2HD1  LEU  52          HD13      LEU  52 132.719   8.401   3.410
  410   3HD1  LEU  52          HD12      LEU  52 133.168   6.814   4.034
  411   1HD2  LEU  52          HD21      LEU  52 134.346  10.320   5.415
  412   2HD2  LEU  52          HD23      LEU  52 135.582  10.246   4.160
  413   3HD2  LEU  52          HD22      LEU  52 133.881  10.266   3.716
  414    H    LYS  53           HN       LYS  53 138.544   6.871   6.979
  415    HA   LYS  53           HA       LYS  53 139.167   6.094   9.114
  416   1HB   LYS  53           HB2      LYS  53 138.122   8.865   9.740
  417   2HB   LYS  53           HB1      LYS  53 139.076   7.890  10.857
  418   1HG   LYS  53           HG2      LYS  53 140.899   7.778   9.165
  419   2HG   LYS  53           HG1      LYS  53 139.958   8.829   8.109
  420   1HD   LYS  53           HD2      LYS  53 140.621   9.675  10.930
  421   2HD   LYS  53           HD1      LYS  53 141.776   9.914   9.622
  422   1HE   LYS  53           HE2      LYS  53 140.019  11.160   8.353
  423   2HE   LYS  53           HE1      LYS  53 138.950  11.010   9.747
  424   1HZ   LYS  53           HZ1      LYS  53 141.474  11.967  10.567
  425   2HZ   LYS  53           HZ3      LYS  53 140.881  12.943   9.312
  426   3HZ   LYS  53           HZ2      LYS  53 139.951  12.707  10.714
  427    H    LYS  54           HN       LYS  54 136.542   5.260   8.327
  428    HA   LYS  54           HA       LYS  54 134.636   4.246   9.225
  429   1HB   LYS  54           HB2      LYS  54 136.149   4.607  11.834
  430   2HB   LYS  54           HB1      LYS  54 134.773   3.540  11.576
  431   1HG   LYS  54           HG2      LYS  54 136.034   2.299   9.868
  432   2HG   LYS  54           HG1      LYS  54 137.418   3.367  10.108
  433   1HD   LYS  54           HD2      LYS  54 137.565   2.645  12.465
  434   2HD   LYS  54           HD1      LYS  54 136.189   1.569  12.217
  435   1HE   LYS  54           HE2      LYS  54 137.408   0.225  10.648
  436   2HE   LYS  54           HE1      LYS  54 138.717   1.405  10.562
  437   1HZ   LYS  54           HZ1      LYS  54 138.067   0.344  13.197
  438   2HZ   LYS  54           HZ3      LYS  54 138.818  -0.723  12.114
  439   3HZ   LYS  54           HZ2      LYS  54 139.576   0.741  12.524
  440    H    ASP  55           HN       ASP  55 134.965   7.355   9.228
  441    HA   ASP  55           HA       ASP  55 133.392   8.285  11.469
  442   1HB   ASP  55           HB2      ASP  55 133.974   9.438   8.732
  443   2HB   ASP  55           HB1      ASP  55 132.949  10.276   9.898
  444    H    GLU  56           HN       GLU  56 131.403   7.355  11.789
  445    HA   GLU  56           HA       GLU  56 129.779   6.218   9.748
  446   1HB   GLU  56           HB2      GLU  56 129.630   5.594  12.122
  447   2HB   GLU  56           HB1      GLU  56 128.971   7.186  12.499
  448   1HG   GLU  56           HG2      GLU  56 127.024   6.754  11.076
  449   2HG   GLU  56           HG1      GLU  56 127.697   5.195  10.594
  450    H    ASP  57           HN       ASP  57 129.578   9.459  11.256
  451    HA   ASP  57           HA       ASP  57 127.094  10.133   9.941
  452   1HB   ASP  57           HB2      ASP  57 129.283  11.855  11.132
  453   2HB   ASP  57           HB1      ASP  57 127.782  12.512  10.479
  454    H    LEU  58           HN       LEU  58 130.483  10.583   9.117
  455    HA   LEU  58           HA       LEU  58 129.914  12.122   6.721
  456   1HB   LEU  58           HB2      LEU  58 132.365  10.471   7.414
  457   2HB   LEU  58           HB1      LEU  58 132.262  11.625   6.088
  458    HG   LEU  58           HG       LEU  58 131.940  12.286   9.033
  459   1HD1  LEU  58          HD11      LEU  58 134.268  11.708   8.220
  460   2HD1  LEU  58          HD13      LEU  58 134.150  13.076   7.114
  461   3HD1  LEU  58          HD12      LEU  58 134.101  13.344   8.856
  462   1HD2  LEU  58          HD21      LEU  58 131.595  13.875   6.495
  463   2HD2  LEU  58          HD23      LEU  58 130.650  13.928   7.982
  464   3HD2  LEU  58          HD22      LEU  58 132.237  14.687   7.923
  465    H    PHE  59           HN       PHE  59 130.410   8.671   7.383
  466    HA   PHE  59           HA       PHE  59 130.311   7.830   4.631
  467   1HB   PHE  59           HB2      PHE  59 131.154   6.325   6.360
  468   2HB   PHE  59           HB1      PHE  59 129.588   6.335   7.170
  469    HD1  PHE  59           HD1      PHE  59 131.315   5.394   4.002
  470    HD2  PHE  59           HD2      PHE  59 127.827   4.897   6.460
  471    HE1  PHE  59           HE1      PHE  59 130.556   3.536   2.547
  472    HE2  PHE  59           HE2      PHE  59 127.066   3.040   5.003
  473    HZ   PHE  59           HZ       PHE  59 128.429   2.359   3.045
  474    H    ARG  60           HN       ARG  60 127.790   8.005   7.154
  475    HA   ARG  60           HA       ARG  60 125.645   7.062   5.550
  476   1HB   ARG  60           HB2      ARG  60 125.687   9.001   7.874
  477   2HB   ARG  60           HB1      ARG  60 124.200   8.386   7.157
  478   1HG   ARG  60           HG2      ARG  60 124.847   6.097   7.698
  479   2HG   ARG  60           HG1      ARG  60 126.390   6.650   8.331
  480   1HD   ARG  60           HD2      ARG  60 124.804   6.291  10.173
  481   2HD   ARG  60           HD1      ARG  60 125.191   8.005  10.030
  482    HE   ARG  60           HE       ARG  60 122.922   7.647   8.443
  483   1HH1  ARG  60          HH21      ARG  60 123.864   7.105  11.718
  484   2HH1  ARG  60          HH22      ARG  60 122.259   7.285  12.344
  485   1HH2  ARG  60          HH11      ARG  60 120.829   7.880   9.243
  486   2HH2  ARG  60          HH12      ARG  60 120.541   7.724  10.943
  487    H    GLU  61           HN       GLU  61 126.737  10.422   6.136
  488    HA   GLU  61           HA       GLU  61 124.746  11.643   4.484
  489   1HB   GLU  61           HB2      GLU  61 126.100  12.878   6.145
  490   2HB   GLU  61           HB1      GLU  61 127.544  12.588   5.175
  491   1HG   GLU  61           HG2      GLU  61 126.575  13.852   3.309
  492   2HG   GLU  61           HG1      GLU  61 125.094  14.107   4.235
  493    H    TRP  62           HN       TRP  62 127.983  10.354   3.797
  494    HA   TRP  62           HA       TRP  62 128.183  11.351   1.131
  495   1HB   TRP  62           HB2      TRP  62 130.162  10.502   2.195
  496   2HB   TRP  62           HB1      TRP  62 129.409   8.931   2.472
  497    HD1  TRP  62           HD1      TRP  62 130.795  11.124  -0.362
  498    HE1  TRP  62           HE1      TRP  62 131.277   9.620  -2.404
  499    HE3  TRP  62           HE3      TRP  62 128.869   6.700   1.322
  500    HZ2  TRP  62           HZ2      TRP  62 130.891   6.893  -3.214
  501    HZ3  TRP  62           HZ3      TRP  62 128.953   4.673  -0.096
  502    HH2  TRP  62           HH2      TRP  62 129.955   4.764  -2.359
  503    H    LEU  63           HN       LEU  63 126.986   8.195   2.311
  504    HA   LEU  63           HA       LEU  63 126.421   7.204  -0.327
  505   1HB   LEU  63           HB2      LEU  63 126.738   5.716   1.608
  506   2HB   LEU  63           HB1      LEU  63 125.286   6.372   2.359
  507    HG   LEU  63           HG       LEU  63 123.957   5.554   0.403
  508   1HD1  LEU  63          HD13      LEU  63 126.672   4.565  -0.439
  509   2HD1  LEU  63          HD12      LEU  63 125.218   3.708  -0.945
  510   3HD1  LEU  63          HD11      LEU  63 125.452   5.393  -1.403
  511   1HD2  LEU  63          HD23      LEU  63 125.616   3.487   1.870
  512   2HD2  LEU  63          HD22      LEU  63 124.109   4.206   2.437
  513   3HD2  LEU  63          HD21      LEU  63 124.106   3.151   1.023
  514    H    LYS  64           HN       LYS  64 124.330   8.652   2.161
  515    HA   LYS  64           HA       LYS  64 121.908   8.422   0.667
  516   1HB   LYS  64           HB2      LYS  64 121.987   8.971   3.095
  517   2HB   LYS  64           HB1      LYS  64 122.591  10.577   2.680
  518   1HG   LYS  64           HG2      LYS  64 120.572  11.064   1.411
  519   2HG   LYS  64           HG1      LYS  64 119.978   9.423   1.666
  520   1HD   LYS  64           HD2      LYS  64 119.898   9.818   4.094
  521   2HD   LYS  64           HD1      LYS  64 120.502  11.458   3.852
  522   1HE   LYS  64           HE2      LYS  64 117.922  10.355   2.698
  523   2HE   LYS  64           HE1      LYS  64 118.036  11.429   4.092
  524   1HZ   LYS  64           HZ2      LYS  64 119.208  13.026   2.617
  525   2HZ   LYS  64           HZ1      LYS  64 118.837  12.022   1.299
  526   3HZ   LYS  64           HZ3      LYS  64 117.588  12.750   2.186
  527    H    ASP  65           HN       ASP  65 124.196  11.143   0.901
  528    HA   ASP  65           HA       ASP  65 122.752  12.782  -0.987
  529   1HB   ASP  65           HB2      ASP  65 125.591  12.855   0.055
  530   2HB   ASP  65           HB1      ASP  65 124.976  14.034  -1.103
  531    H    THR  66           HN       THR  66 125.129  10.232  -1.301
  532    HA   THR  66           HA       THR  66 125.810  10.918  -4.048
  533    HB   THR  66           HB       THR  66 126.361   8.441  -2.395
  534    HG1  THR  66           HG1      THR  66 128.478   9.413  -2.437
  535   1HG2  THR  66          HG23      THR  66 127.214   9.264  -5.173
  536   2HG2  THR  66          HG22      THR  66 128.140   8.111  -4.211
  537   3HG2  THR  66          HG21      THR  66 126.476   7.744  -4.666
  538    H    CYS  67           HN       CYS  67 123.496   8.653  -2.514
  539    HA   CYS  67           HA       CYS  67 122.484   8.053  -5.282
  540   1HB   CYS  67           HB2      CYS  67 121.970   5.747  -4.445
  541   2HB   CYS  67           HB1      CYS  67 123.694   6.100  -4.559
  542    HG   CYS  67           HG       CYS  67 122.208   6.341  -1.817
  543    H    GLY  68           HN       GLY  68 121.693   8.602  -1.890
  544   1HA   GLY  68           HA2      GLY  68 119.565   9.653  -1.312
  545   2HA   GLY  68           HA1      GLY  68 118.817   8.839  -2.687
  546    H    ALA  69           HN       ALA  69 121.017   6.866  -0.946
  547    HA   ALA  69           HA       ALA  69 119.158   4.870  -0.293
  548   1HB   ALA  69           HB2      ALA  69 121.719   4.764  -0.161
  549   2HB   ALA  69           HB1      ALA  69 121.561   5.504   1.433
  550   3HB   ALA  69           HB3      ALA  69 120.837   3.926   1.116
  551    H    ASN  70           HN       ASN  70 118.091   4.335   1.750
  552    HA   ASN  70           HA       ASN  70 117.212   6.763   3.183
  553   1HB   ASN  70           HB2      ASN  70 116.327   3.871   3.435
  554   2HB   ASN  70           HB1      ASN  70 115.541   5.261   4.184
  555   1HD2  ASN  70          HD22      ASN  70 114.282   4.284   0.603
  556   2HD2  ASN  70          HD21      ASN  70 114.932   3.237   1.769
  557    H    ALA  71           HN       ALA  71 116.912   6.451   5.631
  558    HA   ALA  71           HA       ALA  71 119.463   6.181   6.858
  559   1HB   ALA  71           HB3      ALA  71 117.464   7.481   7.734
  560   2HB   ALA  71           HB2      ALA  71 116.806   5.939   8.282
  561   3HB   ALA  71           HB1      ALA  71 118.331   6.531   8.938
  562    H    LYS  72           HN       LYS  72 116.819   3.834   6.473
  563    HA   LYS  72           HA       LYS  72 117.961   1.922   8.324
  564   1HB   LYS  72           HB2      LYS  72 115.957   1.634   6.069
  565   2HB   LYS  72           HB1      LYS  72 116.408   0.311   7.147
  566   1HG   LYS  72           HG2      LYS  72 115.693   1.648   9.094
  567   2HG   LYS  72           HG1      LYS  72 115.239   2.969   8.018
  568   1HD   LYS  72           HD2      LYS  72 113.601   1.506   6.899
  569   2HD   LYS  72           HD1      LYS  72 114.051   0.182   7.974
  570   1HE   LYS  72           HE2      LYS  72 113.248   1.372   9.906
  571   2HE   LYS  72           HE1      LYS  72 113.023   2.850   8.971
  572   1HZ   LYS  72           HZ3      LYS  72 111.641   0.650   7.808
  573   2HZ   LYS  72           HZ2      LYS  72 111.155   0.894   9.418
  574   3HZ   LYS  72           HZ1      LYS  72 111.042   2.161   8.292
  575    H    GLN  73           HN       GLN  73 118.157   2.394   4.821
  576    HA   GLN  73           HA       GLN  73 119.641   0.019   4.240
  577   1HB   GLN  73           HB2      GLN  73 119.439   2.690   2.825
  578   2HB   GLN  73           HB1      GLN  73 120.305   1.306   2.157
  579   1HG   GLN  73           HG2      GLN  73 118.252  -0.038   2.223
  580   2HG   GLN  73           HG1      GLN  73 117.377   1.311   2.946
  581   1HE2  GLN  73          HE22      GLN  73 117.208   1.183  -0.926
  582   2HE2  GLN  73          HE21      GLN  73 117.190  -0.107   0.176
  583    H    SER  74           HN       SER  74 120.625   3.314   5.091
  584    HA   SER  74           HA       SER  74 123.408   2.966   4.663
  585   1HB   SER  74           HB2      SER  74 121.962   4.769   6.621
  586   2HB   SER  74           HB1      SER  74 123.644   4.931   6.130
  587    HG   SER  74           HG       SER  74 121.623   6.005   4.960
  588    H    ARG  75           HN       ARG  75 121.392   2.340   7.561
  589    HA   ARG  75           HA       ARG  75 123.546   1.828   9.341
  590   1HB   ARG  75           HB2      ARG  75 120.716   0.753   9.287
  591   2HB   ARG  75           HB1      ARG  75 121.847   0.431  10.603
  592   1HG   ARG  75           HG2      ARG  75 122.113   2.865  10.962
  593   2HG   ARG  75           HG1      ARG  75 120.961   3.178   9.664
  594   1HD   ARG  75           HD2      ARG  75 119.248   1.867  10.942
  595   2HD   ARG  75           HD1      ARG  75 120.403   1.722  12.264
  596    HE   ARG  75           HE       ARG  75 120.242   4.465  11.699
  597   1HH1  ARG  75          HH21      ARG  75 118.156   1.891  12.657
  598   2HH1  ARG  75          HH22      ARG  75 117.023   2.933  13.454
  599   1HH2  ARG  75          HH11      ARG  75 118.776   5.833  12.727
  600   2HH2  ARG  75          HH12      ARG  75 117.373   5.163  13.490
  601    H    ASP  76           HN       ASP  76 121.888  -0.352   7.041
  602    HA   ASP  76           HA       ASP  76 123.210  -2.719   7.959
  603   1HB   ASP  76           HB2      ASP  76 121.962  -2.004   5.299
  604   2HB   ASP  76           HB1      ASP  76 122.589  -3.610   5.672
  605    H    CYS  77           HN       CYS  77 124.119  -0.339   5.440
  606    HA   CYS  77           HA       CYS  77 126.369  -1.873   4.507
  607   1HB   CYS  77           HB2      CYS  77 125.689   1.075   4.356
  608   2HB   CYS  77           HB1      CYS  77 127.109   0.371   3.581
  609    HG   CYS  77           HG       CYS  77 125.367   0.133   1.750
  610    H    PHE  78           HN       PHE  78 126.029   0.678   7.003
  611    HA   PHE  78           HA       PHE  78 128.805   1.034   7.475
  612   1HB   PHE  78           HB2      PHE  78 127.113   2.523   8.429
  613   2HB   PHE  78           HB1      PHE  78 126.497   1.211   9.432
  614    HD1  PHE  78           HD1      PHE  78 129.350   3.497   8.862
  615    HD2  PHE  78           HD2      PHE  78 127.675   0.463  11.400
  616    HE1  PHE  78           HE1      PHE  78 131.026   4.034  10.611
  617    HE2  PHE  78           HE2      PHE  78 129.351   0.999  13.148
  618    HZ   PHE  78           HZ       PHE  78 131.027   2.785  12.753
  619    H    GLY  79           HN       GLY  79 126.575  -0.974   9.433
  620   1HA   GLY  79           HA2      GLY  79 128.618  -2.265  10.920
  621   2HA   GLY  79           HA1      GLY  79 126.996  -2.911  10.684
  622    H    CYS  80           HN       CYS  80 127.286  -2.997   7.747
  623    HA   CYS  80           HA       CYS  80 128.457  -5.648   7.566
  624   1HB   CYS  80           HB2      CYS  80 126.581  -4.981   6.138
  625   2HB   CYS  80           HB1      CYS  80 127.579  -3.736   5.385
  626    HG   CYS  80           HG       CYS  80 128.587  -5.462   3.925
  627    H    LEU  81           HN       LEU  81 129.490  -2.429   6.308
  628    HA   LEU  81           HA       LEU  81 131.951  -3.497   5.225
  629   1HB   LEU  81           HB2      LEU  81 131.202  -0.668   6.032
  630   2HB   LEU  81           HB1      LEU  81 132.615  -1.105   5.074
  631    HG   LEU  81           HG       LEU  81 129.766  -1.759   4.269
  632   1HD1  LEU  81          HD11      LEU  81 131.553   0.543   3.437
  633   2HD1  LEU  81          HD13      LEU  81 130.035   0.118   2.645
  634   3HD1  LEU  81          HD12      LEU  81 130.034   0.661   4.324
  635   1HD2  LEU  81          HD21      LEU  81 132.473  -2.053   2.965
  636   2HD2  LEU  81          HD23      LEU  81 131.163  -3.226   3.073
  637   3HD2  LEU  81          HD22      LEU  81 131.031  -1.861   1.970
  638    H    ARG  82           HN       ARG  82 131.037  -1.950   8.290
  639    HA   ARG  82           HA       ARG  82 133.664  -1.729   9.371
  640   1HB   ARG  82           HB2      ARG  82 131.629  -0.620  10.308
  641   2HB   ARG  82           HB1      ARG  82 131.087  -2.193  10.895
  642   1HG   ARG  82           HG2      ARG  82 133.130  -2.405  12.251
  643   2HG   ARG  82           HG1      ARG  82 133.697  -0.845  11.655
  644   1HD   ARG  82           HD2      ARG  82 131.646   0.217  12.614
  645   2HD   ARG  82           HD1      ARG  82 131.202  -1.344  13.307
  646    HE   ARG  82           HE       ARG  82 133.790  -0.902  14.222
  647   1HH1  ARG  82          HH21      ARG  82 130.765   0.758  14.267
  648   2HH1  ARG  82          HH22      ARG  82 131.104   1.608  15.737
  649   1HH2  ARG  82          HH11      ARG  82 134.247   0.207  16.139
  650   2HH2  ARG  82          HH12      ARG  82 133.071   1.297  16.795
  651    H    GLU  83           HN       GLU  83 131.328  -4.409   9.490
  652    HA   GLU  83           HA       GLU  83 132.931  -6.025  11.259
  653   1HB   GLU  83           HB2      GLU  83 130.639  -6.683   9.400
  654   2HB   GLU  83           HB1      GLU  83 131.446  -7.909  10.381
  655   1HG   GLU  83           HG2      GLU  83 130.886  -6.725  12.423
  656   2HG   GLU  83           HG1      GLU  83 130.226  -5.372  11.507
  657    H    TRP  84           HN       TRP  84 132.742  -5.835   7.688
  658    HA   TRP  84           HA       TRP  84 134.346  -8.139   7.169
  659   1HB   TRP  84           HB2      TRP  84 133.031  -6.853   5.441
  660   2HB   TRP  84           HB1      TRP  84 134.247  -5.579   5.541
  661    HD1  TRP  84           HD1      TRP  84 133.702  -9.128   4.298
  662    HE1  TRP  84           HE1      TRP  84 135.671  -9.806   2.780
  663    HE3  TRP  84           HE3      TRP  84 136.814  -5.143   5.044
  664    HZ2  TRP  84           HZ2      TRP  84 138.224  -8.802   1.992
  665    HZ3  TRP  84           HZ3      TRP  84 139.009  -5.039   3.899
  666    HH2  TRP  84           HH2      TRP  84 139.713  -6.856   2.370
  667    H    CYS  85           HN       CYS  85 135.201  -4.721   7.647
  668    HA   CYS  85           HA       CYS  85 138.001  -5.008   7.216
  669   1HB   CYS  85           HB2      CYS  85 136.416  -3.044   8.882
  670   2HB   CYS  85           HB1      CYS  85 138.163  -2.924   8.675
  671    HG   CYS  85           HG       CYS  85 136.068  -2.251   6.548
  672    H    ASP  86           HN       ASP  86 136.065  -5.363  10.170
  673    HA   ASP  86           HA       ASP  86 138.216  -5.647  11.998
  674   1HB   ASP  86           HB2      ASP  86 135.422  -6.810  11.969
  675   2HB   ASP  86           HB1      ASP  86 136.535  -7.056  13.315
  676    H    ALA  87           HN       ALA  87 136.853  -7.884   9.661
  677    HA   ALA  87           HA       ALA  87 138.454 -10.131  10.768
  678   1HB   ALA  87           HB2      ALA  87 136.072 -10.447  10.013
  679   2HB   ALA  87           HB1      ALA  87 136.620 -10.138   8.364
  680   3HB   ALA  87           HB3      ALA  87 137.231 -11.535   9.248
  681    H    PHE  88           HN       PHE  88 138.324  -8.064   7.884
  682    HA   PHE  88           HA       PHE  88 140.685  -9.533   6.763
  683   1HB   PHE  88           HB2      PHE  88 138.614  -7.744   5.504
  684   2HB   PHE  88           HB1      PHE  88 140.032  -8.339   4.643
  685    HD1  PHE  88           HD2      PHE  88 140.399 -10.856   4.499
  686    HD2  PHE  88           HD1      PHE  88 136.686  -9.107   5.769
  687    HE1  PHE  88           HE2      PHE  88 139.228 -12.986   4.011
  688    HE2  PHE  88           HE1      PHE  88 135.514 -11.240   5.278
  689    HZ   PHE  88           HZ       PHE  88 136.786 -13.172   4.393
  690    H    LEU  89           HN       LEU  89 140.008  -6.494   8.293
  691    HA   LEU  89           HA       LEU  89 142.250  -5.168   6.840
  692   1HB   LEU  89           HB2      LEU  89 140.074  -3.952   7.321
  693   2HB   LEU  89           HB1      LEU  89 140.507  -4.015   9.025
  694    HG   LEU  89           HG       LEU  89 142.728  -2.915   8.348
  695   1HD1  LEU  89          HD11      LEU  89 141.151  -2.633   5.781
  696   2HD1  LEU  89          HD13      LEU  89 142.357  -1.431   6.234
  697   3HD1  LEU  89          HD12      LEU  89 142.835  -3.106   5.993
  698   1HD2  LEU  89          HD23      LEU  89 140.111  -1.415   8.027
  699   2HD2  LEU  89          HD22      LEU  89 140.968  -1.709   9.540
  700   3HD2  LEU  89          HD21      LEU  89 141.676  -0.655   8.316
  701   1H    MET   1           HT1      MET   1 169.652  -5.655  -5.110
  702   2H    MET   1           HT3      MET   1 170.522  -4.320  -5.693
  703   3H    MET   1           HT2      MET   1 171.084  -5.171  -4.334
  704    HA   MET   1           HA       MET   1 170.121  -3.453  -3.255
  705   1HB   MET   1           HB2      MET   1 167.966  -2.403  -4.189
  706   2HB   MET   1           HB1      MET   1 169.445  -2.126  -5.105
  707   1HG   MET   1           HG2      MET   1 168.829  -4.065  -6.579
  708   2HG   MET   1           HG1      MET   1 167.295  -4.178  -5.722
  709   1HE   MET   1           HE1      MET   1 165.351  -2.904  -6.054
  710   2HE   MET   1           HE3      MET   1 166.065  -1.516  -5.223
  711   3HE   MET   1           HE2      MET   1 165.214  -1.291  -6.748
  712    H    THR   2           HN       THR   2 169.813  -5.445  -1.919
  713    HA   THR   2           HA       THR   2 167.365  -6.945  -2.002
  714    HB   THR   2           HB       THR   2 169.205  -6.453   0.360
  715    HG1  THR   2           HG1      THR   2 169.712  -7.618  -1.895
  716   1HG2  THR   2          HG22      THR   2 167.008  -8.447  -0.204
  717   2HG2  THR   2          HG21      THR   2 168.267  -8.762   0.990
  718   3HG2  THR   2          HG23      THR   2 167.186  -7.383   1.192
  719    H    THR   3           HN       THR   3 165.439  -6.659  -0.847
  720    HA   THR   3           HA       THR   3 164.709  -3.941  -0.198
  721    HB   THR   3           HB       THR   3 162.560  -4.918   0.506
  722    HG1  THR   3           HG1      THR   3 164.066  -7.297   0.311
  723   1HG2  THR   3          HG21      THR   3 163.234  -4.668  -1.948
  724   2HG2  THR   3          HG23      THR   3 163.534  -6.405  -1.935
  725   3HG2  THR   3          HG22      THR   3 161.913  -5.788  -1.613
  726    H    SER   4           HN       SER   4 163.918  -3.233   1.942
  727    HA   SER   4           HA       SER   4 165.774  -4.027   4.058
  728   1HB   SER   4           HB2      SER   4 163.504  -2.030   3.922
  729   2HB   SER   4           HB1      SER   4 164.430  -2.316   5.393
  730    HG   SER   4           HG       SER   4 165.116  -0.994   3.081
  731    H    GLN   5           HN       GLN   5 164.844  -4.478   6.293
  732    HA   GLN   5           HA       GLN   5 163.252  -6.859   6.207
  733   1HB   GLN   5           HB2      GLN   5 164.060  -5.045   8.493
  734   2HB   GLN   5           HB1      GLN   5 163.200  -6.568   8.721
  735   1HG   GLN   5           HG2      GLN   5 165.020  -7.794   7.637
  736   2HG   GLN   5           HG1      GLN   5 165.871  -6.282   7.316
  737   1HE2  GLN   5          HE22      GLN   5 167.187  -7.787  10.507
  738   2HE2  GLN   5          HE21      GLN   5 167.054  -8.355   8.913
  739    H    LYS   6           HN       LYS   6 162.383  -3.502   6.372
  740    HA   LYS   6           HA       LYS   6 159.889  -3.728   7.727
  741   1HB   LYS   6           HB2      LYS   6 160.920  -1.787   5.649
  742   2HB   LYS   6           HB1      LYS   6 159.365  -1.593   6.463
  743   1HG   LYS   6           HG2      LYS   6 160.506  -1.606   8.649
  744   2HG   LYS   6           HG1      LYS   6 162.062  -1.794   7.838
  745   1HD   LYS   6           HD2      LYS   6 161.714   0.357   6.675
  746   2HD   LYS   6           HD1      LYS   6 160.163   0.547   7.496
  747   1HE   LYS   6           HE2      LYS   6 161.306   0.523   9.680
  748   2HE   LYS   6           HE1      LYS   6 162.858   0.320   8.868
  749   1HZ   LYS   6           HZ3      LYS   6 161.733   2.471   7.632
  750   2HZ   LYS   6           HZ2      LYS   6 161.310   2.690   9.263
  751   3HZ   LYS   6           HZ1      LYS   6 162.942   2.525   8.820
  752    H    HIS   7           HN       HIS   7 160.787  -4.093   4.302
  753    HA   HIS   7           HA       HIS   7 158.148  -4.240   3.271
  754   1HB   HIS   7           HB2      HIS   7 160.079  -4.035   1.795
  755   2HB   HIS   7           HB1      HIS   7 160.679  -5.609   2.315
  756    HD2  HIS   7           HD2      HIS   7 159.407  -7.824   1.120
  757    HE1  HIS   7           HE1      HIS   7 156.774  -5.616  -1.329
  758    HE2  HIS   7           HE2      HIS   7 157.672  -7.927  -0.821
  759    H    ARG   8           HN       ARG   8 160.277  -6.939   4.329
  760    HA   ARG   8           HA       ARG   8 158.243  -8.929   3.914
  761   1HB   ARG   8           HB2      ARG   8 160.803  -8.936   5.536
  762   2HB   ARG   8           HB1      ARG   8 159.764 -10.352   5.360
  763   1HG   ARG   8           HG2      ARG   8 160.013 -10.231   2.905
  764   2HG   ARG   8           HG1      ARG   8 161.061  -8.823   3.084
  765   1HD   ARG   8           HD2      ARG   8 162.636 -10.200   4.434
  766   2HD   ARG   8           HD1      ARG   8 161.605 -11.604   4.168
  767    HE   ARG   8           HE       ARG   8 162.168 -10.617   1.613
  768   1HH1  ARG   8          HH21      ARG   8 163.915 -11.712   4.378
  769   2HH1  ARG   8          HH22      ARG   8 165.275 -12.269   3.461
  770   1HH2  ARG   8          HH11      ARG   8 163.934 -11.333   0.403
  771   2HH2  ARG   8          HH12      ARG   8 165.285 -12.055   1.211
  772    H    ASP   9           HN       ASP   9 159.178  -6.903   6.628
  773    HA   ASP   9           HA       ASP   9 157.606  -8.339   8.588
  774   1HB   ASP   9           HB2      ASP   9 158.735  -5.537   8.548
  775   2HB   ASP   9           HB1      ASP   9 157.864  -6.206   9.925
  776    H    PHE  10           HN       PHE  10 156.998  -5.528   6.494
  777    HA   PHE  10           HA       PHE  10 154.445  -4.895   7.655
  778   1HB   PHE  10           HB2      PHE  10 155.801  -3.381   6.164
  779   2HB   PHE  10           HB1      PHE  10 155.315  -4.389   4.800
  780    HD1  PHE  10           HD2      PHE  10 152.967  -4.479   4.063
  781    HD2  PHE  10           HD1      PHE  10 154.203  -1.948   7.308
  782    HE1  PHE  10           HE2      PHE  10 150.814  -3.256   3.930
  783    HE2  PHE  10           HE1      PHE  10 152.050  -0.726   7.176
  784    HZ   PHE  10           HZ       PHE  10 150.355  -1.378   5.488
  785    H    VAL  11           HN       VAL  11 155.339  -6.900   4.823
  786    HA   VAL  11           HA       VAL  11 152.517  -7.613   4.378
  787    HB   VAL  11           HB       VAL  11 153.352  -8.896   2.492
  788   1HG1  VAL  11          HG12      VAL  11 154.846  -6.275   2.831
  789   2HG1  VAL  11          HG11      VAL  11 154.603  -7.105   1.294
  790   3HG1  VAL  11          HG13      VAL  11 153.219  -6.464   2.182
  791   1HG2  VAL  11          HG22      VAL  11 155.995  -8.499   3.883
  792   2HG2  VAL  11          HG21      VAL  11 155.268 -10.001   3.322
  793   3HG2  VAL  11          HG23      VAL  11 155.925  -8.853   2.158
  794    H    ALA  12           HN       ALA  12 154.314  -8.459   6.829
  795    HA   ALA  12           HA       ALA  12 153.748 -11.407   6.681
  796   1HB   ALA  12           HB2      ALA  12 155.784  -9.809   8.238
  797   2HB   ALA  12           HB1      ALA  12 155.387 -11.479   8.644
  798   3HB   ALA  12           HB3      ALA  12 156.071 -11.094   7.064
  799    H    GLU  13           HN       GLU  13 152.679  -8.501   8.107
  800    HA   GLU  13           HA       GLU  13 150.913 -10.023   9.895
  801   1HB   GLU  13           HB2      GLU  13 151.526  -8.573  11.874
  802   2HB   GLU  13           HB1      GLU  13 152.785  -9.710  11.396
  803   1HG   GLU  13           HG2      GLU  13 153.958  -7.963  10.180
  804   2HG   GLU  13           HG1      GLU  13 152.666  -6.812  10.517
  805    HA   PRO  14           HA       PRO  14 147.868  -6.972   8.775
  806   1HB   PRO  14           HB2      PRO  14 147.666  -6.477  11.740
  807   2HB   PRO  14           HB1      PRO  14 146.367  -6.665  10.543
  808   1HG   PRO  14           HG2      PRO  14 147.045  -8.676  12.147
  809   2HG   PRO  14           HG1      PRO  14 146.592  -8.961  10.456
  810   1HD   PRO  14           HD2      PRO  14 149.280  -9.142  11.724
  811   2HD   PRO  14           HD1      PRO  14 148.666  -9.939  10.259
  812    H    MET  15           HN       MET  15 147.560  -4.594   8.781
  813    HA   MET  15           HA       MET  15 150.112  -3.182   9.266
  814   1HB   MET  15           HB2      MET  15 148.811  -1.257   8.173
  815   2HB   MET  15           HB1      MET  15 149.128  -2.667   7.161
  816   1HG   MET  15           HG2      MET  15 146.913  -3.438   7.320
  817   2HG   MET  15           HG1      MET  15 146.577  -2.473   8.758
  818   1HE   MET  15           HE3      MET  15 147.919  -2.229   5.194
  819   2HE   MET  15           HE2      MET  15 146.232  -2.660   4.923
  820   3HE   MET  15           HE1      MET  15 146.826  -1.087   4.394
  821    H    GLY  16           HN       GLY  16 147.005  -3.540  10.740
  822   1HA   GLY  16           HA2      GLY  16 146.009  -2.464  12.581
  823   2HA   GLY  16           HA1      GLY  16 147.666  -2.346  13.174
  824    H    GLU  17           HN       GLU  17 147.636  -0.266  13.996
  825    HA   GLU  17           HA       GLU  17 146.728   1.950  12.206
  826   1HB   GLU  17           HB2      GLU  17 147.195   1.794  15.194
  827   2HB   GLU  17           HB1      GLU  17 146.839   3.297  14.341
  828   1HG   GLU  17           HG2      GLU  17 144.734   2.328  13.497
  829   2HG   GLU  17           HG1      GLU  17 145.084   0.823  14.347
  830    H    LYS  18           HN       LYS  18 149.378   0.573  11.946
  831    HA   LYS  18           HA       LYS  18 151.458   2.168  13.052
  832   1HB   LYS  18           HB2      LYS  18 151.306   0.560  10.486
  833   2HB   LYS  18           HB1      LYS  18 152.791   1.326  11.043
  834   1HG   LYS  18           HG2      LYS  18 152.484   0.071  13.233
  835   2HG   LYS  18           HG1      LYS  18 151.196  -0.836  12.440
  836   1HD   LYS  18           HD2      LYS  18 152.855  -1.439  10.631
  837   2HD   LYS  18           HD1      LYS  18 154.114  -0.718  11.635
  838   1HE   LYS  18           HE2      LYS  18 152.314  -3.033  12.408
  839   2HE   LYS  18           HE1      LYS  18 154.035  -3.130  12.030
  840   1HZ   LYS  18           HZ1      LYS  18 154.134  -1.305  13.904
  841   2HZ   LYS  18           HZ3      LYS  18 152.708  -2.071  14.409
  842   3HZ   LYS  18           HZ2      LYS  18 154.149  -2.963  14.274
  843    HA   PRO  19           HA       PRO  19 150.993   5.982  10.824
  844   1HB   PRO  19           HB2      PRO  19 153.616   6.827  10.621
  845   2HB   PRO  19           HB1      PRO  19 152.673   6.895  12.125
  846   1HG   PRO  19           HG2      PRO  19 154.663   4.846  11.238
  847   2HG   PRO  19           HG1      PRO  19 154.459   5.602  12.830
  848   1HD   PRO  19           HD2      PRO  19 153.518   3.118  12.316
  849   2HD   PRO  19           HD1      PRO  19 152.657   4.231  13.402
  850    H    VAL  20           HN       VAL  20 151.337   7.015   8.771
  851    HA   VAL  20           HA       VAL  20 151.400   5.304   6.536
  852    HB   VAL  20           HB       VAL  20 150.416   7.490   6.334
  853   1HG1  VAL  20          HG11      VAL  20 151.947   8.582   8.007
  854   2HG1  VAL  20          HG13      VAL  20 153.182   8.660   6.750
  855   3HG1  VAL  20          HG12      VAL  20 151.669   9.548   6.559
  856   1HG2  VAL  20          HG22      VAL  20 151.701   6.457   4.341
  857   2HG2  VAL  20          HG21      VAL  20 151.295   8.170   4.238
  858   3HG2  VAL  20          HG23      VAL  20 152.932   7.676   4.667
  859    H    GLY  21           HN       GLY  21 154.037   7.198   7.959
  860   1HA   GLY  21           HA2      GLY  21 155.991   6.705   5.961
  861   2HA   GLY  21           HA1      GLY  21 156.361   7.071   7.645
  862    H    SER  22           HN       SER  22 154.423   4.404   7.808
  863    HA   SER  22           HA       SER  22 156.728   2.653   8.272
  864   1HB   SER  22           HB2      SER  22 153.738   2.172   8.447
  865   2HB   SER  22           HB1      SER  22 154.957   0.974   8.871
  866    HG   SER  22           HG       SER  22 154.005   2.568  10.529
  867    H    LEU  23           HN       LEU  23 154.492   3.321   5.716
  868    HA   LEU  23           HA       LEU  23 154.619   0.799   4.354
  869   1HB   LEU  23           HB2      LEU  23 154.209   3.584   3.225
  870   2HB   LEU  23           HB1      LEU  23 153.878   2.078   2.370
  871    HG   LEU  23           HG       LEU  23 152.563   2.917   4.973
  872   1HD1  LEU  23          HD11      LEU  23 151.646   3.029   2.090
  873   2HD1  LEU  23          HD13      LEU  23 150.529   3.116   3.451
  874   3HD1  LEU  23          HD12      LEU  23 151.760   4.361   3.239
  875   1HD2  LEU  23          HD22      LEU  23 152.395   0.472   3.213
  876   2HD2  LEU  23          HD21      LEU  23 152.407   0.580   4.974
  877   3HD2  LEU  23          HD23      LEU  23 150.953   1.002   4.075
  878    H    ALA  24           HN       ALA  24 156.056   0.013   2.895
  879    HA   ALA  24           HA       ALA  24 158.759   0.974   2.964
  880   1HB   ALA  24           HB3      ALA  24 157.418  -0.908   1.005
  881   2HB   ALA  24           HB2      ALA  24 159.159  -0.693   1.171
  882   3HB   ALA  24           HB1      ALA  24 158.223  -1.376   2.502
  883    H    GLY  25           HN       GLY  25 159.836   2.346   1.638
  884   1HA   GLY  25           HA2      GLY  25 160.249   3.476  -0.479
  885   2HA   GLY  25           HA1      GLY  25 158.546   3.280  -0.890
  886    H    ILE  26           HN       ILE  26 157.960   4.141   2.027
  887    HA   ILE  26           HA       ILE  26 158.003   7.072   1.442
  888    HB   ILE  26           HB       ILE  26 156.531   5.576   3.635
  889   1HG1  ILE  26          HG12      ILE  26 155.695   4.755   1.517
  890   2HG1  ILE  26          HG11      ILE  26 154.522   5.908   2.146
  891   1HG2  ILE  26          HG21      ILE  26 156.889   7.995   4.013
  892   2HG2  ILE  26          HG23      ILE  26 156.146   8.340   2.450
  893   3HG2  ILE  26          HG22      ILE  26 155.186   7.627   3.747
  894   1HD1  ILE  26          HD12      ILE  26 155.844   7.662   0.720
  895   2HD1  ILE  26          HD11      ILE  26 156.465   6.246  -0.129
  896   3HD1  ILE  26          HD13      ILE  26 154.732   6.565  -0.098
  897    H    GLY  27           HN       GLY  27 159.712   8.179   2.380
  898   1HA   GLY  27           HA2      GLY  27 161.043   6.986   4.742
  899   2HA   GLY  27           HA1      GLY  27 161.651   8.328   3.772
  900    H    GLU  28           HN       GLU  28 161.799   8.815   6.359
  901    HA   GLU  28           HA       GLU  28 159.518   9.739   7.742
  902   1HB   GLU  28           HB2      GLU  28 162.387  10.709   7.845
  903   2HB   GLU  28           HB1      GLU  28 161.143  11.200   8.995
  904   1HG   GLU  28           HG2      GLU  28 161.874   8.311   8.457
  905   2HG   GLU  28           HG1      GLU  28 162.566   9.263   9.770
  906    H    VAL  29           HN       VAL  29 161.604  11.481   5.431
  907    HA   VAL  29           HA       VAL  29 160.292  14.020   5.807
  908    HB   VAL  29           HB       VAL  29 161.916  12.900   3.504
  909   1HG1  VAL  29          HG13      VAL  29 160.665  15.615   3.924
  910   2HG1  VAL  29          HG12      VAL  29 162.133  15.432   2.961
  911   3HG1  VAL  29          HG11      VAL  29 160.653  14.605   2.478
  912   1HG2  VAL  29          HG22      VAL  29 162.524  14.716   5.851
  913   2HG2  VAL  29          HG21      VAL  29 163.270  13.167   5.458
  914   3HG2  VAL  29          HG23      VAL  29 163.590  14.579   4.452
  915    H    LEU  30           HN       LEU  30 159.849  11.398   3.456
  916    HA   LEU  30           HA       LEU  30 157.753  12.697   1.976
  917   1HB   LEU  30           HB2      LEU  30 158.321   9.737   2.318
  918   2HB   LEU  30           HB1      LEU  30 157.288  10.444   1.079
  919    HG   LEU  30           HG       LEU  30 160.245  11.034   1.417
  920   1HD1  LEU  30          HD13      LEU  30 158.707   9.168  -0.399
  921   2HD1  LEU  30          HD12      LEU  30 160.302   9.776  -0.839
  922   3HD1  LEU  30          HD11      LEU  30 160.101   8.805   0.619
  923   1HD2  LEU  30          HD21      LEU  30 158.097  12.021  -0.459
  924   2HD2  LEU  30          HD23      LEU  30 159.375  12.932   0.348
  925   3HD2  LEU  30          HD22      LEU  30 159.762  11.908  -1.031
  926    H    GLY  31           HN       GLY  31 157.759  10.484   4.738
  927   1HA   GLY  31           HA2      GLY  31 154.956  10.018   4.869
  928   2HA   GLY  31           HA1      GLY  31 156.046   9.956   6.255
  929    H    LYS  32           HN       LYS  32 156.936  12.688   6.087
  930    HA   LYS  32           HA       LYS  32 154.883  13.959   7.625
  931   1HB   LYS  32           HB2      LYS  32 157.338  14.455   7.769
  932   2HB   LYS  32           HB1      LYS  32 157.216  15.278   6.215
  933   1HG   LYS  32           HG2      LYS  32 155.545  16.828   7.163
  934   2HG   LYS  32           HG1      LYS  32 155.672  16.007   8.719
  935   1HD   LYS  32           HD2      LYS  32 158.049  16.592   8.863
  936   2HD   LYS  32           HD1      LYS  32 157.966  17.375   7.284
  937   1HE   LYS  32           HE2      LYS  32 156.411  19.034   8.121
  938   2HE   LYS  32           HE1      LYS  32 156.286  18.197   9.669
  939   1HZ   LYS  32           HZ3      LYS  32 158.850  18.519   9.673
  940   2HZ   LYS  32           HZ2      LYS  32 158.511  19.775   8.579
  941   3HZ   LYS  32           HZ1      LYS  32 157.835  19.796  10.138
  942    H    LYS  33           HN       LYS  33 155.823  14.326   4.191
  943    HA   LYS  33           HA       LYS  33 154.080  16.556   3.695
  944   1HB   LYS  33           HB2      LYS  33 155.243  14.445   1.863
  945   2HB   LYS  33           HB1      LYS  33 154.310  15.824   1.279
  946   1HG   LYS  33           HG2      LYS  33 155.910  17.366   2.357
  947   2HG   LYS  33           HG1      LYS  33 156.846  15.987   2.933
  948   1HD   LYS  33           HD2      LYS  33 157.242  15.273   0.606
  949   2HD   LYS  33           HD1      LYS  33 156.308  16.653   0.024
  950   1HE   LYS  33           HE2      LYS  33 158.857  16.795   1.661
  951   2HE   LYS  33           HE1      LYS  33 158.707  17.168  -0.056
  952   1HZ   LYS  33           HZ3      LYS  33 157.034  18.878   0.600
  953   2HZ   LYS  33           HZ2      LYS  33 157.465  18.607   2.220
  954   3HZ   LYS  33           HZ1      LYS  33 158.615  19.204   1.121
  955    H    LEU  34           HN       LEU  34 153.612  13.040   3.164
  956    HA   LEU  34           HA       LEU  34 150.959  13.253   2.134
  957   1HB   LEU  34           HB2      LEU  34 152.328  11.044   3.697
  958   2HB   LEU  34           HB1      LEU  34 150.733  10.871   2.982
  959    HG   LEU  34           HG       LEU  34 153.098  11.739   1.321
  960   1HD1  LEU  34          HD13      LEU  34 152.159   8.905   1.871
  961   2HD1  LEU  34          HD12      LEU  34 153.361   9.361   0.662
  962   3HD1  LEU  34          HD11      LEU  34 153.699   9.603   2.377
  963   1HD2  LEU  34          HD23      LEU  34 150.362  10.549   0.751
  964   2HD2  LEU  34          HD22      LEU  34 151.030  12.069   0.162
  965   3HD2  LEU  34          HD21      LEU  34 151.651  10.541  -0.450
  966    H    GLU  35           HN       GLU  35 152.237  13.035   5.409
  967    HA   GLU  35           HA       GLU  35 149.753  12.806   6.794
  968   1HB   GLU  35           HB2      GLU  35 151.935  12.465   7.886
  969   2HB   GLU  35           HB1      GLU  35 152.309  14.176   7.686
  970   1HG   GLU  35           HG2      GLU  35 150.407  14.784   9.111
  971   2HG   GLU  35           HG1      GLU  35 149.962  13.083   9.269
  972    H    GLU  36           HN       GLU  36 151.522  15.693   5.686
  973    HA   GLU  36           HA       GLU  36 149.690  17.579   6.880
  974   1HB   GLU  36           HB2      GLU  36 151.610  17.821   4.544
  975   2HB   GLU  36           HB1      GLU  36 150.678  19.176   5.180
  976   1HG   GLU  36           HG2      GLU  36 151.703  18.848   7.400
  977   2HG   GLU  36           HG1      GLU  36 152.639  17.492   6.770
  978    H    ARG  37           HN       ARG  37 149.560  15.548   4.112
  979    HA   ARG  37           HA       ARG  37 147.470  17.167   2.781
  980   1HB   ARG  37           HB2      ARG  37 148.752  14.514   2.090
  981   2HB   ARG  37           HB1      ARG  37 147.491  15.270   1.117
  982   1HG   ARG  37           HG2      ARG  37 150.124  16.587   1.835
  983   2HG   ARG  37           HG1      ARG  37 149.816  15.773   0.305
  984   1HD   ARG  37           HD2      ARG  37 147.690  17.438   0.312
  985   2HD   ARG  37           HD1      ARG  37 148.786  18.405   1.295
  986    HE   ARG  37           HE       ARG  37 148.893  18.175  -1.523
  987   1HH1  ARG  37          HH21      ARG  37 151.007  17.883   1.193
  988   2HH1  ARG  37          HH22      ARG  37 152.445  18.056   0.250
  989   1HH2  ARG  37          HH11      ARG  37 150.755  18.427  -2.751
  990   2HH2  ARG  37          HH12      ARG  37 152.305  18.373  -1.979
  991    H    GLY  38           HN       GLY  38 147.397  15.123   5.398
  992   1HA   GLY  38           HA2      GLY  38 145.239  14.648   6.422
  993   2HA   GLY  38           HA1      GLY  38 144.538  14.440   4.824
  994    H    PHE  39           HN       PHE  39 147.530  12.863   4.915
  995    HA   PHE  39           HA       PHE  39 146.154  10.237   5.378
  996   1HB   PHE  39           HB2      PHE  39 148.737  10.959   3.984
  997   2HB   PHE  39           HB1      PHE  39 148.163   9.308   4.201
  998    HD1  PHE  39           HD2      PHE  39 146.193   8.498   2.994
  999    HD2  PHE  39           HD1      PHE  39 147.652  12.492   2.460
 1000    HE1  PHE  39           HE2      PHE  39 144.767   8.745   0.978
 1001    HE2  PHE  39           HE1      PHE  39 146.236  12.747   0.444
 1002    HZ   PHE  39           HZ       PHE  39 144.787  10.872  -0.299
 1003    H    ASP  40           HN       ASP  40 146.379  10.862   7.765
 1004    HA   ASP  40           HA       ASP  40 149.093  10.837   8.862
 1005   1HB   ASP  40           HB2      ASP  40 147.956  10.978  11.045
 1006   2HB   ASP  40           HB1      ASP  40 147.317  12.176   9.920
 1007    H    LYS  41           HN       LYS  41 146.840   8.417   7.948
 1008    HA   LYS  41           HA       LYS  41 148.385   6.386   9.537
 1009   1HB   LYS  41           HB2      LYS  41 145.414   6.346   8.932
 1010   2HB   LYS  41           HB1      LYS  41 146.312   5.092   9.780
 1011   1HG   LYS  41           HG2      LYS  41 146.244   7.953  10.756
 1012   2HG   LYS  41           HG1      LYS  41 145.027   6.775  11.237
 1013   1HD   LYS  41           HD2      LYS  41 146.926   5.284  12.027
 1014   2HD   LYS  41           HD1      LYS  41 148.009   6.651  11.764
 1015   1HE   LYS  41           HE2      LYS  41 145.563   6.718  13.548
 1016   2HE   LYS  41           HE1      LYS  41 147.221   6.522  14.117
 1017   1HZ   LYS  41           HZ3      LYS  41 147.420   8.683  12.537
 1018   2HZ   LYS  41           HZ2      LYS  41 145.860   8.888  13.178
 1019   3HZ   LYS  41           HZ1      LYS  41 147.197   8.742  14.217
 1020    H    ALA  42           HN       ALA  42 148.689   4.384   8.506
 1021    HA   ALA  42           HA       ALA  42 149.083   4.510   5.678
 1022   1HB   ALA  42           HB3      ALA  42 150.298   3.024   7.335
 1023   2HB   ALA  42           HB2      ALA  42 148.879   1.980   7.318
 1024   3HB   ALA  42           HB1      ALA  42 149.803   2.236   5.838
 1025    H    TYR  43           HN       TYR  43 146.463   2.973   7.579
 1026    HA   TYR  43           HA       TYR  43 145.279   1.609   5.394
 1027   1HB   TYR  43           HB2      TYR  43 143.219   1.507   6.708
 1028   2HB   TYR  43           HB1      TYR  43 144.624   1.141   7.703
 1029    HD1  TYR  43           HD1      TYR  43 142.241   3.860   6.783
 1030    HD2  TYR  43           HD2      TYR  43 145.109   2.422   9.638
 1031    HE1  TYR  43           HE1      TYR  43 141.553   5.636   8.369
 1032    HE2  TYR  43           HE2      TYR  43 144.428   4.207  11.219
 1033    HH   TYR  43           HH       TYR  43 142.103   5.604  11.508
 1034    H    VAL  44           HN       VAL  44 145.315   5.011   6.036
 1035    HA   VAL  44           HA       VAL  44 142.933   5.560   4.399
 1036    HB   VAL  44           HB       VAL  44 145.159   7.419   5.329
 1037   1HG1  VAL  44          HG13      VAL  44 143.917   8.244   3.322
 1038   2HG1  VAL  44          HG12      VAL  44 142.412   8.059   4.212
 1039   3HG1  VAL  44          HG11      VAL  44 143.613   9.229   4.750
 1040   1HG2  VAL  44          HG23      VAL  44 142.362   6.928   6.405
 1041   2HG2  VAL  44          HG22      VAL  44 143.869   6.461   7.191
 1042   3HG2  VAL  44          HG21      VAL  44 143.472   8.166   6.990
 1043    H    VAL  45           HN       VAL  45 146.366   5.294   4.057
 1044    HA   VAL  45           HA       VAL  45 146.525   6.333   1.334
 1045    HB   VAL  45           HB       VAL  45 148.459   4.616   2.921
 1046   1HG1  VAL  45          HG11      VAL  45 148.659   5.985   0.234
 1047   2HG1  VAL  45          HG13      VAL  45 150.092   5.580   1.182
 1048   3HG1  VAL  45          HG12      VAL  45 149.008   4.303   0.629
 1049   1HG2  VAL  45          HG21      VAL  45 148.034   6.848   3.892
 1050   2HG2  VAL  45          HG23      VAL  45 149.665   6.748   3.230
 1051   3HG2  VAL  45          HG22      VAL  45 148.402   7.593   2.336
 1052    H    LEU  46           HN       LEU  46 146.313   3.120   2.834
 1053    HA   LEU  46           HA       LEU  46 146.597   1.592   0.440
 1054   1HB   LEU  46           HB2      LEU  46 146.601   0.566   2.707
 1055   2HB   LEU  46           HB1      LEU  46 144.898   0.983   2.889
 1056    HG   LEU  46           HG       LEU  46 144.380  -0.411   0.885
 1057   1HD1  LEU  46          HD12      LEU  46 147.359  -0.767   0.927
 1058   2HD1  LEU  46          HD11      LEU  46 146.354  -2.097   0.359
 1059   3HD1  LEU  46          HD13      LEU  46 146.277  -0.532  -0.444
 1060   1HD2  LEU  46          HD23      LEU  46 144.664  -1.269   3.429
 1061   2HD2  LEU  46          HD22      LEU  46 144.194  -2.330   2.109
 1062   3HD2  LEU  46          HD21      LEU  46 145.869  -2.297   2.649
 1063    H    GLY  47           HN       GLY  47 143.870   3.195   1.970
 1064   1HA   GLY  47           HA2      GLY  47 141.753   2.225   0.372
 1065   2HA   GLY  47           HA1      GLY  47 141.784   3.837   1.091
 1066    H    GLN  48           HN       GLN  48 144.008   4.939  -0.250
 1067    HA   GLN  48           HA       GLN  48 142.831   5.786  -2.707
 1068   1HB   GLN  48           HB2      GLN  48 144.637   6.988  -1.393
 1069   2HB   GLN  48           HB1      GLN  48 145.789   5.824  -2.047
 1070   1HG   GLN  48           HG2      GLN  48 145.872   7.721  -3.502
 1071   2HG   GLN  48           HG1      GLN  48 144.954   6.487  -4.364
 1072   1HE2  GLN  48          HE22      GLN  48 142.568   9.320  -2.591
 1073   2HE2  GLN  48          HE21      GLN  48 143.767   8.544  -1.674
 1074    H    PHE  49           HN       PHE  49 145.330   3.334  -2.036
 1075    HA   PHE  49           HA       PHE  49 145.913   2.643  -4.741
 1076   1HB   PHE  49           HB2      PHE  49 147.269   1.896  -2.814
 1077   2HB   PHE  49           HB1      PHE  49 145.932   0.891  -2.262
 1078    HD1  PHE  49           HD1      PHE  49 148.461   1.357  -4.930
 1079    HD2  PHE  49           HD2      PHE  49 145.422  -1.213  -3.314
 1080    HE1  PHE  49           HE1      PHE  49 149.256  -0.494  -6.378
 1081    HE2  PHE  49           HE2      PHE  49 146.215  -3.062  -4.765
 1082    HZ   PHE  49           HZ       PHE  49 148.132  -2.702  -6.297
 1083    H    LEU  50           HN       LEU  50 143.442   1.508  -2.495
 1084    HA   LEU  50           HA       LEU  50 142.363  -0.509  -4.274
 1085   1HB   LEU  50           HB2      LEU  50 141.026   1.002  -2.007
 1086   2HB   LEU  50           HB1      LEU  50 140.347  -0.415  -2.802
 1087    HG   LEU  50           HG       LEU  50 143.040  -0.390  -1.400
 1088   1HD1  LEU  50          HD12      LEU  50 141.012  -0.004   0.090
 1089   2HD1  LEU  50          HD11      LEU  50 140.459  -1.605  -0.388
 1090   3HD1  LEU  50          HD13      LEU  50 141.980  -1.422   0.488
 1091   1HD2  LEU  50          HD21      LEU  50 141.355  -2.509  -2.742
 1092   2HD2  LEU  50          HD23      LEU  50 143.085  -2.206  -2.901
 1093   3HD2  LEU  50          HD22      LEU  50 142.455  -2.954  -1.438
 1094    H    VAL  51           HN       VAL  51 141.649   2.923  -3.765
 1095    HA   VAL  51           HA       VAL  51 139.357   3.026  -5.482
 1096    HB   VAL  51           HB       VAL  51 141.306   5.193  -4.660
 1097   1HG1  VAL  51          HG13      VAL  51 138.718   5.288  -6.223
 1098   2HG1  VAL  51          HG12      VAL  51 139.321   6.689  -5.338
 1099   3HG1  VAL  51          HG11      VAL  51 140.275   5.998  -6.651
 1100   1HG2  VAL  51          HG21      VAL  51 139.872   4.017  -2.906
 1101   2HG2  VAL  51          HG23      VAL  51 139.654   5.763  -3.015
 1102   3HG2  VAL  51          HG22      VAL  51 138.465   4.678  -3.739
 1103    H    LEU  52           HN       LEU  52 142.792   3.090  -6.173
 1104    HA   LEU  52           HA       LEU  52 142.376   4.124  -8.900
 1105   1HB   LEU  52           HB2      LEU  52 144.828   3.071  -7.477
 1106   2HB   LEU  52           HB1      LEU  52 144.838   3.735  -9.110
 1107    HG   LEU  52           HG       LEU  52 143.862   5.241  -6.665
 1108   1HD1  LEU  52          HD11      LEU  52 146.533   5.163  -8.069
 1109   2HD1  LEU  52          HD13      LEU  52 146.046   6.528  -7.066
 1110   3HD1  LEU  52          HD12      LEU  52 146.195   4.920  -6.357
 1111   1HD2  LEU  52          HD21      LEU  52 144.157   5.900  -9.595
 1112   2HD2  LEU  52          HD23      LEU  52 142.861   6.329  -8.479
 1113   3HD2  LEU  52          HD22      LEU  52 144.399   7.180  -8.407
 1114    H    LYS  53           HN       LYS  53 141.495   1.259  -7.790
 1115    HA   LYS  53           HA       LYS  53 141.425  -0.915  -8.692
 1116   1HB   LYS  53           HB2      LYS  53 141.619   0.790 -11.188
 1117   2HB   LYS  53           HB1      LYS  53 141.169  -0.915 -11.183
 1118   1HG   LYS  53           HG2      LYS  53 139.273  -0.389  -9.663
 1119   2HG   LYS  53           HG1      LYS  53 139.695   1.319  -9.752
 1120   1HD   LYS  53           HD2      LYS  53 139.166  -0.276 -12.261
 1121   2HD   LYS  53           HD1      LYS  53 137.838   0.424 -11.339
 1122   1HE   LYS  53           HE2      LYS  53 138.944   2.661 -11.524
 1123   2HE   LYS  53           HE1      LYS  53 140.171   1.933 -12.560
 1124   1HZ   LYS  53           HZ1      LYS  53 137.596   1.212 -13.462
 1125   2HZ   LYS  53           HZ3      LYS  53 137.692   2.899 -13.318
 1126   3HZ   LYS  53           HZ2      LYS  53 138.814   2.065 -14.283
 1127    H    LYS  54           HN       LYS  54 144.052  -0.099  -7.906
 1128    HA   LYS  54           HA       LYS  54 146.276  -0.787  -8.100
 1129   1HB   LYS  54           HB2      LYS  54 145.076  -2.822 -10.010
 1130   2HB   LYS  54           HB1      LYS  54 146.672  -2.911  -9.274
 1131   1HG   LYS  54           HG2      LYS  54 145.653  -2.937  -7.035
 1132   2HG   LYS  54           HG1      LYS  54 144.049  -2.837  -7.758
 1133   1HD   LYS  54           HD2      LYS  54 144.438  -4.979  -8.920
 1134   2HD   LYS  54           HD1      LYS  54 146.041  -5.082  -8.188
 1135   1HE   LYS  54           HE2      LYS  54 145.120  -5.260  -5.981
 1136   2HE   LYS  54           HE1      LYS  54 143.505  -4.838  -6.553
 1137   1HZ   LYS  54           HZ1      LYS  54 144.787  -7.142  -7.794
 1138   2HZ   LYS  54           HZ3      LYS  54 144.276  -7.331  -6.188
 1139   3HZ   LYS  54           HZ2      LYS  54 143.156  -6.891  -7.388
 1140    H    ASP  55           HN       ASP  55 144.989   1.135 -10.203
 1141    HA   ASP  55           HA       ASP  55 146.462   0.699 -12.651
 1142   1HB   ASP  55           HB2      ASP  55 145.196   3.147 -11.401
 1143   2HB   ASP  55           HB1      ASP  55 146.051   3.226 -12.941
 1144    H    GLU  56           HN       GLU  56 148.671   0.496 -12.514
 1145    HA   GLU  56           HA       GLU  56 150.294   1.654 -10.480
 1146   1HB   GLU  56           HB2      GLU  56 150.934  -0.341 -11.768
 1147   2HB   GLU  56           HB1      GLU  56 151.105   0.649 -13.217
 1148   1HG   GLU  56           HG2      GLU  56 152.891   1.949 -12.157
 1149   2HG   GLU  56           HG1      GLU  56 152.680   1.051 -10.653
 1150    H    ASP  57           HN       ASP  57 149.663   2.805 -13.808
 1151    HA   ASP  57           HA       ASP  57 151.618   4.927 -13.662
 1152   1HB   ASP  57           HB2      ASP  57 149.167   4.545 -15.403
 1153   2HB   ASP  57           HB1      ASP  57 150.288   5.895 -15.593
 1154    H    LEU  58           HN       LEU  58 148.185   4.731 -12.933
 1155    HA   LEU  58           HA       LEU  58 147.928   7.565 -12.353
 1156   1HB   LEU  58           HB2      LEU  58 146.234   5.236 -11.393
 1157   2HB   LEU  58           HB1      LEU  58 145.797   6.935 -11.249
 1158    HG   LEU  58           HG       LEU  58 146.264   5.443 -13.852
 1159   1HD1  LEU  58          HD11      LEU  58 144.156   4.907 -12.556
 1160   2HD1  LEU  58          HD13      LEU  58 143.698   6.601 -12.725
 1161   3HD1  LEU  58          HD12      LEU  58 143.876   5.589 -14.158
 1162   1HD2  LEU  58          HD21      LEU  58 145.765   8.341 -13.180
 1163   2HD2  LEU  58          HD23      LEU  58 146.833   7.646 -14.400
 1164   3HD2  LEU  58          HD22      LEU  58 145.094   7.685 -14.674
 1165    H    PHE  59           HN       PHE  59 148.633   4.691 -10.392
 1166    HA   PHE  59           HA       PHE  59 148.637   6.067  -7.863
 1167   1HB   PHE  59           HB2      PHE  59 148.534   3.629  -7.948
 1168   2HB   PHE  59           HB1      PHE  59 150.109   3.566  -8.740
 1169    HD1  PHE  59           HD1      PHE  59 148.376   4.592  -5.603
 1170    HD2  PHE  59           HD2      PHE  59 152.127   3.668  -7.480
 1171    HE1  PHE  59           HE1      PHE  59 149.489   4.620  -3.388
 1172    HE2  PHE  59           HE2      PHE  59 153.241   3.696  -5.265
 1173    HZ   PHE  59           HZ       PHE  59 151.922   4.173  -3.218
 1174    H    ARG  60           HN       ARG  60 151.278   5.231 -10.117
 1175    HA   ARG  60           HA       ARG  60 153.384   6.390  -8.605
 1176   1HB   ARG  60           HB2      ARG  60 153.034   6.049 -11.593
 1177   2HB   ARG  60           HB1      ARG  60 154.533   6.603 -10.853
 1178   1HG   ARG  60           HG2      ARG  60 154.715   4.529  -9.583
 1179   2HG   ARG  60           HG1      ARG  60 153.172   3.972 -10.207
 1180   1HD   ARG  60           HD2      ARG  60 155.009   2.962 -11.487
 1181   2HD   ARG  60           HD1      ARG  60 154.092   4.062 -12.513
 1182    HE   ARG  60           HE       ARG  60 156.139   5.625 -11.432
 1183   1HH1  ARG  60          HH21      ARG  60 155.835   2.724 -13.274
 1184   2HH1  ARG  60          HH22      ARG  60 157.365   2.913 -14.064
 1185   1HH2  ARG  60          HH11      ARG  60 158.134   5.882 -12.446
 1186   2HH2  ARG  60          HH12      ARG  60 158.669   4.700 -13.593
 1187    H    GLU  61           HN       GLU  61 151.378   7.846 -11.193
 1188    HA   GLU  61           HA       GLU  61 152.656  10.402 -11.116
 1189   1HB   GLU  61           HB2      GLU  61 151.206   9.647 -12.973
 1190   2HB   GLU  61           HB1      GLU  61 149.815   9.673 -11.890
 1191   1HG   GLU  61           HG2      GLU  61 150.092  12.088 -11.555
 1192   2HG   GLU  61           HG1      GLU  61 151.522  12.080 -12.588
 1193    H    TRP  62           HN       TRP  62 149.932   9.021  -9.309
 1194    HA   TRP  62           HA       TRP  62 149.088  11.445  -8.066
 1195   1HB   TRP  62           HB2      TRP  62 147.627   9.540  -7.979
 1196   2HB   TRP  62           HB1      TRP  62 148.864   8.555  -7.196
 1197    HD1  TRP  62           HD1      TRP  62 146.512  11.512  -6.499
 1198    HE1  TRP  62           HE1      TRP  62 146.266  11.784  -3.945
 1199    HE3  TRP  62           HE3      TRP  62 149.926   8.058  -4.911
 1200    HZ2  TRP  62           HZ2      TRP  62 147.379  10.677  -1.540
 1201    HZ3  TRP  62           HZ3      TRP  62 150.300   7.683  -2.493
 1202    HH2  TRP  62           HH2      TRP  62 149.038   8.988  -0.809
 1203    H    LEU  63           HN       LEU  63 151.359   8.941  -6.895
 1204    HA   LEU  63           HA       LEU  63 151.866  10.290  -4.409
 1205   1HB   LEU  63           HB2      LEU  63 152.275   7.885  -4.716
 1206   2HB   LEU  63           HB1      LEU  63 153.529   8.240  -5.899
 1207    HG   LEU  63           HG       LEU  63 154.793   9.470  -4.122
 1208   1HD1  LEU  63          HD13      LEU  63 152.445   8.557  -2.474
 1209   2HD1  LEU  63          HD12      LEU  63 154.017   8.808  -1.721
 1210   3HD1  LEU  63          HD11      LEU  63 153.205  10.146  -2.526
 1211   1HD2  LEU  63          HD23      LEU  63 154.065   6.590  -3.527
 1212   2HD2  LEU  63          HD22      LEU  63 155.333   7.140  -4.623
 1213   3HD2  LEU  63          HD21      LEU  63 155.483   7.422  -2.888
 1214    H    LYS  64           HN       LYS  64 153.693  10.176  -7.463
 1215    HA   LYS  64           HA       LYS  64 155.854  11.808  -6.559
 1216   1HB   LYS  64           HB2      LYS  64 155.906  10.473  -8.666
 1217   2HB   LYS  64           HB1      LYS  64 154.784  11.630  -9.386
 1218   1HG   LYS  64           HG2      LYS  64 156.375  13.443  -9.082
 1219   2HG   LYS  64           HG1      LYS  64 157.478  12.376  -8.213
 1220   1HD   LYS  64           HD2      LYS  64 157.741  10.990 -10.229
 1221   2HD   LYS  64           HD1      LYS  64 156.631  12.046 -11.105
 1222   1HE   LYS  64           HE2      LYS  64 159.252  12.921  -9.853
 1223   2HE   LYS  64           HE1      LYS  64 158.996  12.628 -11.574
 1224   1HZ   LYS  64           HZ2      LYS  64 157.195  14.320 -11.468
 1225   2HZ   LYS  64           HZ1      LYS  64 157.693  14.690  -9.887
 1226   3HZ   LYS  64           HZ3      LYS  64 158.751  14.943 -11.188
 1227    H    ASP  65           HN       ASP  65 152.878  12.716  -8.294
 1228    HA   ASP  65           HA       ASP  65 153.480  15.539  -8.261
 1229   1HB   ASP  65           HB2      ASP  65 150.921  13.981  -8.675
 1230   2HB   ASP  65           HB1      ASP  65 150.978  15.743  -8.740
 1231    H    THR  66           HN       THR  66 151.998  13.346  -5.970
 1232    HA   THR  66           HA       THR  66 150.795  15.473  -4.388
 1233    HB   THR  66           HB       THR  66 151.260  12.541  -3.792
 1234    HG1  THR  66           HG1      THR  66 148.960  12.547  -4.155
 1235   1HG2  THR  66          HG23      THR  66 149.847  14.727  -2.260
 1236   2HG2  THR  66          HG22      THR  66 149.464  13.021  -2.029
 1237   3HG2  THR  66          HG21      THR  66 151.087  13.617  -1.678
 1238    H    CYS  67           HN       CYS  67 153.877  13.656  -4.233
 1239    HA   CYS  67           HA       CYS  67 154.661  15.485  -1.976
 1240   1HB   CYS  67           HB2      CYS  67 155.982  13.560  -1.061
 1241   2HB   CYS  67           HB1      CYS  67 154.235  13.330  -0.988
 1242    HG   CYS  67           HG       CYS  67 155.905  12.067  -3.312
 1243    H    GLY  68           HN       GLY  68 155.675  13.749  -4.876
 1244   1HA   GLY  68           HA2      GLY  68 157.416  14.709  -6.296
 1245   2HA   GLY  68           HA1      GLY  68 158.199  15.359  -4.856
 1246    H    ALA  69           HN       ALA  69 156.972  12.181  -4.453
 1247    HA   ALA  69           HA       ALA  69 159.430  11.002  -3.788
 1248   1HB   ALA  69           HB2      ALA  69 157.064  10.047  -3.473
 1249   2HB   ALA  69           HB1      ALA  69 157.191   9.477  -5.138
 1250   3HB   ALA  69           HB3      ALA  69 158.322   8.892  -3.917
 1251    H    ASN  70           HN       ASN  70 160.862   9.578  -5.022
 1252    HA   ASN  70           HA       ASN  70 161.112  10.456  -7.831
 1253   1HB   ASN  70           HB2      ASN  70 162.883   8.662  -6.140
 1254   2HB   ASN  70           HB1      ASN  70 163.284   9.301  -7.735
 1255   1HD2  ASN  70          HD22      ASN  70 164.321  11.518  -4.672
 1256   2HD2  ASN  70          HD21      ASN  70 164.181   9.826  -4.697
 1257    H    ALA  71           HN       ALA  71 161.807   8.656  -9.407
 1258    HA   ALA  71           HA       ALA  71 159.648   6.838  -9.757
 1259   1HB   ALA  71           HB3      ALA  71 161.230   7.711 -11.541
 1260   2HB   ALA  71           HB2      ALA  71 162.406   6.533 -10.959
 1261   3HB   ALA  71           HB1      ALA  71 160.871   5.987 -11.633
 1262    H    LYS  72           HN       LYS  72 162.822   6.393  -8.215
 1263    HA   LYS  72           HA       LYS  72 162.587   3.510  -8.073
 1264   1HB   LYS  72           HB2      LYS  72 164.274   5.499  -6.526
 1265   2HB   LYS  72           HB1      LYS  72 164.403   3.749  -6.328
 1266   1HG   LYS  72           HG2      LYS  72 164.906   3.508  -8.731
 1267   2HG   LYS  72           HG1      LYS  72 164.780   5.256  -8.932
 1268   1HD   LYS  72           HD2      LYS  72 166.637   5.580  -7.346
 1269   2HD   LYS  72           HD1      LYS  72 166.770   3.833  -7.140
 1270   1HE   LYS  72           HE2      LYS  72 167.398   3.532  -9.445
 1271   2HE   LYS  72           HE1      LYS  72 167.023   5.213  -9.825
 1272   1HZ   LYS  72           HZ3      LYS  72 168.866   5.013  -7.666
 1273   2HZ   LYS  72           HZ2      LYS  72 169.453   4.211  -9.046
 1274   3HZ   LYS  72           HZ1      LYS  72 169.016   5.851  -9.132
 1275    H    GLN  73           HN       GLN  73 161.805   6.171  -5.875
 1276    HA   GLN  73           HA       GLN  73 161.079   4.554  -3.630
 1277   1HB   GLN  73           HB2      GLN  73 160.249   7.344  -4.479
 1278   2HB   GLN  73           HB1      GLN  73 159.786   6.623  -2.937
 1279   1HG   GLN  73           HG2      GLN  73 162.147   6.335  -2.335
 1280   2HG   GLN  73           HG1      GLN  73 162.639   6.999  -3.894
 1281   1HE2  GLN  73          HE22      GLN  73 162.349   9.629  -1.061
 1282   2HE2  GLN  73          HE21      GLN  73 162.909   8.030  -0.963
 1283    H    SER  74           HN       SER  74 159.229   5.820  -6.372
 1284    HA   SER  74           HA       SER  74 156.663   5.023  -5.457
 1285   1HB   SER  74           HB2      SER  74 157.704   5.303  -8.289
 1286   2HB   SER  74           HB1      SER  74 156.009   5.225  -7.821
 1287    HG   SER  74           HG       SER  74 157.429   7.364  -7.994
 1288    H    ARG  75           HN       ARG  75 159.131   3.245  -7.356
 1289    HA   ARG  75           HA       ARG  75 157.490   1.012  -7.990
 1290   1HB   ARG  75           HB2      ARG  75 160.485   1.220  -7.586
 1291   2HB   ARG  75           HB1      ARG  75 159.684  -0.245  -8.155
 1292   1HG   ARG  75           HG2      ARG  75 158.718   1.019 -10.047
 1293   2HG   ARG  75           HG1      ARG  75 159.543   2.474  -9.491
 1294   1HD   ARG  75           HD2      ARG  75 161.725   1.262  -9.734
 1295   2HD   ARG  75           HD1      ARG  75 160.847  -0.101 -10.423
 1296    HE   ARG  75           HE       ARG  75 160.067   2.133 -11.927
 1297   1HH1  ARG  75          HH21      ARG  75 162.962   0.440 -11.117
 1298   2HH1  ARG  75          HH22      ARG  75 163.804   0.931 -12.550
 1299   1HH2  ARG  75          HH11      ARG  75 161.150   2.786 -13.791
 1300   2HH2  ARG  75          HH12      ARG  75 162.778   2.263 -14.063
 1301    H    ASP  76           HN       ASP  76 159.440   1.683  -5.067
 1302    HA   ASP  76           HA       ASP  76 159.056  -0.912  -3.924
 1303   1HB   ASP  76           HB2      ASP  76 159.672   1.776  -2.682
 1304   2HB   ASP  76           HB1      ASP  76 159.632   0.273  -1.759
 1305    H    CYS  77           HN       CYS  77 157.133   2.096  -3.639
 1306    HA   CYS  77           HA       CYS  77 155.379   1.032  -1.621
 1307   1HB   CYS  77           HB2      CYS  77 155.070   3.276  -3.630
 1308   2HB   CYS  77           HB1      CYS  77 153.859   2.904  -2.404
 1309    HG   CYS  77           HG       CYS  77 155.334   4.563  -1.173
 1310    H    PHE  78           HN       PHE  78 155.217   1.089  -5.203
 1311    HA   PHE  78           HA       PHE  78 152.553   0.134  -5.413
 1312   1HB   PHE  78           HB2      PHE  78 153.797   0.980  -7.341
 1313   2HB   PHE  78           HB1      PHE  78 154.917  -0.378  -7.236
 1314    HD1  PHE  78           HD1      PHE  78 151.442   0.621  -8.025
 1315    HD2  PHE  78           HD2      PHE  78 154.296  -2.590  -7.974
 1316    HE1  PHE  78           HE1      PHE  78 149.920  -0.754  -9.421
 1317    HE2  PHE  78           HE2      PHE  78 152.773  -3.965  -9.368
 1318    HZ   PHE  78           HZ       PHE  78 150.587  -3.048 -10.091
 1319    H    GLY  79           HN       GLY  79 155.530  -1.837  -5.724
 1320   1HA   GLY  79           HA2      GLY  79 154.197  -4.340  -5.629
 1321   2HA   GLY  79           HA1      GLY  79 155.897  -4.100  -5.235
 1322    H    CYS  80           HN       CYS  80 155.280  -2.219  -3.041
 1323    HA   CYS  80           HA       CYS  80 154.990  -4.193  -0.931
 1324   1HB   CYS  80           HB2      CYS  80 156.363  -2.187  -0.622
 1325   2HB   CYS  80           HB1      CYS  80 154.938  -1.165  -0.806
 1326    HG   CYS  80           HG       CYS  80 154.342  -1.607   1.556
 1327    H    LEU  81           HN       LEU  81 152.846  -1.547  -2.110
 1328    HA   LEU  81           HA       LEU  81 150.726  -2.267  -0.279
 1329   1HB   LEU  81           HB2      LEU  81 150.643  -0.737  -2.899
 1330   2HB   LEU  81           HB1      LEU  81 149.331  -0.805  -1.725
 1331    HG   LEU  81           HG       LEU  81 152.116   0.209  -1.080
 1332   1HD1  LEU  81          HD11      LEU  81 149.603   1.730  -1.830
 1333   2HD1  LEU  81          HD13      LEU  81 151.061   2.471  -1.173
 1334   3HD1  LEU  81          HD12      LEU  81 151.109   1.675  -2.746
 1335   1HD2  LEU  81          HD21      LEU  81 149.493   0.074   0.411
 1336   2HD2  LEU  81          HD23      LEU  81 151.109  -0.365   0.966
 1337   3HD2  LEU  81          HD22      LEU  81 150.666   1.330   0.800
 1338    H    ARG  82           HN       ARG  82 151.493  -3.082  -3.648
 1339    HA   ARG  82           HA       ARG  82 149.089  -4.495  -4.224
 1340   1HB   ARG  82           HB2      ARG  82 150.774  -3.781  -5.924
 1341   2HB   ARG  82           HB1      ARG  82 151.854  -5.044  -5.335
 1342   1HG   ARG  82           HG2      ARG  82 150.175  -6.755  -5.888
 1343   2HG   ARG  82           HG1      ARG  82 149.073  -5.501  -6.458
 1344   1HD   ARG  82           HD2      ARG  82 150.794  -4.824  -8.146
 1345   2HD   ARG  82           HD1      ARG  82 151.787  -6.188  -7.628
 1346    HE   ARG  82           HE       ARG  82 149.326  -7.327  -8.239
 1347   1HH1  ARG  82          HH21      ARG  82 151.653  -5.328  -9.819
 1348   2HH1  ARG  82          HH22      ARG  82 151.257  -5.898 -11.406
 1349   1HH2  ARG  82          HH11      ARG  82 148.798  -8.076 -10.301
 1350   2HH2  ARG  82          HH12      ARG  82 149.641  -7.453 -11.680
 1351    H    GLU  83           HN       GLU  83 152.140  -5.603  -2.775
 1352    HA   GLU  83           HA       GLU  83 151.369  -8.381  -2.712
 1353   1HB   GLU  83           HB2      GLU  83 153.492  -6.809  -1.242
 1354   2HB   GLU  83           HB1      GLU  83 153.245  -8.538  -0.983
 1355   1HG   GLU  83           HG2      GLU  83 153.658  -9.006  -3.329
 1356   2HG   GLU  83           HG1      GLU  83 153.737  -7.286  -3.701
 1357    H    TRP  84           HN       TRP  84 151.029  -5.739  -0.320
 1358    HA   TRP  84           HA       TRP  84 150.178  -7.388   1.849
 1359   1HB   TRP  84           HB2      TRP  84 150.793  -4.948   2.019
 1360   2HB   TRP  84           HB1      TRP  84 149.261  -4.561   1.235
 1361    HD1  TRP  84           HD1      TRP  84 150.730  -5.860   4.491
 1362    HE1  TRP  84           HE1      TRP  84 148.897  -5.870   6.303
 1363    HE3  TRP  84           HE3      TRP  84 146.648  -4.732   1.630
 1364    HZ2  TRP  84           HZ2      TRP  84 146.077  -5.462   6.513
 1365    HZ3  TRP  84           HZ3      TRP  84 144.403  -4.558   2.666
 1366    HH2  TRP  84           HH2      TRP  84 144.112  -4.913   5.100
 1367    H    CYS  85           HN       CYS  85 148.362  -5.744  -0.728
 1368    HA   CYS  85           HA       CYS  85 145.762  -6.508   0.145
 1369   1HB   CYS  85           HB2      CYS  85 146.856  -5.876  -2.602
 1370   2HB   CYS  85           HB1      CYS  85 145.147  -6.197  -2.310
 1371    HG   CYS  85           HG       CYS  85 146.635  -3.638  -1.534
 1372    H    ASP  86           HN       ASP  86 148.074  -8.174  -1.977
 1373    HA   ASP  86           HA       ASP  86 146.372 -10.289  -2.803
 1374   1HB   ASP  86           HB2      ASP  86 149.362 -10.159  -2.351
 1375   2HB   ASP  86           HB1      ASP  86 148.564 -11.595  -2.996
 1376    H    ALA  87           HN       ALA  87 148.059  -9.720   0.225
 1377    HA   ALA  87           HA       ALA  87 147.398 -12.453   1.190
 1378   1HB   ALA  87           HB2      ALA  87 149.643 -11.402   1.633
 1379   2HB   ALA  87           HB1      ALA  87 148.823 -10.231   2.667
 1380   3HB   ALA  87           HB3      ALA  87 148.794 -11.944   3.081
 1381    H    PHE  88           HN       PHE  88 146.505  -9.073   1.813
 1382    HA   PHE  88           HA       PHE  88 144.601  -9.999   3.936
 1383   1HB   PHE  88           HB2      PHE  88 145.828  -7.315   3.333
 1384   2HB   PHE  88           HB1      PHE  88 144.570  -7.554   4.544
 1385    HD1  PHE  88           HD2      PHE  88 144.996  -9.218   6.426
 1386    HD2  PHE  88           HD1      PHE  88 148.101  -7.792   3.820
 1387    HE1  PHE  88           HE2      PHE  88 146.706  -9.911   8.081
 1388    HE2  PHE  88           HE1      PHE  88 149.813  -8.485   5.480
 1389    HZ   PHE  88           HZ       PHE  88 149.109  -9.536   7.612
 1390    H    LEU  89           HN       LEU  89 144.482  -8.847   0.665
 1391    HA   LEU  89           HA       LEU  89 141.768  -7.683   1.086
 1392   1HB   LEU  89           HB2      LEU  89 143.494  -6.536  -0.383
 1393   2HB   LEU  89           HB1      LEU  89 143.326  -7.885  -1.499
 1394    HG   LEU  89           HG       LEU  89 140.803  -7.396  -1.475
 1395   1HD1  LEU  89          HD11      LEU  89 141.870  -4.950  -0.046
 1396   2HD1  LEU  89          HD13      LEU  89 140.418  -4.849  -1.038
 1397   3HD1  LEU  89          HD12      LEU  89 140.460  -5.929   0.349
 1398   1HD2  LEU  89          HD23      LEU  89 142.753  -5.379  -2.631
 1399   2HD2  LEU  89          HD22      LEU  89 142.230  -6.882  -3.391
 1400   3HD2  LEU  89          HD21      LEU  89 141.078  -5.569  -3.150
   
  No H/Q in entry =        1400
  Start of MODEL   13
    1   1H    MET   1           HT2      MET   1 117.888 -12.443  11.122
    2   2H    MET   1           HT1      MET   1 116.968 -12.296  12.543
    3   3H    MET   1           HT3      MET   1 117.142 -13.811  11.799
    4    HA   MET   1           HA       MET   1 115.800 -13.216   9.984
    5   1HB   MET   1           HB2      MET   1 114.653 -13.668  12.198
    6   2HB   MET   1           HB1      MET   1 114.527 -11.922  12.410
    7   1HG   MET   1           HG2      MET   1 113.255 -11.737  10.322
    8   2HG   MET   1           HG1      MET   1 113.411 -13.472  10.051
    9   1HE   MET   1           HE2      MET   1 112.569 -15.224  11.313
   10   2HE   MET   1           HE1      MET   1 112.811 -14.842  13.015
   11   3HE   MET   1           HE3      MET   1 111.191 -15.212  12.409
   12    H    THR   2           HN       THR   2 117.067 -10.515  11.764
   13    HA   THR   2           HA       THR   2 115.685  -8.434  10.315
   14    HB   THR   2           HB       THR   2 118.396  -8.258  11.660
   15    HG1  THR   2           HG1      THR   2 116.100  -8.932  12.714
   16   1HG2  THR   2          HG23      THR   2 117.636  -6.346  10.214
   17   2HG2  THR   2          HG22      THR   2 116.233  -6.174  11.268
   18   3HG2  THR   2          HG21      THR   2 117.855  -5.914  11.909
   19    H    THR   3           HN       THR   3 119.209  -8.944  10.204
   20    HA   THR   3           HA       THR   3 119.318  -7.980   7.466
   21    HB   THR   3           HB       THR   3 121.729  -8.508   7.635
   22    HG1  THR   3           HG1      THR   3 120.786  -9.882   9.888
   23   1HG2  THR   3          HG22      THR   3 120.833  -6.416   8.624
   24   2HG2  THR   3          HG21      THR   3 120.617  -7.253  10.160
   25   3HG2  THR   3          HG23      THR   3 122.237  -7.013   9.508
   26    H    SER   4           HN       SER   4 119.993  -9.236   5.616
   27    HA   SER   4           HA       SER   4 118.825 -11.911   5.583
   28   1HB   SER   4           HB2      SER   4 120.407 -10.472   3.431
   29   2HB   SER   4           HB1      SER   4 119.401 -11.899   3.204
   30    HG   SER   4           HG       SER   4 117.638 -10.582   4.008
   31    H    GLN   5           HN       GLN   5 120.109 -13.750   4.630
   32    HA   GLN   5           HA       GLN   5 122.322 -14.403   6.269
   33   1HB   GLN   5           HB2      GLN   5 121.415 -15.532   3.610
   34   2HB   GLN   5           HB1      GLN   5 122.709 -16.246   4.574
   35   1HG   GLN   5           HG2      GLN   5 121.189 -16.601   6.441
   36   2HG   GLN   5           HG1      GLN   5 119.893 -15.761   5.587
   37   1HE2  GLN   5          HE22      GLN   5 119.639 -19.518   5.073
   38   2HE2  GLN   5          HE21      GLN   5 119.804 -18.573   6.473
   39    H    LYS   6           HN       LYS   6 122.220 -12.499   3.363
   40    HA   LYS   6           HA       LYS   6 124.849 -12.959   2.387
   41   1HB   LYS   6           HB2      LYS   6 123.063 -10.515   2.283
   42   2HB   LYS   6           HB1      LYS   6 124.579 -10.659   1.393
   43   1HG   LYS   6           HG2      LYS   6 123.727 -12.678   0.257
   44   2HG   LYS   6           HG1      LYS   6 122.208 -12.533   1.143
   45   1HD   LYS   6           HD2      LYS   6 121.818 -10.322   0.124
   46   2HD   LYS   6           HD1      LYS   6 123.333 -10.464  -0.768
   47   1HE   LYS   6           HE2      LYS   6 122.508 -12.383  -1.989
   48   2HE   LYS   6           HE1      LYS   6 121.053 -12.446  -0.995
   49   1HZ   LYS   6           HZ3      LYS   6 121.692  -9.980  -2.456
   50   2HZ   LYS   6           HZ2      LYS   6 121.009 -11.286  -3.301
   51   3HZ   LYS   6           HZ1      LYS   6 120.180 -10.594  -1.989
   52    H    HIS   7           HN       HIS   7 123.601 -10.743   4.874
   53    HA   HIS   7           HA       HIS   7 125.963  -9.234   5.265
   54   1HB   HIS   7           HB2      HIS   7 123.956  -8.485   6.327
   55   2HB   HIS   7           HB1      HIS   7 123.728 -10.027   7.146
   56    HD2  HIS   7           HD2      HIS   7 125.096 -10.282   9.582
   57    HE1  HIS   7           HE1      HIS   7 127.099  -6.568   9.451
   58    HE2  HIS   7           HE2      HIS   7 126.587  -8.593  10.891
   59    H    ARG   8           HN       ARG   8 124.939 -12.212   6.989
   60    HA   ARG   8           HA       ARG   8 127.370 -12.390   8.503
   61   1HB   ARG   8           HB2      ARG   8 125.240 -14.440   7.831
   62   2HB   ARG   8           HB1      ARG   8 126.574 -14.738   8.952
   63   1HG   ARG   8           HG2      ARG   8 125.843 -12.820  10.329
   64   2HG   ARG   8           HG1      ARG   8 124.508 -12.533   9.214
   65   1HD   ARG   8           HD2      ARG   8 123.680 -14.849   9.689
   66   2HD   ARG   8           HD1      ARG   8 124.945 -15.007  10.908
   67    HE   ARG   8           HE       ARG   8 123.622 -12.673  11.615
   68   1HH1  ARG   8          HH21      ARG   8 122.751 -15.944  10.953
   69   2HH1  ARG   8          HH22      ARG   8 121.407 -15.946  12.046
   70   1HH2  ARG   8          HH11      ARG   8 121.872 -12.657  13.041
   71   2HH2  ARG   8          HH12      ARG   8 120.907 -14.084  13.227
   72    H    ASP   9           HN       ASP   9 126.345 -13.615   5.377
   73    HA   ASP   9           HA       ASP   9 128.553 -15.457   5.064
   74   1HB   ASP   9           HB2      ASP   9 126.689 -14.173   3.064
   75   2HB   ASP   9           HB1      ASP   9 127.925 -15.345   2.616
   76    H    PHE  10           HN       PHE  10 128.025 -12.055   4.139
   77    HA   PHE  10           HA       PHE  10 130.437 -11.836   2.586
   78   1HB   PHE  10           HB2      PHE  10 128.502 -10.250   2.481
   79   2HB   PHE  10           HB1      PHE  10 128.967  -9.642   4.069
   80    HD1  PHE  10           HD1      PHE  10 129.902  -9.844   0.514
   81    HD2  PHE  10           HD2      PHE  10 130.994  -8.312   4.376
   82    HE1  PHE  10           HE1      PHE  10 131.553  -8.333  -0.554
   83    HE2  PHE  10           HE2      PHE  10 132.648  -6.801   3.307
   84    HZ   PHE  10           HZ       PHE  10 132.927  -6.812   0.842
   85    H    VAL  11           HN       VAL  11 129.736 -11.164   6.023
   86    HA   VAL  11           HA       VAL  11 132.492 -10.256   6.491
   87    HB   VAL  11           HB       VAL  11 131.789 -10.059   8.830
   88   1HG1  VAL  11          HG12      VAL  11 129.738  -9.118   6.804
   89   2HG1  VAL  11          HG11      VAL  11 129.805  -8.547   8.472
   90   3HG1  VAL  11          HG13      VAL  11 131.148  -8.228   7.375
   91   1HG2  VAL  11          HG22      VAL  11 129.430 -11.647   7.816
   92   2HG2  VAL  11          HG21      VAL  11 130.463 -11.986   9.204
   93   3HG2  VAL  11          HG23      VAL  11 129.305 -10.658   9.271
   94    H    ALA  12           HN       ALA  12 131.593 -13.156   5.658
   95    HA   ALA  12           HA       ALA  12 133.197 -14.592   7.758
   96   1HB   ALA  12           HB3      ALA  12 130.773 -15.219   7.671
   97   2HB   ALA  12           HB2      ALA  12 131.014 -15.745   6.006
   98   3HB   ALA  12           HB1      ALA  12 131.860 -16.562   7.320
   99    H    GLU  13           HN       GLU  13 133.185 -13.596   4.517
  100    HA   GLU  13           HA       GLU  13 135.425 -15.438   3.959
  101   1HB   GLU  13           HB2      GLU  13 134.498 -16.240   1.853
  102   2HB   GLU  13           HB1      GLU  13 133.374 -16.616   3.158
  103   1HG   GLU  13           HG2      GLU  13 132.236 -14.374   2.574
  104   2HG   GLU  13           HG1      GLU  13 133.166 -14.438   1.078
  105    HA   PRO  14           HA       PRO  14 137.265 -11.879   2.000
  106   1HB   PRO  14           HB2      PRO  14 137.681 -13.627  -0.410
  107   2HB   PRO  14           HB1      PRO  14 138.844 -12.595   0.447
  108   1HG   PRO  14           HG2      PRO  14 138.820 -15.260   0.748
  109   2HG   PRO  14           HG1      PRO  14 139.240 -14.165   2.077
  110   1HD   PRO  14           HD2      PRO  14 136.776 -15.789   1.702
  111   2HD   PRO  14           HD1      PRO  14 137.505 -15.162   3.197
  112    H    MET  15           HN       MET  15 136.783 -10.306   0.289
  113    HA   MET  15           HA       MET  15 134.049 -10.643  -0.798
  114   1HB   MET  15           HB2      MET  15 134.390  -8.234  -1.518
  115   2HB   MET  15           HB1      MET  15 134.442  -8.514   0.221
  116   1HG   MET  15           HG2      MET  15 136.838  -8.405   0.258
  117   2HG   MET  15           HG1      MET  15 136.928  -8.458  -1.504
  118   1HE   MET  15           HE1      MET  15 135.293  -6.728   1.435
  119   2HE   MET  15           HE3      MET  15 136.926  -6.064   1.570
  120   3HE   MET  15           HE2      MET  15 135.567  -5.008   1.188
  121    H    GLY  16           HN       GLY  16 137.370 -10.684  -1.883
  122   1HA   GLY  16           HA2      GLY  16 138.287 -11.018  -4.009
  123   2HA   GLY  16           HA1      GLY  16 136.796 -11.894  -4.359
  124    H    GLU  17           HN       GLU  17 136.295 -11.113  -6.377
  125    HA   GLU  17           HA       GLU  17 136.251  -8.156  -6.803
  126   1HB   GLU  17           HB2      GLU  17 136.220 -10.507  -8.713
  127   2HB   GLU  17           HB1      GLU  17 136.030  -8.828  -9.225
  128   1HG   GLU  17           HG2      GLU  17 138.209  -8.267  -8.211
  129   2HG   GLU  17           HG1      GLU  17 138.403  -9.944  -7.702
  130    H    LYS  18           HN       LYS  18 134.139  -9.579  -5.288
  131    HA   LYS  18           HA       LYS  18 131.831 -10.025  -6.891
  132   1HB   LYS  18           HB2      LYS  18 132.171  -9.169  -4.008
  133   2HB   LYS  18           HB1      LYS  18 130.585  -9.482  -4.714
  134   1HG   LYS  18           HG2      LYS  18 131.216 -11.763  -5.256
  135   2HG   LYS  18           HG1      LYS  18 132.875 -11.467  -4.738
  136   1HD   LYS  18           HD2      LYS  18 132.170 -11.151  -2.444
  137   2HD   LYS  18           HD1      LYS  18 130.470 -11.230  -2.912
  138   1HE   LYS  18           HE2      LYS  18 132.467 -13.485  -3.259
  139   2HE   LYS  18           HE1      LYS  18 131.277 -13.384  -1.962
  140   1HZ   LYS  18           HZ3      LYS  18 129.684 -13.045  -4.018
  141   2HZ   LYS  18           HZ2      LYS  18 130.895 -13.940  -4.803
  142   3HZ   LYS  18           HZ1      LYS  18 130.096 -14.590  -3.453
  143    HA   PRO  19           HA       PRO  19 130.786  -5.909  -8.167
  144   1HB   PRO  19           HB2      PRO  19 128.026  -6.063  -8.301
  145   2HB   PRO  19           HB1      PRO  19 129.116  -6.771  -9.508
  146   1HG   PRO  19           HG2      PRO  19 127.690  -8.090  -7.244
  147   2HG   PRO  19           HG1      PRO  19 127.986  -8.680  -8.891
  148   1HD   PRO  19           HD2      PRO  19 129.459  -9.513  -6.743
  149   2HD   PRO  19           HD1      PRO  19 130.129  -9.421  -8.384
  150    H    VAL  20           HN       VAL  20 129.817  -3.900  -7.452
  151    HA   VAL  20           HA       VAL  20 129.946  -3.417  -4.680
  152    HB   VAL  20           HB       VAL  20 130.137  -1.593  -6.270
  153   1HG1  VAL  20          HG13      VAL  20 128.437  -2.632  -7.881
  154   2HG1  VAL  20          HG12      VAL  20 127.188  -1.907  -6.869
  155   3HG1  VAL  20          HG11      VAL  20 128.359  -0.881  -7.695
  156   1HG2  VAL  20          HG23      VAL  20 129.111  -1.226  -3.947
  157   2HG2  VAL  20          HG22      VAL  20 128.808   0.037  -5.140
  158   3HG2  VAL  20          HG21      VAL  20 127.551  -1.143  -4.764
  159    H    GLY  21           HN       GLY  21 127.067  -3.945  -6.709
  160   1HA   GLY  21           HA2      GLY  21 125.103  -3.563  -4.720
  161   2HA   GLY  21           HA1      GLY  21 124.894  -4.597  -6.132
  162    H    SER  22           HN       SER  22 127.551  -5.852  -4.670
  163    HA   SER  22           HA       SER  22 125.986  -8.031  -3.486
  164   1HB   SER  22           HB2      SER  22 128.074  -8.474  -4.770
  165   2HB   SER  22           HB1      SER  22 128.989  -7.587  -3.554
  166    HG   SER  22           HG       SER  22 127.410  -9.916  -3.144
  167    H    LEU  23           HN       LEU  23 127.631  -5.161  -2.438
  168    HA   LEU  23           HA       LEU  23 128.113  -5.906   0.284
  169   1HB   LEU  23           HB2      LEU  23 127.543  -3.185  -0.930
  170   2HB   LEU  23           HB1      LEU  23 128.150  -3.444   0.704
  171    HG   LEU  23           HG       LEU  23 129.554  -4.448  -1.791
  172   1HD1  LEU  23          HD12      LEU  23 129.428  -1.965  -1.733
  173   2HD1  LEU  23          HD11      LEU  23 130.161  -1.983  -0.130
  174   3HD1  LEU  23          HD13      LEU  23 131.078  -2.551  -1.525
  175   1HD2  LEU  23          HD22      LEU  23 130.199  -4.417   1.159
  176   2HD2  LEU  23          HD21      LEU  23 130.387  -5.726  -0.004
  177   3HD2  LEU  23          HD23      LEU  23 131.508  -4.369  -0.019
  178    H    ALA  24           HN       ALA  24 126.813  -5.847   2.054
  179    HA   ALA  24           HA       ALA  24 123.975  -6.105   1.676
  180   1HB   ALA  24           HB1      ALA  24 125.596  -5.636   4.191
  181   2HB   ALA  24           HB3      ALA  24 123.881  -6.044   4.177
  182   3HB   ALA  24           HB2      ALA  24 125.066  -7.192   3.553
  183    H    GLY  25           HN       GLY  25 122.346  -4.641   1.843
  184   1HA   GLY  25           HA2      GLY  25 121.327  -2.582   2.643
  185   2HA   GLY  25           HA1      GLY  25 122.935  -1.888   2.841
  186    H    ILE  26           HN       ILE  26 123.558  -3.136   0.062
  187    HA   ILE  26           HA       ILE  26 122.496  -0.817  -1.500
  188    HB   ILE  26           HB       ILE  26 124.665  -2.797  -2.257
  189   1HG1  ILE  26          HG12      ILE  26 125.381  -1.653  -0.241
  190   2HG1  ILE  26          HG11      ILE  26 126.232  -0.939  -1.609
  191   1HG2  ILE  26          HG22      ILE  26 123.871  -0.073  -3.321
  192   2HG2  ILE  26          HG21      ILE  26 125.307  -0.962  -3.825
  193   3HG2  ILE  26          HG23      ILE  26 123.704  -1.616  -4.156
  194   1HD1  ILE  26          HD13      ILE  26 124.264   0.779  -1.634
  195   2HD1  ILE  26          HD12      ILE  26 123.960   0.207   0.004
  196   3HD1  ILE  26          HD11      ILE  26 125.510   0.942  -0.400
  197    H    GLY  27           HN       GLY  27 120.724  -1.252  -2.788
  198   1HA   GLY  27           HA2      GLY  27 120.121  -4.071  -3.460
  199   2HA   GLY  27           HA1      GLY  27 119.033  -2.699  -3.657
  200    H    GLU  28           HN       GLU  28 119.116  -4.277  -5.770
  201    HA   GLU  28           HA       GLU  28 121.174  -3.989  -7.672
  202   1HB   GLU  28           HB2      GLU  28 118.182  -4.280  -8.055
  203   2HB   GLU  28           HB1      GLU  28 119.347  -4.402  -9.372
  204   1HG   GLU  28           HG2      GLU  28 120.481  -6.256  -8.201
  205   2HG   GLU  28           HG1      GLU  28 119.313  -6.137  -6.886
  206    H    VAL  29           HN       VAL  29 118.399  -1.831  -7.048
  207    HA   VAL  29           HA       VAL  29 118.940  -0.090  -9.277
  208    HB   VAL  29           HB       VAL  29 117.511   0.441  -6.655
  209   1HG1  VAL  29          HG11      VAL  29 117.782   2.059  -9.194
  210   2HG1  VAL  29          HG13      VAL  29 116.438   2.292  -8.075
  211   3HG1  VAL  29          HG12      VAL  29 118.093   2.570  -7.534
  212   1HG2  VAL  29          HG22      VAL  29 116.523  -0.314  -9.424
  213   2HG2  VAL  29          HG21      VAL  29 116.449  -1.317  -7.975
  214   3HG2  VAL  29          HG23      VAL  29 115.478   0.151  -8.082
  215    H    LEU  30           HN       LEU  30 119.885   0.007  -5.859
  216    HA   LEU  30           HA       LEU  30 121.274   2.513  -6.023
  217   1HB   LEU  30           HB2      LEU  30 121.559   0.179  -4.109
  218   2HB   LEU  30           HB1      LEU  30 122.373   1.726  -3.892
  219    HG   LEU  30           HG       LEU  30 119.366   1.426  -4.166
  220   1HD1  LEU  30          HD11      LEU  30 121.159   1.469  -1.736
  221   2HD1  LEU  30          HD13      LEU  30 119.474   1.983  -1.644
  222   3HD1  LEU  30          HD12      LEU  30 119.867   0.334  -2.131
  223   1HD2  LEU  30          HD23      LEU  30 121.241   3.727  -3.634
  224   2HD2  LEU  30          HD22      LEU  30 119.817   3.666  -4.671
  225   3HD2  LEU  30          HD21      LEU  30 119.628   3.757  -2.924
  226    H    GLY  31           HN       GLY  31 122.297  -0.848  -6.449
  227   1HA   GLY  31           HA2      GLY  31 125.098  -0.375  -6.625
  228   2HA   GLY  31           HA1      GLY  31 124.260  -1.723  -7.389
  229    H    LYS  32           HN       LYS  32 122.549  -0.213  -9.108
  230    HA   LYS  32           HA       LYS  32 124.277   0.155 -11.343
  231   1HB   LYS  32           HB2      LYS  32 121.891  -0.404 -11.557
  232   2HB   LYS  32           HB1      LYS  32 121.453   1.168 -10.900
  233   1HG   LYS  32           HG2      LYS  32 121.255   1.221 -13.329
  234   2HG   LYS  32           HG1      LYS  32 122.585   2.262 -12.841
  235   1HD   LYS  32           HD2      LYS  32 124.222   0.700 -13.562
  236   2HD   LYS  32           HD1      LYS  32 123.048  -0.617 -13.639
  237   1HE   LYS  32           HE2      LYS  32 121.887   0.569 -15.493
  238   2HE   LYS  32           HE1      LYS  32 123.120   1.829 -15.434
  239   1HZ   LYS  32           HZ3      LYS  32 124.216  -0.817 -15.596
  240   2HZ   LYS  32           HZ2      LYS  32 123.237  -0.430 -16.929
  241   3HZ   LYS  32           HZ1      LYS  32 124.561   0.556 -16.529
  242    H    LYS  33           HN       LYS  33 122.842   2.586  -9.127
  243    HA   LYS  33           HA       LYS  33 123.780   4.824 -10.680
  244   1HB   LYS  33           HB2      LYS  33 123.059   4.587  -7.746
  245   2HB   LYS  33           HB1      LYS  33 123.442   6.116  -8.539
  246   1HG   LYS  33           HG2      LYS  33 121.609   5.745 -10.149
  247   2HG   LYS  33           HG1      LYS  33 121.223   4.218  -9.357
  248   1HD   LYS  33           HD2      LYS  33 120.751   5.424  -7.255
  249   2HD   LYS  33           HD1      LYS  33 121.133   6.953  -8.049
  250   1HE   LYS  33           HE2      LYS  33 118.696   6.572  -8.016
  251   2HE   LYS  33           HE1      LYS  33 119.311   6.570  -9.669
  252   1HZ   LYS  33           HZ2      LYS  33 119.415   4.135  -9.553
  253   2HZ   LYS  33           HZ1      LYS  33 118.718   4.185  -8.006
  254   3HZ   LYS  33           HZ3      LYS  33 117.833   4.719  -9.350
  255    H    LEU  34           HN       LEU  34 125.187   3.100  -7.885
  256    HA   LEU  34           HA       LEU  34 127.503   4.777  -7.672
  257   1HB   LEU  34           HB2      LEU  34 127.028   1.880  -6.915
  258   2HB   LEU  34           HB1      LEU  34 128.502   2.749  -6.516
  259    HG   LEU  34           HG       LEU  34 125.747   3.720  -5.720
  260   1HD1  LEU  34          HD11      LEU  34 127.739   1.994  -4.227
  261   2HD1  LEU  34          HD13      LEU  34 126.433   2.869  -3.428
  262   3HD1  LEU  34          HD12      LEU  34 126.060   1.612  -4.608
  263   1HD2  LEU  34          HD22      LEU  34 128.587   4.564  -5.110
  264   2HD2  LEU  34          HD21      LEU  34 127.205   5.558  -5.556
  265   3HD2  LEU  34          HD23      LEU  34 127.308   4.877  -3.940
  266    H    GLU  35           HN       GLU  35 126.800   1.872  -9.542
  267    HA   GLU  35           HA       GLU  35 129.407   1.453 -10.619
  268   1HB   GLU  35           HB2      GLU  35 127.576  -0.190 -10.846
  269   2HB   GLU  35           HB1      GLU  35 126.720   0.915 -11.919
  270   1HG   GLU  35           HG2      GLU  35 128.557   0.809 -13.543
  271   2HG   GLU  35           HG1      GLU  35 129.474  -0.238 -12.459
  272    H    GLU  36           HN       GLU  36 126.749   3.502 -11.766
  273    HA   GLU  36           HA       GLU  36 128.060   4.338 -14.182
  274   1HB   GLU  36           HB2      GLU  36 125.631   4.611 -13.813
  275   2HB   GLU  36           HB1      GLU  36 125.959   5.776 -12.529
  276   1HG   GLU  36           HG2      GLU  36 127.048   7.279 -14.126
  277   2HG   GLU  36           HG1      GLU  36 126.828   6.097 -15.418
  278    H    ARG  37           HN       ARG  37 128.447   5.223 -10.856
  279    HA   ARG  37           HA       ARG  37 129.826   7.755 -11.557
  280   1HB   ARG  37           HB2      ARG  37 129.211   6.443  -8.902
  281   2HB   ARG  37           HB1      ARG  37 130.149   7.929  -9.054
  282   1HG   ARG  37           HG2      ARG  37 128.207   8.903 -10.369
  283   2HG   ARG  37           HG1      ARG  37 127.280   7.474  -9.913
  284   1HD   ARG  37           HD2      ARG  37 126.778   9.225  -8.325
  285   2HD   ARG  37           HD1      ARG  37 127.777   8.022  -7.503
  286    HE   ARG  37           HE       ARG  37 129.644   9.806  -8.428
  287   1HH1  ARG  37          HH21      ARG  37 126.662  10.099  -6.725
  288   2HH1  ARG  37          HH22      ARG  37 127.176  11.464  -5.791
  289   1HH2  ARG  37          HH11      ARG  37 130.333  11.588  -7.218
  290   2HH2  ARG  37          HH12      ARG  37 129.253  12.305  -6.069
  291    H    GLY  38           HN       GLY  38 130.806   4.630 -11.736
  292   1HA   GLY  38           HA2      GLY  38 133.128   4.180 -12.304
  293   2HA   GLY  38           HA1      GLY  38 133.636   5.449 -11.202
  294    H    PHE  39           HN       PHE  39 131.245   3.577  -9.686
  295    HA   PHE  39           HA       PHE  39 133.364   2.029  -8.233
  296   1HB   PHE  39           HB2      PHE  39 130.522   2.742  -7.480
  297   2HB   PHE  39           HB1      PHE  39 131.603   1.772  -6.486
  298    HD1  PHE  39           HD2      PHE  39 133.599   2.788  -5.450
  299    HD2  PHE  39           HD1      PHE  39 130.788   5.127  -7.693
  300    HE1  PHE  39           HE2      PHE  39 134.574   4.860  -4.501
  301    HE2  PHE  39           HE1      PHE  39 131.760   7.204  -6.748
  302    HZ   PHE  39           HZ       PHE  39 133.660   7.072  -5.146
  303    H    ASP  40           HN       ASP  40 133.249   0.643 -10.278
  304    HA   ASP  40           HA       ASP  40 130.822  -0.913 -10.680
  305   1HB   ASP  40           HB2      ASP  40 132.130  -2.100 -12.380
  306   2HB   ASP  40           HB1      ASP  40 132.341  -0.358 -12.547
  307    H    LYS  41           HN       LYS  41 133.379  -1.172  -8.438
  308    HA   LYS  41           HA       LYS  41 132.535  -3.983  -7.863
  309   1HB   LYS  41           HB2      LYS  41 135.401  -3.009  -7.973
  310   2HB   LYS  41           HB1      LYS  41 134.882  -4.611  -7.433
  311   1HG   LYS  41           HG2      LYS  41 133.781  -4.955  -9.650
  312   2HG   LYS  41           HG1      LYS  41 134.439  -3.412 -10.182
  313   1HD   LYS  41           HD2      LYS  41 136.733  -4.275  -9.726
  314   2HD   LYS  41           HD1      LYS  41 136.022  -5.836  -9.315
  315   1HE   LYS  41           HE2      LYS  41 135.685  -4.446 -11.986
  316   2HE   LYS  41           HE1      LYS  41 136.818  -5.761 -11.672
  317   1HZ   LYS  41           HZ1      LYS  41 134.417  -6.650 -10.701
  318   2HZ   LYS  41           HZ3      LYS  41 134.012  -5.873 -12.153
  319   3HZ   LYS  41           HZ2      LYS  41 135.157  -7.128 -12.153
  320    H    ALA  42           HN       ALA  42 132.927  -4.651  -5.674
  321    HA   ALA  42           HA       ALA  42 132.148  -2.683  -3.763
  322   1HB   ALA  42           HB3      ALA  42 133.188  -5.500  -3.461
  323   2HB   ALA  42           HB2      ALA  42 132.617  -4.534  -2.100
  324   3HB   ALA  42           HB1      ALA  42 131.512  -4.955  -3.408
  325    H    TYR  43           HN       TYR  43 135.367  -4.182  -4.305
  326    HA   TYR  43           HA       TYR  43 136.535  -3.064  -1.977
  327   1HB   TYR  43           HB2      TYR  43 138.714  -3.465  -2.959
  328   2HB   TYR  43           HB1      TYR  43 137.649  -4.826  -3.281
  329    HD1  TYR  43           HD1      TYR  43 138.973  -1.672  -4.789
  330    HD2  TYR  43           HD2      TYR  43 137.293  -5.560  -5.489
  331    HE1  TYR  43           HE1      TYR  43 139.442  -1.441  -7.205
  332    HE2  TYR  43           HE2      TYR  43 137.773  -5.328  -7.908
  333    HH   TYR  43           HH       TYR  43 138.813  -2.314  -9.297
  334    H    VAL  44           HN       VAL  44 135.562  -1.422  -4.847
  335    HA   VAL  44           HA       VAL  44 137.416   0.826  -4.464
  336    HB   VAL  44           HB       VAL  44 134.792   0.792  -5.999
  337   1HG1  VAL  44          HG13      VAL  44 135.918   3.016  -5.403
  338   2HG1  VAL  44          HG12      VAL  44 137.248   2.506  -6.441
  339   3HG1  VAL  44          HG11      VAL  44 135.637   2.730  -7.120
  340   1HG2  VAL  44          HG21      VAL  44 137.610   0.073  -6.856
  341   2HG2  VAL  44          HG23      VAL  44 136.180  -0.958  -6.910
  342   3HG2  VAL  44          HG22      VAL  44 136.307   0.427  -7.993
  343    H    VAL  45           HN       VAL  45 134.258  -0.176  -3.496
  344    HA   VAL  45           HA       VAL  45 133.486   2.358  -2.237
  345    HB   VAL  45           HB       VAL  45 132.327  -0.436  -1.954
  346   1HG1  VAL  45          HG11      VAL  45 131.348   2.282  -1.037
  347   2HG1  VAL  45          HG13      VAL  45 130.318   0.853  -1.114
  348   3HG1  VAL  45          HG12      VAL  45 131.707   0.882  -0.027
  349   1HG2  VAL  45          HG22      VAL  45 131.585   1.953  -3.666
  350   2HG2  VAL  45          HG21      VAL  45 132.099   0.361  -4.225
  351   3HG2  VAL  45          HG23      VAL  45 130.535   0.556  -3.434
  352    H    LEU  46           HN       LEU  46 134.879  -0.740  -1.245
  353    HA   LEU  46           HA       LEU  46 134.825  -0.313   1.582
  354   1HB   LEU  46           HB2      LEU  46 135.450  -2.488   0.480
  355   2HB   LEU  46           HB1      LEU  46 136.952  -1.745  -0.057
  356    HG   LEU  46           HG       LEU  46 137.355  -1.207   2.449
  357   1HD1  LEU  46          HD11      LEU  46 135.112  -3.219   2.633
  358   2HD1  LEU  46          HD13      LEU  46 136.285  -2.998   3.930
  359   3HD1  LEU  46          HD12      LEU  46 135.252  -1.658   3.441
  360   1HD2  LEU  46          HD21      LEU  46 137.581  -3.877   1.104
  361   2HD2  LEU  46          HD23      LEU  46 138.847  -2.755   1.594
  362   3HD2  LEU  46          HD22      LEU  46 138.034  -3.744   2.803
  363    H    GLY  47           HN       GLY  47 137.030   0.653  -0.985
  364   1HA   GLY  47           HA2      GLY  47 139.107   1.770   0.605
  365   2HA   GLY  47           HA1      GLY  47 138.739   2.257  -1.049
  366    H    GLN  48           HN       GLN  48 136.107   3.273  -0.664
  367    HA   GLN  48           HA       GLN  48 136.669   5.919   0.246
  368   1HB   GLN  48           HB2      GLN  48 134.763   5.218  -1.274
  369   2HB   GLN  48           HB1      GLN  48 133.937   4.609   0.159
  370   1HG   GLN  48           HG2      GLN  48 133.125   6.843  -0.230
  371   2HG   GLN  48           HG1      GLN  48 134.194   6.915   1.171
  372   1HE2  GLN  48          HE22      GLN  48 135.904   9.543  -0.456
  373   2HE2  GLN  48          HE21      GLN  48 135.021   9.048   0.906
  374    H    PHE  49           HN       PHE  49 135.140   3.146   1.839
  375    HA   PHE  49           HA       PHE  49 134.428   4.420   4.285
  376   1HB   PHE  49           HB2      PHE  49 133.659   2.166   3.597
  377   2HB   PHE  49           HB1      PHE  49 135.300   1.554   3.792
  378    HD1  PHE  49           HD1      PHE  49 132.730   3.503   5.710
  379    HD2  PHE  49           HD2      PHE  49 135.848   0.550   5.832
  380    HE1  PHE  49           HE1      PHE  49 132.272   3.117   8.116
  381    HE2  PHE  49           HE2      PHE  49 135.391   0.164   8.232
  382    HZ   PHE  49           HZ       PHE  49 133.602   1.448   9.379
  383    H    LEU  50           HN       LEU  50 137.410   2.851   3.219
  384    HA   LEU  50           HA       LEU  50 138.795   3.174   5.751
  385   1HB   LEU  50           HB2      LEU  50 139.945   2.908   2.952
  386   2HB   LEU  50           HB1      LEU  50 140.865   2.747   4.448
  387    HG   LEU  50           HG       LEU  50 138.520   0.995   3.647
  388   1HD1  LEU  50          HD11      LEU  50 140.625   0.708   2.292
  389   2HD1  LEU  50          HD13      LEU  50 141.467   0.308   3.789
  390   3HD1  LEU  50          HD12      LEU  50 140.162  -0.726   3.209
  391   1HD2  LEU  50          HD23      LEU  50 140.279   1.157   6.091
  392   2HD2  LEU  50          HD22      LEU  50 138.536   0.903   5.991
  393   3HD2  LEU  50          HD21      LEU  50 139.639  -0.409   5.589
  394    H    VAL  51           HN       VAL  51 138.507   5.162   2.846
  395    HA   VAL  51           HA       VAL  51 140.416   7.155   3.610
  396    HB   VAL  51           HB       VAL  51 137.997   7.254   1.788
  397   1HG1  VAL  51          HG13      VAL  51 140.102   9.347   2.381
  398   2HG1  VAL  51          HG12      VAL  51 139.150   9.351   0.896
  399   3HG1  VAL  51          HG11      VAL  51 138.349   9.527   2.457
  400   1HG2  VAL  51          HG21      VAL  51 139.964   5.802   1.179
  401   2HG2  VAL  51          HG23      VAL  51 139.648   7.094   0.022
  402   3HG2  VAL  51          HG22      VAL  51 140.968   7.249   1.182
  403    H    LEU  52           HN       LEU  52 137.079   6.607   4.549
  404    HA   LEU  52           HA       LEU  52 136.846   9.294   5.769
  405   1HB   LEU  52           HB2      LEU  52 134.957   6.925   5.718
  406   2HB   LEU  52           HB1      LEU  52 134.580   8.486   6.442
  407    HG   LEU  52           HG       LEU  52 135.365   8.100   3.536
  408   1HD1  LEU  52          HD13      LEU  52 132.682   8.211   4.914
  409   2HD1  LEU  52          HD12      LEU  52 132.857   8.697   3.228
  410   3HD1  LEU  52          HD11      LEU  52 133.258   7.051   3.718
  411   1HD2  LEU  52          HD21      LEU  52 134.572  10.467   5.230
  412   2HD2  LEU  52          HD23      LEU  52 135.824  10.349   3.993
  413   3HD2  LEU  52          HD22      LEU  52 134.131  10.454   3.523
  414    H    LYS  53           HN       LYS  53 138.649   6.870   6.726
  415    HA   LYS  53           HA       LYS  53 139.270   5.951   8.800
  416   1HB   LYS  53           HB2      LYS  53 138.361   8.742   9.535
  417   2HB   LYS  53           HB1      LYS  53 139.187   7.667  10.663
  418   1HG   LYS  53           HG2      LYS  53 141.070   7.468   9.037
  419   2HG   LYS  53           HG1      LYS  53 140.266   8.642   8.001
  420   1HD   LYS  53           HD2      LYS  53 140.893   9.266  10.891
  421   2HD   LYS  53           HD1      LYS  53 142.090   9.513   9.621
  422   1HE   LYS  53           HE2      LYS  53 140.381  10.925   8.403
  423   2HE   LYS  53           HE1      LYS  53 139.361  10.810   9.836
  424   1HZ   LYS  53           HZ2      LYS  53 142.129  11.879   9.780
  425   2HZ   LYS  53           HZ1      LYS  53 140.712  12.817   9.848
  426   3HZ   LYS  53           HZ3      LYS  53 141.117  11.800  11.143
  427    H    LYS  54           HN       LYS  54 136.653   5.167   8.033
  428    HA   LYS  54           HA       LYS  54 134.747   4.134   8.910
  429   1HB   LYS  54           HB2      LYS  54 136.256   4.423  11.532
  430   2HB   LYS  54           HB1      LYS  54 134.857   3.393  11.257
  431   1HG   LYS  54           HG2      LYS  54 136.101   2.133   9.553
  432   2HG   LYS  54           HG1      LYS  54 137.508   3.162   9.811
  433   1HD   LYS  54           HD2      LYS  54 137.613   2.433  12.166
  434   2HD   LYS  54           HD1      LYS  54 136.208   1.401  11.909
  435   1HE   LYS  54           HE2      LYS  54 137.475   0.170  10.151
  436   2HE   LYS  54           HE1      LYS  54 138.888   1.159  10.512
  437   1HZ   LYS  54           HZ1      LYS  54 138.659   0.368  12.860
  438   2HZ   LYS  54           HZ3      LYS  54 137.508  -0.749  12.312
  439   3HZ   LYS  54           HZ2      LYS  54 139.106  -0.829  11.740
  440    H    ASP  55           HN       ASP  55 135.074   7.240   8.992
  441    HA   ASP  55           HA       ASP  55 133.525   8.096  11.279
  442   1HB   ASP  55           HB2      ASP  55 134.021   9.355   8.571
  443   2HB   ASP  55           HB1      ASP  55 133.123  10.162   9.859
  444    H    GLU  56           HN       GLU  56 131.498   7.357  11.621
  445    HA   GLU  56           HA       GLU  56 129.824   6.184   9.627
  446   1HB   GLU  56           HB2      GLU  56 129.753   5.714  12.079
  447   2HB   GLU  56           HB1      GLU  56 128.998   7.290  12.316
  448   1HG   GLU  56           HG2      GLU  56 127.105   6.649  10.936
  449   2HG   GLU  56           HG1      GLU  56 127.881   5.119  10.520
  450    H    ASP  57           HN       ASP  57 129.722   9.453  11.071
  451    HA   ASP  57           HA       ASP  57 127.259  10.186   9.752
  452   1HB   ASP  57           HB2      ASP  57 129.474  11.839  10.982
  453   2HB   ASP  57           HB1      ASP  57 127.998  12.544  10.320
  454    H    LEU  58           HN       LEU  58 130.666  10.600   8.922
  455    HA   LEU  58           HA       LEU  58 130.104  12.197   6.563
  456   1HB   LEU  58           HB2      LEU  58 132.533  10.493   7.200
  457   2HB   LEU  58           HB1      LEU  58 132.439  11.680   5.903
  458    HG   LEU  58           HG       LEU  58 132.083  12.309   8.852
  459   1HD1  LEU  58          HD12      LEU  58 134.403  11.630   8.233
  460   2HD1  LEU  58          HD11      LEU  58 134.418  12.893   7.004
  461   3HD1  LEU  58          HD13      LEU  58 134.303  13.323   8.709
  462   1HD2  LEU  58          HD23      LEU  58 131.994  13.947   6.318
  463   2HD2  LEU  58          HD22      LEU  58 130.920  14.007   7.715
  464   3HD2  LEU  58          HD21      LEU  58 132.538  14.693   7.820
  465    H    PHE  59           HN       PHE  59 130.536   8.734   7.151
  466    HA   PHE  59           HA       PHE  59 130.433   7.928   4.395
  467   1HB   PHE  59           HB2      PHE  59 131.211   6.397   6.137
  468   2HB   PHE  59           HB1      PHE  59 129.633   6.446   6.921
  469    HD1  PHE  59           HD1      PHE  59 131.357   5.495   3.745
  470    HD2  PHE  59           HD2      PHE  59 127.890   4.995   6.234
  471    HE1  PHE  59           HE1      PHE  59 130.592   3.625   2.305
  472    HE2  PHE  59           HE2      PHE  59 127.123   3.128   4.793
  473    HZ   PHE  59           HZ       PHE  59 128.475   2.442   2.828
  474    H    ARG  60           HN       ARG  60 127.876   8.199   6.886
  475    HA   ARG  60           HA       ARG  60 125.736   7.321   5.241
  476   1HB   ARG  60           HB2      ARG  60 125.799   9.209   7.600
  477   2HB   ARG  60           HB1      ARG  60 124.296   8.735   6.810
  478   1HG   ARG  60           HG2      ARG  60 124.826   6.357   7.242
  479   2HG   ARG  60           HG1      ARG  60 126.309   6.844   8.064
  480   1HD   ARG  60           HD2      ARG  60 125.039   8.052   9.749
  481   2HD   ARG  60           HD1      ARG  60 123.534   7.751   8.884
  482    HE   ARG  60           HE       ARG  60 124.563   5.214   9.380
  483   1HH1  ARG  60          HH21      ARG  60 123.822   8.031  11.226
  484   2HH1  ARG  60          HH22      ARG  60 123.394   7.147  12.653
  485   1HH2  ARG  60          HH11      ARG  60 124.001   4.043  11.231
  486   2HH2  ARG  60          HH12      ARG  60 123.496   4.890  12.655
  487    H    GLU  61           HN       GLU  61 126.912  10.679   5.794
  488    HA   GLU  61           HA       GLU  61 124.956  11.884   4.082
  489   1HB   GLU  61           HB2      GLU  61 126.295  13.181   5.700
  490   2HB   GLU  61           HB1      GLU  61 127.756  12.828   4.774
  491   1HG   GLU  61           HG2      GLU  61 126.895  14.028   2.851
  492   2HG   GLU  61           HG1      GLU  61 125.337  14.266   3.645
  493    H    TRP  62           HN       TRP  62 128.201  10.557   3.471
  494    HA   TRP  62           HA       TRP  62 128.377  11.438   0.760
  495   1HB   TRP  62           HB2      TRP  62 130.383  10.683   1.817
  496   2HB   TRP  62           HB1      TRP  62 129.660   9.131   2.236
  497    HD1  TRP  62           HD1      TRP  62 131.056  11.082  -0.749
  498    HE1  TRP  62           HE1      TRP  62 131.517   9.429  -2.676
  499    HE3  TRP  62           HE3      TRP  62 129.018   6.841   1.227
  500    HZ2  TRP  62           HZ2      TRP  62 131.065   6.660  -3.299
  501    HZ3  TRP  62           HZ3      TRP  62 129.053   4.716  -0.042
  502    HH2  TRP  62           HH2      TRP  62 130.070   4.620  -2.300
  503    H    LEU  63           HN       LEU  63 127.238   8.314   2.096
  504    HA   LEU  63           HA       LEU  63 126.664   7.199  -0.482
  505   1HB   LEU  63           HB2      LEU  63 126.951   5.796   1.511
  506   2HB   LEU  63           HB1      LEU  63 125.519   6.516   2.241
  507    HG   LEU  63           HG       LEU  63 124.125   5.609   0.427
  508   1HD1  LEU  63          HD11      LEU  63 126.801   4.740  -0.646
  509   2HD1  LEU  63          HD13      LEU  63 125.356   3.807  -1.033
  510   3HD1  LEU  63          HD12      LEU  63 125.459   5.500  -1.498
  511   1HD2  LEU  63          HD21      LEU  63 124.532   4.251   2.446
  512   2HD2  LEU  63          HD23      LEU  63 124.346   3.225   1.024
  513   3HD2  LEU  63          HD22      LEU  63 125.952   3.539   1.680
  514    H    LYS  64           HN       LYS  64 124.587   8.807   1.907
  515    HA   LYS  64           HA       LYS  64 122.156   8.530   0.434
  516   1HB   LYS  64           HB2      LYS  64 122.233   9.214   2.816
  517   2HB   LYS  64           HB1      LYS  64 122.933  10.760   2.333
  518   1HG   LYS  64           HG2      LYS  64 120.932  11.275   1.003
  519   2HG   LYS  64           HG1      LYS  64 120.236   9.711   1.427
  520   1HD   LYS  64           HD2      LYS  64 120.212  10.331   3.792
  521   2HD   LYS  64           HD1      LYS  64 120.984  11.873   3.415
  522   1HE   LYS  64           HE2      LYS  64 118.337  11.016   2.222
  523   2HE   LYS  64           HE1      LYS  64 118.463  11.981   3.694
  524   1HZ   LYS  64           HZ2      LYS  64 120.076  12.960   1.522
  525   2HZ   LYS  64           HZ1      LYS  64 118.411  12.974   1.183
  526   3HZ   LYS  64           HZ3      LYS  64 119.006  13.796   2.543
  527    H    ASP  65           HN       ASP  65 124.526  11.188   0.486
  528    HA   ASP  65           HA       ASP  65 123.113  12.769  -1.470
  529   1HB   ASP  65           HB2      ASP  65 125.997  12.788  -0.544
  530   2HB   ASP  65           HB1      ASP  65 125.340  13.957  -1.691
  531    H    THR  66           HN       THR  66 125.426  10.148  -1.663
  532    HA   THR  66           HA       THR  66 126.126  10.616  -4.427
  533    HB   THR  66           HB       THR  66 126.435   8.143  -2.697
  534    HG1  THR  66           HG1      THR  66 127.688  10.526  -2.826
  535   1HG2  THR  66          HG21      THR  66 126.584   7.770  -5.221
  536   2HG2  THR  66          HG23      THR  66 127.971   8.855  -5.204
  537   3HG2  THR  66          HG22      THR  66 128.023   7.347  -4.301
  538    H    CYS  67           HN       CYS  67 123.694   8.526  -2.813
  539    HA   CYS  67           HA       CYS  67 122.593   7.958  -5.556
  540   1HB   CYS  67           HB2      CYS  67 122.001   5.696  -4.720
  541   2HB   CYS  67           HB1      CYS  67 123.743   5.976  -4.748
  542    HG   CYS  67           HG       CYS  67 123.503   5.180  -2.375
  543    H    GLY  68           HN       GLY  68 121.869   8.547  -2.145
  544   1HA   GLY  68           HA2      GLY  68 119.803   9.759  -1.584
  545   2HA   GLY  68           HA1      GLY  68 118.990   8.912  -2.902
  546    H    ALA  69           HN       ALA  69 121.197   7.020  -1.067
  547    HA   ALA  69           HA       ALA  69 119.366   5.036  -0.332
  548   1HB   ALA  69           HB2      ALA  69 121.827   4.774  -0.213
  549   2HB   ALA  69           HB1      ALA  69 121.866   5.861   1.176
  550   3HB   ALA  69           HB3      ALA  69 121.053   4.300   1.299
  551    H    ASN  70           HN       ASN  70 118.271   4.560   1.673
  552    HA   ASN  70           HA       ASN  70 117.419   6.990   3.123
  553   1HB   ASN  70           HB2      ASN  70 115.756   5.315   2.297
  554   2HB   ASN  70           HB1      ASN  70 116.468   4.121   3.381
  555   1HD2  ASN  70          HD22      ASN  70 114.663   7.336   5.218
  556   2HD2  ASN  70          HD21      ASN  70 115.595   7.602   3.824
  557    H    ALA  71           HN       ALA  71 117.136   6.685   5.565
  558    HA   ALA  71           HA       ALA  71 119.666   6.309   6.789
  559   1HB   ALA  71           HB3      ALA  71 116.865   6.410   7.917
  560   2HB   ALA  71           HB2      ALA  71 118.290   6.271   8.945
  561   3HB   ALA  71           HB1      ALA  71 118.081   7.686   7.913
  562    H    LYS  72           HN       LYS  72 116.964   4.018   6.371
  563    HA   LYS  72           HA       LYS  72 118.051   2.066   8.193
  564   1HB   LYS  72           HB2      LYS  72 116.126   1.765   5.870
  565   2HB   LYS  72           HB1      LYS  72 116.455   0.509   7.059
  566   1HG   LYS  72           HG2      LYS  72 115.541   3.257   7.917
  567   2HG   LYS  72           HG1      LYS  72 114.377   2.028   7.427
  568   1HD   LYS  72           HD2      LYS  72 115.438   0.481   9.139
  569   2HD   LYS  72           HD1      LYS  72 116.353   1.871   9.720
  570   1HE   LYS  72           HE2      LYS  72 114.311   3.068  10.245
  571   2HE   LYS  72           HE1      LYS  72 113.333   1.788   9.526
  572   1HZ   LYS  72           HZ1      LYS  72 115.158   1.418  11.839
  573   2HZ   LYS  72           HZ3      LYS  72 113.481   1.643  11.964
  574   3HZ   LYS  72           HZ2      LYS  72 114.095   0.262  11.189
  575    H    GLN  73           HN       GLN  73 118.256   2.447   4.662
  576    HA   GLN  73           HA       GLN  73 119.730   0.030   4.239
  577   1HB   GLN  73           HB2      GLN  73 119.525   2.558   2.582
  578   2HB   GLN  73           HB1      GLN  73 120.309   1.079   2.028
  579   1HG   GLN  73           HG2      GLN  73 117.423   1.250   2.949
  580   2HG   GLN  73           HG1      GLN  73 117.932   1.268   1.262
  581   1HE2  GLN  73          HE22      GLN  73 119.383  -2.204   1.969
  582   2HE2  GLN  73          HE21      GLN  73 120.150  -0.703   1.770
  583    H    SER  74           HN       SER  74 120.726   3.309   5.081
  584    HA   SER  74           HA       SER  74 123.511   2.926   4.491
  585   1HB   SER  74           HB2      SER  74 123.853   4.986   5.599
  586   2HB   SER  74           HB1      SER  74 122.230   5.128   4.929
  587    HG   SER  74           HG       SER  74 122.298   5.740   7.129
  588    H    ARG  75           HN       ARG  75 121.526   2.358   7.394
  589    HA   ARG  75           HA       ARG  75 123.659   1.851   9.202
  590   1HB   ARG  75           HB2      ARG  75 120.822   0.801   9.098
  591   2HB   ARG  75           HB1      ARG  75 121.921   0.485  10.443
  592   1HG   ARG  75           HG2      ARG  75 122.182   2.887  10.830
  593   2HG   ARG  75           HG1      ARG  75 121.147   3.242   9.450
  594   1HD   ARG  75           HD2      ARG  75 119.877   3.393  11.558
  595   2HD   ARG  75           HD1      ARG  75 119.273   2.076  10.552
  596    HE   ARG  75           HE       ARG  75 121.141   0.843  12.176
  597   1HH1  ARG  75          HH21      ARG  75 118.414   2.901  12.625
  598   2HH1  ARG  75          HH22      ARG  75 117.992   2.231  14.166
  599   1HH2  ARG  75          HH11      ARG  75 120.606  -0.049  14.186
  600   2HH2  ARG  75          HH12      ARG  75 119.234   0.561  15.049
  601    H    ASP  76           HN       ASP  76 121.982  -0.336   6.930
  602    HA   ASP  76           HA       ASP  76 123.261  -2.709   7.872
  603   1HB   ASP  76           HB2      ASP  76 122.046  -1.984   5.197
  604   2HB   ASP  76           HB1      ASP  76 122.633  -3.602   5.584
  605    H    CYS  77           HN       CYS  77 124.216  -0.379   5.326
  606    HA   CYS  77           HA       CYS  77 126.466  -1.955   4.447
  607   1HB   CYS  77           HB2      CYS  77 125.795   0.985   4.185
  608   2HB   CYS  77           HB1      CYS  77 127.217   0.250   3.445
  609    HG   CYS  77           HG       CYS  77 125.436  -1.407   2.210
  610    H    PHE  78           HN       PHE  78 126.125   0.694   6.840
  611    HA   PHE  78           HA       PHE  78 128.910   1.045   7.289
  612   1HB   PHE  78           HB2      PHE  78 127.212   2.601   8.157
  613   2HB   PHE  78           HB1      PHE  78 126.626   1.354   9.259
  614    HD1  PHE  78           HD1      PHE  78 129.393   3.678   8.514
  615    HD2  PHE  78           HD2      PHE  78 127.920   0.670  11.199
  616    HE1  PHE  78           HE1      PHE  78 131.111   4.327  10.184
  617    HE2  PHE  78           HE2      PHE  78 129.634   1.322  12.869
  618    HZ   PHE  78           HZ       PHE  78 131.229   3.148  12.361
  619    H    GLY  79           HN       GLY  79 126.639  -0.834   9.326
  620   1HA   GLY  79           HA2      GLY  79 128.666  -2.076  10.878
  621   2HA   GLY  79           HA1      GLY  79 127.029  -2.698  10.681
  622    H    CYS  80           HN       CYS  80 127.280  -2.968   7.752
  623    HA   CYS  80           HA       CYS  80 128.383  -5.643   7.717
  624   1HB   CYS  80           HB2      CYS  80 126.575  -4.916   6.184
  625   2HB   CYS  80           HB1      CYS  80 127.710  -3.832   5.380
  626    HG   CYS  80           HG       CYS  80 128.921  -6.551   5.337
  627    H    LEU  81           HN       LEU  81 129.538  -2.519   6.393
  628    HA   LEU  81           HA       LEU  81 132.010  -3.664   5.426
  629   1HB   LEU  81           HB2      LEU  81 131.201  -0.808   6.054
  630   2HB   LEU  81           HB1      LEU  81 132.741  -1.244   5.319
  631    HG   LEU  81           HG       LEU  81 130.041  -2.003   4.160
  632   1HD1  LEU  81          HD13      LEU  81 130.396   0.465   4.219
  633   2HD1  LEU  81          HD12      LEU  81 131.895   0.245   3.318
  634   3HD1  LEU  81          HD11      LEU  81 130.351  -0.175   2.576
  635   1HD2  LEU  81          HD22      LEU  81 132.906  -2.364   3.300
  636   2HD2  LEU  81          HD21      LEU  81 131.549  -3.481   3.168
  637   3HD2  LEU  81          HD23      LEU  81 131.679  -2.121   2.059
  638    H    ARG  82           HN       ARG  82 131.014  -2.044   8.428
  639    HA   ARG  82           HA       ARG  82 133.576  -1.798   9.629
  640   1HB   ARG  82           HB2      ARG  82 131.388  -0.818  10.475
  641   2HB   ARG  82           HB1      ARG  82 131.007  -2.423  11.101
  642   1HG   ARG  82           HG2      ARG  82 133.434  -2.207  12.198
  643   2HG   ARG  82           HG1      ARG  82 133.120  -0.484  12.004
  644   1HD   ARG  82           HD2      ARG  82 131.679  -2.494  13.711
  645   2HD   ARG  82           HD1      ARG  82 132.239  -0.875  14.130
  646    HE   ARG  82           HE       ARG  82 130.290  -0.407  12.229
  647   1HH1  ARG  82          HH21      ARG  82 130.530  -2.229  15.146
  648   2HH1  ARG  82          HH22      ARG  82 128.868  -2.011  15.578
  649   1HH2  ARG  82          HH11      ARG  82 128.111  -0.111  12.783
  650   2HH2  ARG  82          HH12      ARG  82 127.500  -0.812  14.243
  651    H    GLU  83           HN       GLU  83 131.251  -4.502   9.725
  652    HA   GLU  83           HA       GLU  83 132.904  -6.098  11.476
  653   1HB   GLU  83           HB2      GLU  83 130.468  -6.666   9.803
  654   2HB   GLU  83           HB1      GLU  83 131.366  -8.011  10.501
  655   1HG   GLU  83           HG2      GLU  83 129.680  -7.481  12.095
  656   2HG   GLU  83           HG1      GLU  83 131.158  -6.795  12.755
  657    H    TRP  84           HN       TRP  84 132.642  -5.925   7.917
  658    HA   TRP  84           HA       TRP  84 134.220  -8.240   7.381
  659   1HB   TRP  84           HB2      TRP  84 132.925  -6.903   5.670
  660   2HB   TRP  84           HB1      TRP  84 134.182  -5.671   5.767
  661    HD1  TRP  84           HD1      TRP  84 133.453  -9.118   4.398
  662    HE1  TRP  84           HE1      TRP  84 135.424  -9.883   2.919
  663    HE3  TRP  84           HE3      TRP  84 136.835  -5.439   5.452
  664    HZ2  TRP  84           HZ2      TRP  84 138.077  -9.051   2.273
  665    HZ3  TRP  84           HZ3      TRP  84 139.075  -5.452   4.392
  666    HH2  TRP  84           HH2      TRP  84 139.700  -7.252   2.805
  667    H    CYS  85           HN       CYS  85 135.094  -4.841   7.920
  668    HA   CYS  85           HA       CYS  85 137.916  -5.140   7.573
  669   1HB   CYS  85           HB2      CYS  85 136.264  -3.184   9.185
  670   2HB   CYS  85           HB1      CYS  85 138.021  -3.076   9.078
  671    HG   CYS  85           HG       CYS  85 137.026  -3.247   6.290
  672    H    ASP  86           HN       ASP  86 135.828  -5.508  10.409
  673    HA   ASP  86           HA       ASP  86 137.862  -5.873  12.361
  674   1HB   ASP  86           HB2      ASP  86 135.045  -6.969  12.177
  675   2HB   ASP  86           HB1      ASP  86 136.073  -7.178  13.595
  676    H    ALA  87           HN       ALA  87 136.441  -8.122  10.032
  677    HA   ALA  87           HA       ALA  87 137.825 -10.420  11.231
  678   1HB   ALA  87           HB2      ALA  87 135.542 -10.428   9.992
  679   2HB   ALA  87           HB1      ALA  87 136.510 -10.418   8.517
  680   3HB   ALA  87           HB3      ALA  87 136.669 -11.745   9.669
  681    H    PHE  88           HN       PHE  88 138.202  -8.386   8.330
  682    HA   PHE  88           HA       PHE  88 140.697  -9.893   7.654
  683   1HB   PHE  88           HB2      PHE  88 139.053  -7.902   6.075
  684   2HB   PHE  88           HB1      PHE  88 140.558  -8.620   5.504
  685    HD1  PHE  88           HD2      PHE  88 140.716 -11.105   5.193
  686    HD2  PHE  88           HD1      PHE  88 136.998  -9.134   6.057
  687    HE1  PHE  88           HE2      PHE  88 139.475 -13.112   4.430
  688    HE2  PHE  88           HE1      PHE  88 135.756 -11.142   5.294
  689    HZ   PHE  88           HZ       PHE  88 136.996 -13.129   4.479
  690    H    LEU  89           HN       LEU  89 140.025  -6.495   6.920
  691    HA   LEU  89           HA       LEU  89 142.683  -5.775   7.977
  692   1HB   LEU  89           HB2      LEU  89 142.126  -4.842   5.829
  693   2HB   LEU  89           HB1      LEU  89 140.573  -4.257   6.418
  694    HG   LEU  89           HG       LEU  89 141.670  -2.627   7.857
  695   1HD1  LEU  89          HD12      LEU  89 144.173  -4.078   6.981
  696   2HD1  LEU  89          HD11      LEU  89 144.233  -2.430   7.608
  697   3HD1  LEU  89          HD13      LEU  89 143.624  -3.737   8.622
  698   1HD2  LEU  89          HD22      LEU  89 141.349  -2.114   5.411
  699   2HD2  LEU  89          HD21      LEU  89 142.662  -1.207   6.164
  700   3HD2  LEU  89          HD23      LEU  89 143.023  -2.600   5.143
  701   1H    MET   1           HT2      MET   1 167.481  -7.821  -0.209
  702   2H    MET   1           HT1      MET   1 168.480  -8.423  -1.445
  703   3H    MET   1           HT3      MET   1 168.694  -8.954   0.151
  704    HA   MET   1           HA       MET   1 169.547  -6.900   0.859
  705   1HB   MET   1           HB2      MET   1 171.045  -8.369  -0.563
  706   2HB   MET   1           HB1      MET   1 170.646  -7.330  -1.931
  707   1HG   MET   1           HG2      MET   1 171.524  -5.377  -0.737
  708   2HG   MET   1           HG1      MET   1 171.885  -6.377   0.668
  709   1HE   MET   1           HE2      MET   1 173.382  -8.133   0.863
  710   2HE   MET   1           HE1      MET   1 173.249  -9.132  -0.583
  711   3HE   MET   1           HE3      MET   1 174.811  -8.456  -0.113
  712    H    THR   2           HN       THR   2 167.735  -6.747  -2.101
  713    HA   THR   2           HA       THR   2 168.204  -3.957  -2.681
  714    HB   THR   2           HB       THR   2 165.766  -5.606  -3.404
  715    HG1  THR   2           HG1      THR   2 168.272  -6.065  -3.999
  716   1HG2  THR   2          HG23      THR   2 165.704  -3.121  -3.787
  717   2HG2  THR   2          HG22      THR   2 167.103  -3.303  -4.844
  718   3HG2  THR   2          HG21      THR   2 165.574  -4.075  -5.265
  719    H    THR   3           HN       THR   3 165.032  -5.304  -1.783
  720    HA   THR   3           HA       THR   3 164.284  -2.819  -0.478
  721    HB   THR   3           HB       THR   3 162.199  -4.027   0.084
  722    HG1  THR   3           HG1      THR   3 163.797  -6.189  -0.705
  723   1HG2  THR   3          HG22      THR   3 162.513  -3.059  -2.179
  724   2HG2  THR   3          HG21      THR   3 163.172  -4.601  -2.729
  725   3HG2  THR   3          HG23      THR   3 161.489  -4.494  -2.214
  726    H    SER   4           HN       SER   4 163.807  -2.576   1.797
  727    HA   SER   4           HA       SER   4 165.738  -3.945   3.503
  728   1HB   SER   4           HB2      SER   4 163.530  -2.008   4.257
  729   2HB   SER   4           HB1      SER   4 164.894  -2.477   5.269
  730    HG   SER   4           HG       SER   4 166.246  -1.624   3.557
  731    H    GLN   5           HN       GLN   5 164.984  -4.890   5.619
  732    HA   GLN   5           HA       GLN   5 163.309  -7.132   5.193
  733   1HB   GLN   5           HB2      GLN   5 164.182  -5.760   7.746
  734   2HB   GLN   5           HB1      GLN   5 163.306  -7.290   7.721
  735   1HG   GLN   5           HG2      GLN   5 165.083  -8.341   6.431
  736   2HG   GLN   5           HG1      GLN   5 165.934  -6.801   6.289
  737   1HE2  GLN   5          HE22      GLN   5 167.283  -8.831   9.206
  738   2HE2  GLN   5          HE21      GLN   5 167.009  -9.226   7.579
  739    H    LYS   6           HN       LYS   6 162.445  -3.849   5.942
  740    HA   LYS   6           HA       LYS   6 159.990  -4.290   7.305
  741   1HB   LYS   6           HB2      LYS   6 160.898  -2.065   5.461
  742   2HB   LYS   6           HB1      LYS   6 159.402  -2.014   6.397
  743   1HG   LYS   6           HG2      LYS   6 160.694  -2.291   8.482
  744   2HG   LYS   6           HG1      LYS   6 162.188  -2.339   7.549
  745   1HD   LYS   6           HD2      LYS   6 161.741  -0.066   6.701
  746   2HD   LYS   6           HD1      LYS   6 160.246  -0.012   7.638
  747   1HE   LYS   6           HE2      LYS   6 161.468  -0.174   9.720
  748   2HE   LYS   6           HE1      LYS   6 162.983  -0.449   8.861
  749   1HZ   LYS   6           HZ3      LYS   6 161.431   1.977   8.290
  750   2HZ   LYS   6           HZ2      LYS   6 162.373   1.913   9.703
  751   3HZ   LYS   6           HZ1      LYS   6 163.102   1.719   8.180
  752    H    HIS   7           HN       HIS   7 160.787  -4.166   3.841
  753    HA   HIS   7           HA       HIS   7 158.142  -4.177   2.838
  754   1HB   HIS   7           HB2      HIS   7 159.930  -3.797   1.296
  755   2HB   HIS   7           HB1      HIS   7 160.729  -5.302   1.742
  756    HD2  HIS   7           HD2      HIS   7 159.826  -7.571   0.364
  757    HE1  HIS   7           HE1      HIS   7 156.763  -5.665  -1.832
  758    HE2  HIS   7           HE2      HIS   7 158.058  -7.826  -1.537
  759    H    ARG   8           HN       ARG   8 160.251  -7.001   3.521
  760    HA   ARG   8           HA       ARG   8 158.208  -8.910   2.886
  761   1HB   ARG   8           HB2      ARG   8 160.768  -9.133   4.490
  762   2HB   ARG   8           HB1      ARG   8 159.745 -10.513   4.072
  763   1HG   ARG   8           HG2      ARG   8 160.007  -9.981   1.673
  764   2HG   ARG   8           HG1      ARG   8 161.036  -8.610   2.093
  765   1HD   ARG   8           HD2      ARG   8 162.598 -10.201   3.238
  766   2HD   ARG   8           HD1      ARG   8 161.609 -11.534   2.645
  767    HE   ARG   8           HE       ARG   8 162.215 -10.083   0.360
  768   1HH1  ARG   8          HH21      ARG   8 163.972 -11.503   2.965
  769   2HH1  ARG   8          HH22      ARG   8 165.376 -11.842   2.009
  770   1HH2  ARG   8          HH11      ARG   8 164.038 -10.516  -0.902
  771   2HH2  ARG   8          HH12      ARG   8 165.413 -11.281  -0.181
  772    H    ASP   9           HN       ASP   9 159.162  -7.244   5.823
  773    HA   ASP   9           HA       ASP   9 157.619  -8.917   7.606
  774   1HB   ASP   9           HB2      ASP   9 158.722  -6.122   7.901
  775   2HB   ASP   9           HB1      ASP   9 157.869  -6.962   9.192
  776    H    PHE  10           HN       PHE  10 156.939  -5.887   5.857
  777    HA   PHE  10           HA       PHE  10 154.403  -5.417   7.132
  778   1HB   PHE  10           HB2      PHE  10 155.717  -3.708   5.859
  779   2HB   PHE  10           HB1      PHE  10 155.290  -4.549   4.370
  780    HD1  PHE  10           HD1      PHE  10 154.026  -2.518   7.169
  781    HD2  PHE  10           HD2      PHE  10 153.003  -4.514   3.504
  782    HE1  PHE  10           HE1      PHE  10 151.866  -1.302   7.112
  783    HE2  PHE  10           HE2      PHE  10 150.840  -3.298   3.449
  784    HZ   PHE  10           HZ       PHE  10 150.271  -1.692   5.253
  785    H    VAL  11           HN       VAL  11 155.284  -7.130   4.125
  786    HA   VAL  11           HA       VAL  11 152.465  -7.710   3.533
  787    HB   VAL  11           HB       VAL  11 153.360  -8.973   1.634
  788   1HG1  VAL  11          HG12      VAL  11 154.745  -6.329   2.160
  789   2HG1  VAL  11          HG11      VAL  11 154.710  -7.124   0.587
  790   3HG1  VAL  11          HG13      VAL  11 153.208  -6.573   1.330
  791   1HG2  VAL  11          HG22      VAL  11 155.949  -8.589   3.136
  792   2HG2  VAL  11          HG21      VAL  11 155.256 -10.085   2.517
  793   3HG2  VAL  11          HG23      VAL  11 155.942  -8.904   1.401
  794    H    ALA  12           HN       ALA  12 154.109  -8.757   6.004
  795    HA   ALA  12           HA       ALA  12 153.312 -11.641   5.706
  796   1HB   ALA  12           HB3      ALA  12 155.780 -11.243   5.875
  797   2HB   ALA  12           HB2      ALA  12 155.510 -10.514   7.458
  798   3HB   ALA  12           HB1      ALA  12 155.132 -12.217   7.195
  799    H    GLU  13           HN       GLU  13 152.608  -8.751   7.332
  800    HA   GLU  13           HA       GLU  13 151.001 -10.265   9.295
  801   1HB   GLU  13           HB2      GLU  13 151.861  -9.054  11.226
  802   2HB   GLU  13           HB1      GLU  13 153.201  -9.852  10.404
  803   1HG   GLU  13           HG2      GLU  13 153.499  -7.627   9.128
  804   2HG   GLU  13           HG1      GLU  13 152.455  -6.926  10.362
  805    HA   PRO  14           HA       PRO  14 147.913  -7.151   8.489
  806   1HB   PRO  14           HB2      PRO  14 147.766  -6.763  11.466
  807   2HB   PRO  14           HB1      PRO  14 146.456  -7.037  10.300
  808   1HG   PRO  14           HG2      PRO  14 147.346  -8.984  11.914
  809   2HG   PRO  14           HG1      PRO  14 146.776  -9.312  10.268
  810   1HD   PRO  14           HD2      PRO  14 149.557  -9.358  11.326
  811   2HD   PRO  14           HD1      PRO  14 148.863 -10.202   9.926
  812    H    MET  15           HN       MET  15 147.660  -4.792   8.565
  813    HA   MET  15           HA       MET  15 150.206  -3.419   9.208
  814   1HB   MET  15           HB2      MET  15 149.042  -1.449   8.109
  815   2HB   MET  15           HB1      MET  15 149.299  -2.847   7.067
  816   1HG   MET  15           HG2      MET  15 147.012  -3.540   7.287
  817   2HG   MET  15           HG1      MET  15 146.725  -2.389   8.591
  818   1HE   MET  15           HE1      MET  15 148.092  -2.776   5.086
  819   2HE   MET  15           HE3      MET  15 146.363  -2.938   4.750
  820   3HE   MET  15           HE2      MET  15 147.265  -1.563   4.116
  821    H    GLY  16           HN       GLY  16 146.958  -3.727  10.451
  822   1HA   GLY  16           HA2      GLY  16 145.929  -2.762  12.319
  823   2HA   GLY  16           HA1      GLY  16 147.562  -2.636  12.974
  824    H    GLU  17           HN       GLU  17 147.535  -0.577  13.811
  825    HA   GLU  17           HA       GLU  17 146.602   1.669  12.076
  826   1HB   GLU  17           HB2      GLU  17 147.125   1.455  15.050
  827   2HB   GLU  17           HB1      GLU  17 146.719   2.967  14.236
  828   1HG   GLU  17           HG2      GLU  17 144.618   1.962  13.416
  829   2HG   GLU  17           HG1      GLU  17 145.022   0.452  14.233
  830    H    LYS  18           HN       LYS  18 149.228   0.345  11.692
  831    HA   LYS  18           HA       LYS  18 151.337   1.872  12.836
  832   1HB   LYS  18           HB2      LYS  18 151.112   0.340  10.236
  833   2HB   LYS  18           HB1      LYS  18 152.614   1.111  10.744
  834   1HG   LYS  18           HG2      LYS  18 152.667  -0.205  12.782
  835   2HG   LYS  18           HG1      LYS  18 151.075  -0.879  12.432
  836   1HD   LYS  18           HD2      LYS  18 151.926  -2.038  10.483
  837   2HD   LYS  18           HD1      LYS  18 153.493  -1.243  10.643
  838   1HE   LYS  18           HE2      LYS  18 152.272  -3.099  12.707
  839   2HE   LYS  18           HE1      LYS  18 153.526  -3.557  11.555
  840   1HZ   LYS  18           HZ3      LYS  18 154.662  -1.425  12.578
  841   2HZ   LYS  18           HZ2      LYS  18 153.701  -1.846  13.915
  842   3HZ   LYS  18           HZ1      LYS  18 154.826  -2.955  13.293
  843    HA   PRO  19           HA       PRO  19 150.878   5.771  10.776
  844   1HB   PRO  19           HB2      PRO  19 153.509   6.615  10.610
  845   2HB   PRO  19           HB1      PRO  19 152.551   6.646  12.103
  846   1HG   PRO  19           HG2      PRO  19 154.590   4.661  11.207
  847   2HG   PRO  19           HG1      PRO  19 154.288   5.318  12.826
  848   1HD   PRO  19           HD2      PRO  19 153.430   2.837  12.062
  849   2HD   PRO  19           HD1      PRO  19 152.565   3.822  13.260
  850    H    VAL  20           HN       VAL  20 151.252   6.893   8.756
  851    HA   VAL  20           HA       VAL  20 151.328   5.260   6.462
  852    HB   VAL  20           HB       VAL  20 150.379   7.492   6.366
  853   1HG1  VAL  20          HG13      VAL  20 152.101   8.447   8.005
  854   2HG1  VAL  20          HG12      VAL  20 153.179   8.610   6.619
  855   3HG1  VAL  20          HG11      VAL  20 151.653   9.491   6.657
  856   1HG2  VAL  20          HG23      VAL  20 151.521   6.449   4.321
  857   2HG2  VAL  20          HG22      VAL  20 151.265   8.193   4.264
  858   3HG2  VAL  20          HG21      VAL  20 152.863   7.547   4.640
  859    H    GLY  21           HN       GLY  21 153.948   7.202   7.890
  860   1HA   GLY  21           HA2      GLY  21 155.930   6.689   5.948
  861   2HA   GLY  21           HA1      GLY  21 156.271   7.048   7.640
  862    H    SER  22           HN       SER  22 154.343   4.396   7.809
  863    HA   SER  22           HA       SER  22 156.647   2.637   8.258
  864   1HB   SER  22           HB2      SER  22 154.657   2.586   9.757
  865   2HB   SER  22           HB1      SER  22 153.671   2.046   8.400
  866    HG   SER  22           HG       SER  22 155.936   0.726   9.502
  867    H    LEU  23           HN       LEU  23 154.334   3.288   5.753
  868    HA   LEU  23           HA       LEU  23 154.453   0.773   4.387
  869   1HB   LEU  23           HB2      LEU  23 153.989   3.569   3.307
  870   2HB   LEU  23           HB1      LEU  23 153.703   2.086   2.399
  871    HG   LEU  23           HG       LEU  23 152.381   2.715   5.058
  872   1HD1  LEU  23          HD12      LEU  23 151.733   4.341   3.291
  873   2HD1  LEU  23          HD11      LEU  23 151.248   2.996   2.257
  874   3HD1  LEU  23          HD13      LEU  23 150.387   3.304   3.767
  875   1HD2  LEU  23          HD22      LEU  23 152.132   0.502   3.016
  876   2HD2  LEU  23          HD21      LEU  23 152.219   0.387   4.773
  877   3HD2  LEU  23          HD23      LEU  23 150.738   0.941   3.998
  878    H    ALA  24           HN       ALA  24 155.883  -0.007   2.912
  879    HA   ALA  24           HA       ALA  24 158.586   0.963   2.982
  880   1HB   ALA  24           HB1      ALA  24 157.230  -0.965   1.079
  881   2HB   ALA  24           HB3      ALA  24 158.970  -0.693   1.144
  882   3HB   ALA  24           HB2      ALA  24 158.132  -1.380   2.535
  883    H    GLY  25           HN       GLY  25 159.683   2.311   1.642
  884   1HA   GLY  25           HA2      GLY  25 160.103   3.421  -0.482
  885   2HA   GLY  25           HA1      GLY  25 158.397   3.243  -0.888
  886    H    ILE  26           HN       ILE  26 157.851   4.149   2.039
  887    HA   ILE  26           HA       ILE  26 157.932   7.074   1.414
  888    HB   ILE  26           HB       ILE  26 156.412   5.628   3.605
  889   1HG1  ILE  26          HG12      ILE  26 155.634   4.767   1.475
  890   2HG1  ILE  26          HG11      ILE  26 154.437   5.914   2.072
  891   1HG2  ILE  26          HG22      ILE  26 156.177   8.392   2.385
  892   2HG2  ILE  26          HG21      ILE  26 155.037   7.713   3.545
  893   3HG2  ILE  26          HG23      ILE  26 156.709   8.006   4.022
  894   1HD1  ILE  26          HD13      ILE  26 155.752   7.667   0.647
  895   2HD1  ILE  26          HD12      ILE  26 156.422   6.255  -0.169
  896   3HD1  ILE  26          HD11      ILE  26 154.683   6.537  -0.181
  897    H    GLY  27           HN       GLY  27 159.575   8.224   2.398
  898   1HA   GLY  27           HA2      GLY  27 160.938   7.025   4.736
  899   2HA   GLY  27           HA1      GLY  27 161.509   8.397   3.788
  900    H    GLU  28           HN       GLU  28 161.658   8.796   6.393
  901    HA   GLU  28           HA       GLU  28 159.393   9.658   7.828
  902   1HB   GLU  28           HB2      GLU  28 162.254  10.655   7.900
  903   2HB   GLU  28           HB1      GLU  28 161.028  11.121   9.080
  904   1HG   GLU  28           HG2      GLU  28 160.686   8.752   9.669
  905   2HG   GLU  28           HG1      GLU  28 161.915   8.281   8.493
  906    H    VAL  29           HN       VAL  29 161.409  11.499   5.529
  907    HA   VAL  29           HA       VAL  29 160.077  14.009   5.993
  908    HB   VAL  29           HB       VAL  29 161.587  12.991   3.566
  909   1HG1  VAL  29          HG11      VAL  29 160.508  15.716   4.301
  910   2HG1  VAL  29          HG13      VAL  29 161.842  15.515   3.165
  911   3HG1  VAL  29          HG12      VAL  29 160.265  14.812   2.807
  912   1HG2  VAL  29          HG22      VAL  29 162.407  14.711   5.930
  913   2HG2  VAL  29          HG21      VAL  29 162.971  13.078   5.578
  914   3HG2  VAL  29          HG23      VAL  29 163.414  14.413   4.513
  915    H    LEU  30           HN       LEU  30 159.588  11.426   3.612
  916    HA   LEU  30           HA       LEU  30 157.477  12.750   2.189
  917   1HB   LEU  30           HB2      LEU  30 158.176   9.815   2.467
  918   2HB   LEU  30           HB1      LEU  30 156.955  10.427   1.356
  919    HG   LEU  30           HG       LEU  30 159.846  11.347   1.357
  920   1HD1  LEU  30          HD11      LEU  30 158.447   9.148  -0.167
  921   2HD1  LEU  30          HD13      LEU  30 159.887   9.940  -0.809
  922   3HD1  LEU  30          HD12      LEU  30 159.968   9.073   0.724
  923   1HD2  LEU  30          HD23      LEU  30 157.428  11.911  -0.355
  924   2HD2  LEU  30          HD22      LEU  30 158.659  13.024   0.238
  925   3HD2  LEU  30          HD21      LEU  30 159.028  11.939  -1.096
  926    H    GLY  31           HN       GLY  31 157.508  10.526   4.940
  927   1HA   GLY  31           HA2      GLY  31 154.700  10.093   5.113
  928   2HA   GLY  31           HA1      GLY  31 155.815   9.994   6.475
  929    H    LYS  32           HN       LYS  32 156.739  12.696   6.436
  930    HA   LYS  32           HA       LYS  32 154.717  13.944   8.006
  931   1HB   LYS  32           HB2      LYS  32 157.112  14.464   8.227
  932   2HB   LYS  32           HB1      LYS  32 157.115  15.177   6.618
  933   1HG   LYS  32           HG2      LYS  32 156.981  16.946   8.288
  934   2HG   LYS  32           HG1      LYS  32 155.464  16.880   7.401
  935   1HD   LYS  32           HD2      LYS  32 154.320  15.848   9.209
  936   2HD   LYS  32           HD1      LYS  32 155.828  15.401  10.012
  937   1HE   LYS  32           HE2      LYS  32 156.318  17.815  10.364
  938   2HE   LYS  32           HE1      LYS  32 154.772  18.218   9.620
  939   1HZ   LYS  32           HZ3      LYS  32 154.546  16.258  11.703
  940   2HZ   LYS  32           HZ2      LYS  32 155.180  17.735  12.256
  941   3HZ   LYS  32           HZ1      LYS  32 153.675  17.695  11.469
  942    H    LYS  33           HN       LYS  33 155.589  14.455   4.563
  943    HA   LYS  33           HA       LYS  33 153.812  16.701   4.255
  944   1HB   LYS  33           HB2      LYS  33 154.931  14.746   2.230
  945   2HB   LYS  33           HB1      LYS  33 153.994  16.177   1.794
  946   1HG   LYS  33           HG2      LYS  33 155.634  17.608   2.953
  947   2HG   LYS  33           HG1      LYS  33 156.574  16.181   3.388
  948   1HD   LYS  33           HD2      LYS  33 156.906  15.668   0.996
  949   2HD   LYS  33           HD1      LYS  33 155.969  17.099   0.562
  950   1HE   LYS  33           HE2      LYS  33 158.386  17.581   0.476
  951   2HE   LYS  33           HE1      LYS  33 157.601  18.530   1.739
  952   1HZ   LYS  33           HZ2      LYS  33 158.277  16.822   3.345
  953   2HZ   LYS  33           HZ1      LYS  33 159.112  16.003   2.113
  954   3HZ   LYS  33           HZ3      LYS  33 159.611  17.553   2.588
  955    H    LEU  34           HN       LEU  34 153.376  13.211   3.634
  956    HA   LEU  34           HA       LEU  34 150.698  13.446   2.637
  957   1HB   LEU  34           HB2      LEU  34 152.145  11.173   4.026
  958   2HB   LEU  34           HB1      LEU  34 150.535  11.013   3.339
  959    HG   LEU  34           HG       LEU  34 152.926  11.949   1.738
  960   1HD1  LEU  34          HD11      LEU  34 151.773   9.176   2.122
  961   2HD1  LEU  34          HD13      LEU  34 152.832   9.602   0.778
  962   3HD1  LEU  34          HD12      LEU  34 153.425   9.706   2.435
  963   1HD2  LEU  34          HD22      LEU  34 150.063  11.206   1.099
  964   2HD2  LEU  34          HD21      LEU  34 151.000  12.594   0.551
  965   3HD2  LEU  34          HD23      LEU  34 151.316  11.001  -0.122
  966    H    GLU  35           HN       GLU  35 152.032  13.049   5.876
  967    HA   GLU  35           HA       GLU  35 149.570  12.709   7.279
  968   1HB   GLU  35           HB2      GLU  35 151.779  12.356   8.328
  969   2HB   GLU  35           HB1      GLU  35 152.107  14.085   8.221
  970   1HG   GLU  35           HG2      GLU  35 150.207  14.567   9.696
  971   2HG   GLU  35           HG1      GLU  35 149.805  12.852   9.764
  972    H    GLU  36           HN       GLU  36 151.291  15.666   6.335
  973    HA   GLU  36           HA       GLU  36 149.494  17.474   7.658
  974   1HB   GLU  36           HB2      GLU  36 151.741  18.148   6.884
  975   2HB   GLU  36           HB1      GLU  36 151.230  17.927   5.211
  976   1HG   GLU  36           HG2      GLU  36 149.536  19.675   5.462
  977   2HG   GLU  36           HG1      GLU  36 149.950  19.859   7.167
  978    H    ARG  37           HN       ARG  37 149.269  15.644   4.727
  979    HA   ARG  37           HA       ARG  37 147.093  17.358   3.670
  980   1HB   ARG  37           HB2      ARG  37 148.413  14.859   2.595
  981   2HB   ARG  37           HB1      ARG  37 147.046  15.649   1.806
  982   1HG   ARG  37           HG2      ARG  37 148.407  17.792   1.817
  983   2HG   ARG  37           HG1      ARG  37 149.783  16.828   2.351
  984   1HD   ARG  37           HD2      ARG  37 149.909  17.035  -0.054
  985   2HD   ARG  37           HD1      ARG  37 149.446  15.372   0.321
  986    HE   ARG  37           HE       ARG  37 147.015  16.604   0.001
  987   1HH1  ARG  37          HH21      ARG  37 149.947  16.543  -1.812
  988   2HH1  ARG  37          HH22      ARG  37 149.153  16.633  -3.350
  989   1HH2  ARG  37          HH11      ARG  37 145.963  16.725  -1.995
  990   2HH2  ARG  37          HH12      ARG  37 146.898  16.736  -3.453
  991    H    GLY  38           HN       GLY  38 147.119  15.133   6.080
  992   1HA   GLY  38           HA2      GLY  38 145.004  14.511   7.100
  993   2HA   GLY  38           HA1      GLY  38 144.268  14.427   5.509
  994    H    PHE  39           HN       PHE  39 147.295  12.894   5.398
  995    HA   PHE  39           HA       PHE  39 145.965  10.222   5.706
  996   1HB   PHE  39           HB2      PHE  39 148.512  11.048   4.301
  997   2HB   PHE  39           HB1      PHE  39 147.923   9.393   4.402
  998    HD1  PHE  39           HD2      PHE  39 145.855   8.728   3.231
  999    HD2  PHE  39           HD1      PHE  39 147.490  12.676   2.848
 1000    HE1  PHE  39           HE2      PHE  39 144.408   9.131   1.257
 1001    HE2  PHE  39           HE1      PHE  39 146.047  13.085   0.873
 1002    HZ   PHE  39           HZ       PHE  39 144.499  11.307   0.074
 1003    H    ASP  40           HN       ASP  40 146.248  10.757   8.104
 1004    HA   ASP  40           HA       ASP  40 148.968  10.766   9.139
 1005   1HB   ASP  40           HB2      ASP  40 147.894  10.757  11.342
 1006   2HB   ASP  40           HB1      ASP  40 147.130  11.948  10.289
 1007    H    LYS  41           HN       LYS  41 146.926   8.263   8.055
 1008    HA   LYS  41           HA       LYS  41 148.666   6.284   9.467
 1009   1HB   LYS  41           HB2      LYS  41 145.650   6.113   9.258
 1010   2HB   LYS  41           HB1      LYS  41 146.706   4.852   9.904
 1011   1HG   LYS  41           HG2      LYS  41 147.573   6.494  11.577
 1012   2HG   LYS  41           HG1      LYS  41 146.403   7.669  10.982
 1013   1HD   LYS  41           HD2      LYS  41 144.570   6.079  11.555
 1014   2HD   LYS  41           HD1      LYS  41 145.781   4.993  12.241
 1015   1HE   LYS  41           HE2      LYS  41 145.328   7.849  13.146
 1016   2HE   LYS  41           HE1      LYS  41 144.710   6.421  13.979
 1017   1HZ   LYS  41           HZ1      LYS  41 147.370   5.909  13.576
 1018   2HZ   LYS  41           HZ3      LYS  41 147.328   7.545  14.026
 1019   3HZ   LYS  41           HZ2      LYS  41 146.641   6.369  15.041
 1020    H    ALA  42           HN       ALA  42 148.777   4.215   8.419
 1021    HA   ALA  42           HA       ALA  42 149.140   4.429   5.596
 1022   1HB   ALA  42           HB3      ALA  42 149.078   2.052   7.456
 1023   2HB   ALA  42           HB2      ALA  42 149.485   1.924   5.745
 1024   3HB   ALA  42           HB1      ALA  42 150.493   2.891   6.822
 1025    H    TYR  43           HN       TYR  43 146.507   2.825   7.441
 1026    HA   TYR  43           HA       TYR  43 145.352   1.593   5.166
 1027   1HB   TYR  43           HB2      TYR  43 143.300   1.333   6.432
 1028   2HB   TYR  43           HB1      TYR  43 144.688   0.993   7.457
 1029    HD1  TYR  43           HD1      TYR  43 142.264   3.687   6.541
 1030    HD2  TYR  43           HD2      TYR  43 144.977   2.144   9.488
 1031    HE1  TYR  43           HE1      TYR  43 141.442   5.354   8.169
 1032    HE2  TYR  43           HE2      TYR  43 144.150   3.815  11.119
 1033    HH   TYR  43           HH       TYR  43 142.055   6.426  10.178
 1034    H    VAL  44           HN       VAL  44 145.393   4.948   5.958
 1035    HA   VAL  44           HA       VAL  44 142.995   5.585   4.383
 1036    HB   VAL  44           HB       VAL  44 145.284   7.431   5.152
 1037   1HG1  VAL  44          HG13      VAL  44 143.606   8.129   3.348
 1038   2HG1  VAL  44          HG12      VAL  44 142.382   8.099   4.614
 1039   3HG1  VAL  44          HG11      VAL  44 143.745   9.212   4.731
 1040   1HG2  VAL  44          HG21      VAL  44 142.747   6.682   6.633
 1041   2HG2  VAL  44          HG23      VAL  44 144.410   6.483   7.192
 1042   3HG2  VAL  44          HG22      VAL  44 143.721   8.099   7.028
 1043    H    VAL  45           HN       VAL  45 146.402   5.234   3.962
 1044    HA   VAL  45           HA       VAL  45 146.499   6.267   1.217
 1045    HB   VAL  45           HB       VAL  45 148.498   4.600   2.782
 1046   1HG1  VAL  45          HG11      VAL  45 148.684   6.052   0.129
 1047   2HG1  VAL  45          HG13      VAL  45 150.091   5.486   1.030
 1048   3HG1  VAL  45          HG12      VAL  45 148.910   4.328   0.421
 1049   1HG2  VAL  45          HG22      VAL  45 148.236   7.575   2.265
 1050   2HG2  VAL  45          HG21      VAL  45 148.177   6.757   3.826
 1051   3HG2  VAL  45          HG23      VAL  45 149.689   6.823   2.921
 1052    H    LEU  46           HN       LEU  46 146.277   3.124   2.825
 1053    HA   LEU  46           HA       LEU  46 146.549   1.472   0.507
 1054   1HB   LEU  46           HB2      LEU  46 146.500   0.612   2.873
 1055   2HB   LEU  46           HB1      LEU  46 144.787   1.006   2.944
 1056    HG   LEU  46           HG       LEU  46 144.556  -0.494   0.839
 1057   1HD1  LEU  46          HD11      LEU  46 147.318  -1.245   1.795
 1058   2HD1  LEU  46          HD13      LEU  46 146.308  -2.357   0.871
 1059   3HD1  LEU  46          HD12      LEU  46 146.802  -0.822   0.163
 1060   1HD2  LEU  46          HD21      LEU  46 145.006  -1.386   3.665
 1061   2HD2  LEU  46          HD23      LEU  46 143.526  -1.379   2.713
 1062   3HD2  LEU  46          HD22      LEU  46 144.751  -2.610   2.422
 1063    H    GLY  47           HN       GLY  47 143.847   3.191   1.968
 1064   1HA   GLY  47           HA2      GLY  47 141.743   2.187   0.339
 1065   2HA   GLY  47           HA1      GLY  47 141.731   3.760   1.135
 1066    H    GLN  48           HN       GLN  48 143.939   4.974  -0.184
 1067    HA   GLN  48           HA       GLN  48 142.700   5.905  -2.582
 1068   1HB   GLN  48           HB2      GLN  48 144.522   7.085  -1.267
 1069   2HB   GLN  48           HB1      GLN  48 145.672   5.954  -1.980
 1070   1HG   GLN  48           HG2      GLN  48 145.691   7.936  -3.348
 1071   2HG   GLN  48           HG1      GLN  48 144.836   6.686  -4.256
 1072   1HE2  GLN  48          HE22      GLN  48 142.202   9.002  -4.674
 1073   2HE2  GLN  48          HE21      GLN  48 143.358   8.012  -5.424
 1074    H    PHE  49           HN       PHE  49 145.204   3.462  -2.012
 1075    HA   PHE  49           HA       PHE  49 145.785   2.833  -4.730
 1076   1HB   PHE  49           HB2      PHE  49 147.127   2.066  -2.793
 1077   2HB   PHE  49           HB1      PHE  49 145.798   1.025  -2.291
 1078    HD1  PHE  49           HD1      PHE  49 147.848   1.773  -5.343
 1079    HD2  PHE  49           HD2      PHE  49 145.851  -1.209  -2.983
 1080    HE1  PHE  49           HE1      PHE  49 148.703   0.005  -6.856
 1081    HE2  PHE  49           HE2      PHE  49 146.703  -2.975  -4.491
 1082    HZ   PHE  49           HZ       PHE  49 148.129  -2.371  -6.432
 1083    H    LEU  50           HN       LEU  50 143.330   1.619  -2.494
 1084    HA   LEU  50           HA       LEU  50 142.246  -0.343  -4.338
 1085   1HB   LEU  50           HB2      LEU  50 140.893   1.056  -2.005
 1086   2HB   LEU  50           HB1      LEU  50 140.267  -0.364  -2.840
 1087    HG   LEU  50           HG       LEU  50 142.921  -0.236  -1.376
 1088   1HD1  LEU  50          HD11      LEU  50 140.859  -0.141   0.071
 1089   2HD1  LEU  50          HD13      LEU  50 140.378  -1.695  -0.611
 1090   3HD1  LEU  50          HD12      LEU  50 141.859  -1.570   0.340
 1091   1HD2  LEU  50          HD23      LEU  50 141.519  -2.358  -2.996
 1092   2HD2  LEU  50          HD22      LEU  50 143.227  -1.917  -2.981
 1093   3HD2  LEU  50          HD21      LEU  50 142.549  -2.840  -1.646
 1094    H    VAL  51           HN       VAL  51 141.527   3.049  -3.668
 1095    HA   VAL  51           HA       VAL  51 139.207   3.241  -5.334
 1096    HB   VAL  51           HB       VAL  51 141.226   5.308  -4.424
 1097   1HG1  VAL  51          HG13      VAL  51 138.665   5.621  -6.005
 1098   2HG1  VAL  51          HG12      VAL  51 139.374   6.940  -5.074
 1099   3HG1  VAL  51          HG11      VAL  51 140.269   6.228  -6.416
 1100   1HG2  VAL  51          HG21      VAL  51 139.752   4.168  -2.728
 1101   2HG2  VAL  51          HG23      VAL  51 139.501   5.910  -2.832
 1102   3HG2  VAL  51          HG22      VAL  51 138.354   4.805  -3.592
 1103    H    LEU  52           HN       LEU  52 142.638   3.263  -6.069
 1104    HA   LEU  52           HA       LEU  52 142.174   4.257  -8.820
 1105   1HB   LEU  52           HB2      LEU  52 144.685   3.324  -7.404
 1106   2HB   LEU  52           HB1      LEU  52 144.644   3.965  -9.044
 1107    HG   LEU  52           HG       LEU  52 143.660   5.472  -6.603
 1108   1HD1  LEU  52          HD13      LEU  52 146.325   5.423  -8.017
 1109   2HD1  LEU  52          HD12      LEU  52 145.797   6.849  -7.126
 1110   3HD1  LEU  52          HD11      LEU  52 145.993   5.310  -6.289
 1111   1HD2  LEU  52          HD21      LEU  52 143.881   6.100  -9.546
 1112   2HD2  LEU  52          HD23      LEU  52 142.584   6.488  -8.415
 1113   3HD2  LEU  52          HD22      LEU  52 144.085   7.404  -8.376
 1114    H    LYS  53           HN       LYS  53 141.351   1.453  -7.598
 1115    HA   LYS  53           HA       LYS  53 141.321  -0.769  -8.364
 1116   1HB   LYS  53           HB2      LYS  53 141.390   0.833 -10.926
 1117   2HB   LYS  53           HB1      LYS  53 141.091  -0.905 -10.883
 1118   1HG   LYS  53           HG2      LYS  53 139.178  -0.501  -9.331
 1119   2HG   LYS  53           HG1      LYS  53 139.435   1.233  -9.507
 1120   1HD   LYS  53           HD2      LYS  53 139.011  -0.543 -11.914
 1121   2HD   LYS  53           HD1      LYS  53 137.649   0.124 -11.019
 1122   1HE   LYS  53           HE2      LYS  53 138.666   2.417 -11.350
 1123   2HE   LYS  53           HE1      LYS  53 139.841   1.670 -12.429
 1124   1HZ   LYS  53           HZ2      LYS  53 136.893   1.554 -12.755
 1125   2HZ   LYS  53           HZ1      LYS  53 137.942   2.560 -13.636
 1126   3HZ   LYS  53           HZ3      LYS  53 138.041   0.874 -13.807
 1127    H    LYS  54           HN       LYS  54 143.927   0.052  -7.622
 1128    HA   LYS  54           HA       LYS  54 146.154  -0.641  -7.793
 1129   1HB   LYS  54           HB2      LYS  54 144.972  -2.726  -9.658
 1130   2HB   LYS  54           HB1      LYS  54 146.576  -2.778  -8.943
 1131   1HG   LYS  54           HG2      LYS  54 145.585  -2.814  -6.692
 1132   2HG   LYS  54           HG1      LYS  54 143.971  -2.751  -7.396
 1133   1HD   LYS  54           HD2      LYS  54 144.393  -4.882  -8.564
 1134   2HD   LYS  54           HD1      LYS  54 146.008  -4.952  -7.855
 1135   1HE   LYS  54           HE2      LYS  54 144.977  -4.938  -5.587
 1136   2HE   LYS  54           HE1      LYS  54 143.382  -4.975  -6.337
 1137   1HZ   LYS  54           HZ1      LYS  54 144.139  -7.040  -7.500
 1138   2HZ   LYS  54           HZ3      LYS  54 145.504  -7.038  -6.492
 1139   3HZ   LYS  54           HZ2      LYS  54 143.952  -7.192  -5.817
 1140    H    ASP  55           HN       ASP  55 144.886   1.233  -9.945
 1141    HA   ASP  55           HA       ASP  55 146.365   0.701 -12.371
 1142   1HB   ASP  55           HB2      ASP  55 145.165   3.236 -11.232
 1143   2HB   ASP  55           HB1      ASP  55 145.921   3.159 -12.826
 1144    H    GLU  56           HN       GLU  56 148.549   0.608 -12.375
 1145    HA   GLU  56           HA       GLU  56 150.240   1.729 -10.366
 1146   1HB   GLU  56           HB2      GLU  56 150.761  -0.248 -11.802
 1147   2HB   GLU  56           HB1      GLU  56 151.009   0.855 -13.155
 1148   1HG   GLU  56           HG2      GLU  56 152.819   1.971 -11.981
 1149   2HG   GLU  56           HG1      GLU  56 152.514   1.016 -10.530
 1150    H    ASP  57           HN       ASP  57 149.501   2.907 -13.660
 1151    HA   ASP  57           HA       ASP  57 151.423   5.059 -13.549
 1152   1HB   ASP  57           HB2      ASP  57 148.975   4.609 -15.269
 1153   2HB   ASP  57           HB1      ASP  57 150.062   5.983 -15.478
 1154    H    LEU  58           HN       LEU  58 147.983   4.846 -12.789
 1155    HA   LEU  58           HA       LEU  58 147.715   7.693 -12.279
 1156   1HB   LEU  58           HB2      LEU  58 146.038   5.389 -11.239
 1157   2HB   LEU  58           HB1      LEU  58 145.595   7.089 -11.144
 1158    HG   LEU  58           HG       LEU  58 146.104   5.577 -13.727
 1159   1HD1  LEU  58          HD12      LEU  58 144.053   4.844 -12.508
 1160   2HD1  LEU  58          HD11      LEU  58 143.492   6.515 -12.499
 1161   3HD1  LEU  58          HD13      LEU  58 143.679   5.655 -14.028
 1162   1HD2  LEU  58          HD23      LEU  58 145.360   8.427 -13.057
 1163   2HD2  LEU  58          HD22      LEU  58 146.527   7.834 -14.238
 1164   3HD2  LEU  58          HD21      LEU  58 144.804   7.712 -14.570
 1165    H    PHE  59           HN       PHE  59 148.466   4.886 -10.259
 1166    HA   PHE  59           HA       PHE  59 148.466   6.289  -7.752
 1167   1HB   PHE  59           HB2      PHE  59 148.430   3.846  -7.838
 1168   2HB   PHE  59           HB1      PHE  59 149.998   3.825  -8.641
 1169    HD1  PHE  59           HD1      PHE  59 148.274   4.857  -5.490
 1170    HD2  PHE  59           HD2      PHE  59 152.007   3.886  -7.385
 1171    HE1  PHE  59           HE1      PHE  59 149.398   4.861  -3.279
 1172    HE2  PHE  59           HE2      PHE  59 153.131   3.894  -5.174
 1173    HZ   PHE  59           HZ       PHE  59 151.827   4.380  -3.122
 1174    H    ARG  60           HN       ARG  60 151.102   5.541 -10.056
 1175    HA   ARG  60           HA       ARG  60 153.183   6.761  -8.562
 1176   1HB   ARG  60           HB2      ARG  60 152.834   6.352 -11.536
 1177   2HB   ARG  60           HB1      ARG  60 154.297   7.051 -10.846
 1178   1HG   ARG  60           HG2      ARG  60 154.594   5.030  -9.447
 1179   2HG   ARG  60           HG1      ARG  60 153.149   4.325 -10.172
 1180   1HD   ARG  60           HD2      ARG  60 154.180   4.347 -12.375
 1181   2HD   ARG  60           HD1      ARG  60 155.582   5.210 -11.750
 1182    HE   ARG  60           HE       ARG  60 155.465   2.888 -10.223
 1183   1HH1  ARG  60          HH21      ARG  60 155.516   3.691 -13.575
 1184   2HH1  ARG  60          HH22      ARG  60 156.374   2.261 -14.042
 1185   1HH2  ARG  60          HH11      ARG  60 156.594   1.019 -10.812
 1186   2HH2  ARG  60          HH12      ARG  60 156.984   0.749 -12.478
 1187    H    GLU  61           HN       GLU  61 151.102   8.217 -11.113
 1188    HA   GLU  61           HA       GLU  61 152.352  10.791 -10.976
 1189   1HB   GLU  61           HB2      GLU  61 150.890  10.112 -12.845
 1190   2HB   GLU  61           HB1      GLU  61 149.508  10.067 -11.750
 1191   1HG   GLU  61           HG2      GLU  61 149.703  12.446 -11.316
 1192   2HG   GLU  61           HG1      GLU  61 151.196  12.535 -12.254
 1193    H    TRP  62           HN       TRP  62 149.635   9.338  -9.197
 1194    HA   TRP  62           HA       TRP  62 148.852  11.731  -7.845
 1195   1HB   TRP  62           HB2      TRP  62 147.330   9.888  -7.814
 1196   2HB   TRP  62           HB1      TRP  62 148.548   8.805  -7.142
 1197    HD1  TRP  62           HD1      TRP  62 146.251  11.710  -6.169
 1198    HE1  TRP  62           HE1      TRP  62 146.089  11.811  -3.596
 1199    HE3  TRP  62           HE3      TRP  62 149.742   8.199  -4.931
 1200    HZ2  TRP  62           HZ2      TRP  62 147.303  10.567  -1.306
 1201    HZ3  TRP  62           HZ3      TRP  62 150.213   7.670  -2.560
 1202    HH2  TRP  62           HH2      TRP  62 149.001   8.849  -0.747
 1203    H    LEU  63           HN       LEU  63 151.067   9.115  -6.805
 1204    HA   LEU  63           HA       LEU  63 151.633  10.338  -4.273
 1205   1HB   LEU  63           HB2      LEU  63 152.049   7.956  -4.692
 1206   2HB   LEU  63           HB1      LEU  63 153.265   8.368  -5.897
 1207    HG   LEU  63           HG       LEU  63 154.633   9.453  -4.165
 1208   1HD1  LEU  63          HD11      LEU  63 152.250   8.796  -2.444
 1209   2HD1  LEU  63          HD13      LEU  63 153.853   8.899  -1.719
 1210   3HD1  LEU  63          HD12      LEU  63 153.168  10.298  -2.540
 1211   1HD2  LEU  63          HD21      LEU  63 154.928   7.046  -4.616
 1212   2HD2  LEU  63          HD23      LEU  63 155.243   7.411  -2.920
 1213   3HD2  LEU  63          HD22      LEU  63 153.715   6.669  -3.395
 1214    H    LYS  64           HN       LYS  64 153.390  10.386  -7.359
 1215    HA   LYS  64           HA       LYS  64 155.577  11.972  -6.440
 1216   1HB   LYS  64           HB2      LYS  64 155.589  10.755  -8.600
 1217   2HB   LYS  64           HB1      LYS  64 154.387  11.885  -9.226
 1218   1HG   LYS  64           HG2      LYS  64 155.944  13.757  -8.898
 1219   2HG   LYS  64           HG1      LYS  64 157.142  12.655  -8.216
 1220   1HD   LYS  64           HD2      LYS  64 157.267  11.438 -10.333
 1221   2HD   LYS  64           HD1      LYS  64 156.012  12.469 -11.023
 1222   1HE   LYS  64           HE2      LYS  64 158.622  13.549  -9.935
 1223   2HE   LYS  64           HE1      LYS  64 158.387  13.127 -11.631
 1224   1HZ   LYS  64           HZ2      LYS  64 156.290  14.766 -10.538
 1225   2HZ   LYS  64           HZ1      LYS  64 157.811  15.524 -10.532
 1226   3HZ   LYS  64           HZ3      LYS  64 157.161  14.940 -11.986
 1227    H    ASP  65           HN       ASP  65 152.525  12.947  -7.992
 1228    HA   ASP  65           HA       ASP  65 153.111  15.770  -7.870
 1229   1HB   ASP  65           HB2      ASP  65 150.509  14.244  -8.156
 1230   2HB   ASP  65           HB1      ASP  65 150.614  16.002  -8.233
 1231    H    THR  66           HN       THR  66 151.729  13.467  -5.622
 1232    HA   THR  66           HA       THR  66 150.577  15.463  -3.878
 1233    HB   THR  66           HB       THR  66 151.275  12.553  -3.371
 1234    HG1  THR  66           HG1      THR  66 149.335  13.819  -4.751
 1235   1HG2  THR  66          HG21      THR  66 150.934  14.002  -1.294
 1236   2HG2  THR  66          HG23      THR  66 149.292  14.272  -1.867
 1237   3HG2  THR  66          HG22      THR  66 149.827  12.646  -1.467
 1238    H    CYS  67           HN       CYS  67 153.721  13.731  -3.916
 1239    HA   CYS  67           HA       CYS  67 154.593  15.589  -1.714
 1240   1HB   CYS  67           HB2      CYS  67 155.959  13.714  -0.834
 1241   2HB   CYS  67           HB1      CYS  67 154.229  13.378  -0.775
 1242    HG   CYS  67           HG       CYS  67 155.002  11.297  -1.952
 1243    H    GLY  68           HN       GLY  68 155.522  13.846  -4.649
 1244   1HA   GLY  68           HA2      GLY  68 157.157  14.896  -6.158
 1245   2HA   GLY  68           HA1      GLY  68 158.022  15.500  -4.742
 1246    H    ALA  69           HN       ALA  69 156.762  12.313  -4.460
 1247    HA   ALA  69           HA       ALA  69 159.200  11.072  -3.861
 1248   1HB   ALA  69           HB2      ALA  69 156.977  10.057  -3.439
 1249   2HB   ALA  69           HB1      ALA  69 156.778   9.799  -5.173
 1250   3HB   ALA  69           HB3      ALA  69 158.045   8.944  -4.292
 1251    H    ASN  70           HN       ASN  70 160.629   9.716  -5.108
 1252    HA   ASN  70           HA       ASN  70 160.857  10.571  -7.928
 1253   1HB   ASN  70           HB2      ASN  70 162.841  10.557  -6.409
 1254   2HB   ASN  70           HB1      ASN  70 162.679   8.806  -6.266
 1255   1HD2  ASN  70          HD21      ASN  70 162.470  11.051  -9.093
 1256   2HD2  ASN  70          HD22      ASN  70 163.607  10.206 -10.028
 1257    H    ALA  71           HN       ALA  71 161.525   8.777  -9.498
 1258    HA   ALA  71           HA       ALA  71 159.412   6.905  -9.777
 1259   1HB   ALA  71           HB3      ALA  71 162.159   7.058 -11.023
 1260   2HB   ALA  71           HB2      ALA  71 160.989   5.819 -11.473
 1261   3HB   ALA  71           HB1      ALA  71 160.616   7.522 -11.737
 1262    H    LYS  72           HN       LYS  72 162.617   6.527  -8.260
 1263    HA   LYS  72           HA       LYS  72 162.433   3.655  -8.076
 1264   1HB   LYS  72           HB2      LYS  72 164.049   5.653  -6.468
 1265   2HB   LYS  72           HB1      LYS  72 164.278   3.909  -6.408
 1266   1HG   LYS  72           HG2      LYS  72 164.391   5.402  -9.032
 1267   2HG   LYS  72           HG1      LYS  72 165.808   5.292  -7.991
 1268   1HD   LYS  72           HD2      LYS  72 165.505   2.770  -8.009
 1269   2HD   LYS  72           HD1      LYS  72 164.282   3.000  -9.259
 1270   1HE   LYS  72           HE2      LYS  72 165.899   4.053 -10.728
 1271   2HE   LYS  72           HE1      LYS  72 167.128   4.012  -9.464
 1272   1HZ   LYS  72           HZ1      LYS  72 165.817   1.610 -10.615
 1273   2HZ   LYS  72           HZ3      LYS  72 167.340   2.190 -11.086
 1274   3HZ   LYS  72           HZ2      LYS  72 167.099   1.631  -9.499
 1275    H    GLN  73           HN       GLN  73 161.677   6.274  -5.791
 1276    HA   GLN  73           HA       GLN  73 160.991   4.526  -3.629
 1277   1HB   GLN  73           HB2      GLN  73 160.187   7.390  -4.214
 1278   2HB   GLN  73           HB1      GLN  73 159.842   6.560  -2.697
 1279   1HG   GLN  73           HG2      GLN  73 162.623   6.928  -3.856
 1280   2HG   GLN  73           HG1      GLN  73 161.925   7.945  -2.596
 1281   1HE2  GLN  73          HE22      GLN  73 161.731   4.734  -0.521
 1282   2HE2  GLN  73          HE21      GLN  73 160.516   5.618  -1.310
 1283    H    SER  74           HN       SER  74 159.136   5.786  -6.353
 1284    HA   SER  74           HA       SER  74 156.556   5.083  -5.300
 1285   1HB   SER  74           HB2      SER  74 155.732   5.564  -7.462
 1286   2HB   SER  74           HB1      SER  74 157.131   6.621  -7.298
 1287    HG   SER  74           HG       SER  74 157.151   5.483  -9.279
 1288    H    ARG  75           HN       ARG  75 158.969   3.323  -7.243
 1289    HA   ARG  75           HA       ARG  75 157.346   1.087  -7.902
 1290   1HB   ARG  75           HB2      ARG  75 160.331   1.346  -7.483
 1291   2HB   ARG  75           HB1      ARG  75 159.565  -0.128  -8.078
 1292   1HG   ARG  75           HG2      ARG  75 158.617   1.099  -9.973
 1293   2HG   ARG  75           HG1      ARG  75 159.307   2.603  -9.370
 1294   1HD   ARG  75           HD2      ARG  75 160.720   1.642 -11.148
 1295   2HD   ARG  75           HD1      ARG  75 161.575   1.659  -9.605
 1296    HE   ARG  75           HE       ARG  75 160.404  -0.847  -9.669
 1297   1HH1  ARG  75          HH21      ARG  75 162.386   1.036 -11.766
 1298   2HH1  ARG  75          HH22      ARG  75 163.187  -0.334 -12.460
 1299   1HH2  ARG  75          HH11      ARG  75 161.437  -2.649 -10.560
 1300   2HH2  ARG  75          HH12      ARG  75 162.649  -2.421 -11.777
 1301    H    ASP  76           HN       ASP  76 159.320   1.737  -4.998
 1302    HA   ASP  76           HA       ASP  76 158.976  -0.862  -3.871
 1303   1HB   ASP  76           HB2      ASP  76 159.557   1.829  -2.622
 1304   2HB   ASP  76           HB1      ASP  76 159.558   0.321  -1.708
 1305    H    CYS  77           HN       CYS  77 157.030   2.123  -3.529
 1306    HA   CYS  77           HA       CYS  77 155.291   1.001  -1.519
 1307   1HB   CYS  77           HB2      CYS  77 154.974   3.316  -3.442
 1308   2HB   CYS  77           HB1      CYS  77 153.771   2.905  -2.220
 1309    HG   CYS  77           HG       CYS  77 155.810   3.222  -0.436
 1310    H    PHE  78           HN       PHE  78 155.089   1.194  -5.093
 1311    HA   PHE  78           HA       PHE  78 152.412   0.254  -5.286
 1312   1HB   PHE  78           HB2      PHE  78 153.634   1.199  -7.200
 1313   2HB   PHE  78           HB1      PHE  78 154.714  -0.195  -7.207
 1314    HD1  PHE  78           HD1      PHE  78 151.291   0.987  -7.907
 1315    HD2  PHE  78           HD2      PHE  78 153.951  -2.381  -7.949
 1316    HE1  PHE  78           HE1      PHE  78 149.679  -0.270  -9.315
 1317    HE2  PHE  78           HE2      PHE  78 152.343  -3.635  -9.362
 1318    HZ   PHE  78           HZ       PHE  78 150.207  -2.578 -10.043
 1319    H    GLY  79           HN       GLY  79 155.394  -1.680  -5.746
 1320   1HA   GLY  79           HA2      GLY  79 154.066  -4.190  -5.732
 1321   2HA   GLY  79           HA1      GLY  79 155.777  -3.956  -5.383
 1322    H    CYS  80           HN       CYS  80 155.254  -2.191  -3.073
 1323    HA   CYS  80           HA       CYS  80 155.048  -4.262  -1.061
 1324   1HB   CYS  80           HB2      CYS  80 156.332  -2.170  -0.705
 1325   2HB   CYS  80           HB1      CYS  80 154.823  -1.256  -0.728
 1326    HG   CYS  80           HG       CYS  80 154.525  -3.382   1.336
 1327    H    LEU  81           HN       LEU  81 152.820  -1.658  -2.111
 1328    HA   LEU  81           HA       LEU  81 150.726  -2.505  -0.304
 1329   1HB   LEU  81           HB2      LEU  81 150.677  -0.817  -2.826
 1330   2HB   LEU  81           HB1      LEU  81 149.270  -1.072  -1.794
 1331    HG   LEU  81           HG       LEU  81 151.903   0.065  -0.806
 1332   1HD1  LEU  81          HD13      LEU  81 150.809   1.532  -2.498
 1333   2HD1  LEU  81          HD12      LEU  81 149.352   1.547  -1.505
 1334   3HD1  LEU  81          HD11      LEU  81 150.844   2.259  -0.892
 1335   1HD2  LEU  81          HD22      LEU  81 149.211  -0.464   0.437
 1336   2HD2  LEU  81          HD21      LEU  81 150.821  -0.689   1.118
 1337   3HD2  LEU  81          HD23      LEU  81 150.134   0.929   0.993
 1338    H    ARG  82           HN       ARG  82 151.537  -3.204  -3.692
 1339    HA   ARG  82           HA       ARG  82 149.197  -4.662  -4.378
 1340   1HB   ARG  82           HB2      ARG  82 151.057  -3.928  -5.947
 1341   2HB   ARG  82           HB1      ARG  82 151.996  -5.291  -5.340
 1342   1HG   ARG  82           HG2      ARG  82 149.781  -6.658  -5.949
 1343   2HG   ARG  82           HG1      ARG  82 149.514  -5.299  -7.037
 1344   1HD   ARG  82           HD2      ARG  82 151.712  -7.347  -7.066
 1345   2HD   ARG  82           HD1      ARG  82 150.732  -6.748  -8.403
 1346    HE   ARG  82           HE       ARG  82 152.184  -4.528  -7.628
 1347   1HH1  ARG  82          HH21      ARG  82 152.890  -7.807  -8.424
 1348   2HH1  ARG  82          HH22      ARG  82 154.443  -7.449  -9.103
 1349   1HH2  ARG  82          HH11      ARG  82 154.212  -4.044  -8.519
 1350   2HH2  ARG  82          HH12      ARG  82 155.190  -5.321  -9.157
 1351    H    GLU  83           HN       GLU  83 152.239  -5.779  -2.891
 1352    HA   GLU  83           HA       GLU  83 151.408  -8.548  -2.836
 1353   1HB   GLU  83           HB2      GLU  83 153.660  -7.001  -1.573
 1354   2HB   GLU  83           HB1      GLU  83 153.326  -8.638  -1.016
 1355   1HG   GLU  83           HG2      GLU  83 154.957  -8.873  -2.737
 1356   2HG   GLU  83           HG1      GLU  83 153.437  -9.349  -3.483
 1357    H    TRP  84           HN       TRP  84 151.148  -5.901  -0.446
 1358    HA   TRP  84           HA       TRP  84 150.318  -7.536   1.740
 1359   1HB   TRP  84           HB2      TRP  84 150.907  -5.081   1.869
 1360   2HB   TRP  84           HB1      TRP  84 149.350  -4.728   1.120
 1361    HD1  TRP  84           HD1      TRP  84 150.941  -5.817   4.371
 1362    HE1  TRP  84           HE1      TRP  84 149.139  -5.907   6.217
 1363    HE3  TRP  84           HE3      TRP  84 146.739  -5.178   1.540
 1364    HZ2  TRP  84           HZ2      TRP  84 146.301  -5.736   6.458
 1365    HZ3  TRP  84           HZ3      TRP  84 144.502  -5.147   2.603
 1366    HH2  TRP  84           HH2      TRP  84 144.276  -5.425   5.059
 1367    H    CYS  85           HN       CYS  85 148.504  -5.948  -0.866
 1368    HA   CYS  85           HA       CYS  85 145.896  -6.775  -0.036
 1369   1HB   CYS  85           HB2      CYS  85 147.043  -6.097  -2.752
 1370   2HB   CYS  85           HB1      CYS  85 145.341  -6.493  -2.516
 1371    HG   CYS  85           HG       CYS  85 145.983  -4.376  -0.541
 1372    H    ASP  86           HN       ASP  86 148.332  -8.327  -2.086
 1373    HA   ASP  86           HA       ASP  86 146.775 -10.540  -2.956
 1374   1HB   ASP  86           HB2      ASP  86 149.747 -10.262  -2.446
 1375   2HB   ASP  86           HB1      ASP  86 149.022 -11.693  -3.179
 1376    H    ALA  87           HN       ALA  87 148.521  -9.970   0.065
 1377    HA   ALA  87           HA       ALA  87 148.087 -12.730   0.974
 1378   1HB   ALA  87           HB2      ALA  87 150.083 -11.176   1.558
 1379   2HB   ALA  87           HB1      ALA  87 148.986 -10.451   2.733
 1380   3HB   ALA  87           HB3      ALA  87 149.395 -12.164   2.844
 1381    H    PHE  88           HN       PHE  88 146.736  -9.513   1.697
 1382    HA   PHE  88           HA       PHE  88 144.769 -10.807   3.546
 1383   1HB   PHE  88           HB2      PHE  88 145.499  -7.904   3.082
 1384   2HB   PHE  88           HB1      PHE  88 144.233  -8.447   4.185
 1385    HD1  PHE  88           HD2      PHE  88 144.821  -9.908   6.137
 1386    HD2  PHE  88           HD1      PHE  88 147.817  -8.066   3.670
 1387    HE1  PHE  88           HE2      PHE  88 146.520 -10.315   7.896
 1388    HE2  PHE  88           HE1      PHE  88 149.517  -8.472   5.431
 1389    HZ   PHE  88           HZ       PHE  88 148.866  -9.595   7.544
 1390    H    LEU  89           HN       LEU  89 144.250  -7.866   1.643
 1391    HA   LEU  89           HA       LEU  89 141.658  -8.947   0.742
 1392   1HB   LEU  89           HB2      LEU  89 141.620  -6.683   1.562
 1393   2HB   LEU  89           HB1      LEU  89 142.973  -6.223   0.534
 1394    HG   LEU  89           HG       LEU  89 141.613  -6.486  -1.468
 1395   1HD1  LEU  89          HD12      LEU  89 139.599  -7.606   0.487
 1396   2HD1  LEU  89          HD11      LEU  89 139.106  -6.977  -1.086
 1397   3HD1  LEU  89          HD13      LEU  89 140.214  -8.344  -0.991
 1398   1HD2  LEU  89          HD22      LEU  89 141.448  -4.365  -0.120
 1399   2HD2  LEU  89          HD21      LEU  89 140.022  -4.695  -1.106
 1400   3HD2  LEU  89          HD23      LEU  89 139.990  -5.016   0.629
   
  No H/Q in entry =        1400
  Start of MODEL   14
    1   1H    MET   1           HT1      MET   1 114.347  -9.156  10.870
    2   2H    MET   1           HT3      MET   1 113.308 -10.456  11.194
    3   3H    MET   1           HT2      MET   1 112.877  -8.886  11.679
    4    HA   MET   1           HA       MET   1 114.204  -8.900  13.487
    5   1HB   MET   1           HB2      MET   1 113.874 -11.862  12.917
    6   2HB   MET   1           HB1      MET   1 114.249 -11.163  14.491
    7   1HG   MET   1           HG2      MET   1 111.788 -10.420  12.893
    8   2HG   MET   1           HG1      MET   1 111.792 -11.685  14.121
    9   1HE   MET   1           HE2      MET   1 112.677 -11.520  16.251
   10   2HE   MET   1           HE1      MET   1 113.668 -10.152  16.746
   11   3HE   MET   1           HE3      MET   1 112.016 -10.316  17.352
   12    H    THR   2           HN       THR   2 115.556 -11.841  11.979
   13    HA   THR   2           HA       THR   2 118.252 -10.998  12.734
   14    HB   THR   2           HB       THR   2 118.959 -13.138  11.856
   15    HG1  THR   2           HG1      THR   2 117.116 -14.401  10.868
   16   1HG2  THR   2          HG21      THR   2 117.748 -13.174  14.009
   17   2HG2  THR   2          HG23      THR   2 116.227 -13.401  13.144
   18   3HG2  THR   2          HG22      THR   2 117.468 -14.654  13.091
   19    H    THR   3           HN       THR   3 120.020 -10.853  11.126
   20    HA   THR   3           HA       THR   3 119.249  -9.177   8.870
   21    HB   THR   3           HB       THR   3 121.684  -9.094   8.418
   22    HG1  THR   3           HG1      THR   3 122.954 -10.551   9.226
   23   1HG2  THR   3          HG22      THR   3 120.584  -7.692  10.224
   24   2HG2  THR   3          HG21      THR   3 121.162  -8.881  11.392
   25   3HG2  THR   3          HG23      THR   3 122.316  -7.952  10.435
   26    H    SER   4           HN       SER   4 119.988  -9.680   6.625
   27    HA   SER   4           HA       SER   4 119.041 -12.242   5.755
   28   1HB   SER   4           HB2      SER   4 119.058 -10.207   4.315
   29   2HB   SER   4           HB1      SER   4 120.818 -10.275   4.274
   30    HG   SER   4           HG       SER   4 120.736 -12.028   3.034
   31    H    GLN   5           HN       GLN   5 120.238 -14.007   4.917
   32    HA   GLN   5           HA       GLN   5 122.533 -14.765   6.390
   33   1HB   GLN   5           HB2      GLN   5 122.724 -16.627   4.770
   34   2HB   GLN   5           HB1      GLN   5 121.060 -16.401   5.311
   35   1HG   GLN   5           HG2      GLN   5 120.567 -15.110   3.267
   36   2HG   GLN   5           HG1      GLN   5 122.229 -15.338   2.720
   37   1HE2  GLN   5          HE22      GLN   5 121.627 -18.569   1.463
   38   2HE2  GLN   5          HE21      GLN   5 122.703 -17.265   1.614
   39    H    LYS   6           HN       LYS   6 122.296 -12.753   3.576
   40    HA   LYS   6           HA       LYS   6 124.886 -13.231   2.467
   41   1HB   LYS   6           HB2      LYS   6 123.096 -10.795   2.434
   42   2HB   LYS   6           HB1      LYS   6 124.606 -10.902   1.528
   43   1HG   LYS   6           HG2      LYS   6 123.763 -12.901   0.348
   44   2HG   LYS   6           HG1      LYS   6 122.250 -12.791   1.250
   45   1HD   LYS   6           HD2      LYS   6 121.838 -10.553   0.294
   46   2HD   LYS   6           HD1      LYS   6 123.348 -10.665  -0.611
   47   1HE   LYS   6           HE2      LYS   6 122.491 -12.673  -1.778
   48   2HE   LYS   6           HE1      LYS   6 120.970 -12.522  -0.899
   49   1HZ   LYS   6           HZ3      LYS   6 120.665 -10.332  -1.876
   50   2HZ   LYS   6           HZ2      LYS   6 122.126 -10.487  -2.729
   51   3HZ   LYS   6           HZ1      LYS   6 120.819 -11.513  -3.084
   52    H    HIS   7           HN       HIS   7 123.712 -11.093   5.038
   53    HA   HIS   7           HA       HIS   7 126.053  -9.533   5.365
   54   1HB   HIS   7           HB2      HIS   7 123.987  -8.946   6.509
   55   2HB   HIS   7           HB1      HIS   7 124.018 -10.459   7.414
   56    HD2  HIS   7           HD2      HIS   7 125.705 -10.464   9.664
   57    HE1  HIS   7           HE1      HIS   7 127.187  -6.538   9.190
   58    HE2  HIS   7           HE2      HIS   7 127.113  -8.549  10.735
   59    H    ARG   8           HN       ARG   8 125.145 -12.556   7.061
   60    HA   ARG   8           HA       ARG   8 127.639 -12.724   8.473
   61   1HB   ARG   8           HB2      ARG   8 125.494 -14.777   7.858
   62   2HB   ARG   8           HB1      ARG   8 126.888 -15.104   8.892
   63   1HG   ARG   8           HG2      ARG   8 126.212 -13.099  10.280
   64   2HG   ARG   8           HG1      ARG   8 124.725 -13.036   9.343
   65   1HD   ARG   8           HD2      ARG   8 125.690 -15.351  11.031
   66   2HD   ARG   8           HD1      ARG   8 124.348 -14.284  11.420
   67    HE   ARG   8           HE       ARG   8 124.279 -16.634   9.745
   68   1HH1  ARG   8          HH21      ARG   8 123.070 -13.398   9.873
   69   2HH1  ARG   8          HH22      ARG   8 121.789 -13.710   8.751
   70   1HH2  ARG   8          HH11      ARG   8 122.613 -17.043   8.315
   71   2HH2  ARG   8          HH12      ARG   8 121.529 -15.767   7.874
   72    H    ASP   9           HN       ASP   9 126.516 -13.839   5.352
   73    HA   ASP   9           HA       ASP   9 128.742 -15.649   4.913
   74   1HB   ASP   9           HB2      ASP   9 126.727 -14.411   3.041
   75   2HB   ASP   9           HB1      ASP   9 127.962 -15.547   2.513
   76    H    PHE  10           HN       PHE  10 128.046 -12.260   4.048
   77    HA   PHE  10           HA       PHE  10 130.356 -11.949   2.367
   78   1HB   PHE  10           HB2      PHE  10 128.398 -10.388   2.397
   79   2HB   PHE  10           HB1      PHE  10 128.933  -9.808   3.974
   80    HD1  PHE  10           HD1      PHE  10 129.707  -9.929   0.369
   81    HD2  PHE  10           HD2      PHE  10 130.940  -8.436   4.206
   82    HE1  PHE  10           HE1      PHE  10 131.282  -8.369  -0.744
   83    HE2  PHE  10           HE2      PHE  10 132.517  -6.877   3.092
   84    HZ   PHE  10           HZ       PHE  10 132.688  -6.845   0.617
   85    H    VAL  11           HN       VAL  11 129.842 -11.425   5.859
   86    HA   VAL  11           HA       VAL  11 132.622 -10.511   6.199
   87    HB   VAL  11           HB       VAL  11 132.064 -10.378   8.574
   88   1HG1  VAL  11          HG13      VAL  11 129.809  -9.395   6.796
   89   2HG1  VAL  11          HG12      VAL  11 130.144  -8.812   8.424
   90   3HG1  VAL  11          HG11      VAL  11 131.312  -8.535   7.132
   91   1HG2  VAL  11          HG23      VAL  11 129.668 -11.980   7.683
   92   2HG2  VAL  11          HG22      VAL  11 130.770 -12.297   9.021
   93   3HG2  VAL  11          HG21      VAL  11 129.592 -10.992   9.143
   94    H    ALA  12           HN       ALA  12 131.760 -13.335   5.239
   95    HA   ALA  12           HA       ALA  12 133.362 -14.900   7.246
   96   1HB   ALA  12           HB1      ALA  12 131.078 -15.786   5.464
   97   2HB   ALA  12           HB3      ALA  12 132.084 -16.886   6.406
   98   3HB   ALA  12           HB2      ALA  12 131.073 -15.695   7.225
   99    H    GLU  13           HN       GLU  13 133.367 -13.668   4.085
  100    HA   GLU  13           HA       GLU  13 135.659 -15.401   3.425
  101   1HB   GLU  13           HB2      GLU  13 134.666 -15.852   1.116
  102   2HB   GLU  13           HB1      GLU  13 133.935 -16.739   2.452
  103   1HG   GLU  13           HG2      GLU  13 132.048 -15.311   2.508
  104   2HG   GLU  13           HG1      GLU  13 132.835 -14.088   1.512
  105    HA   PRO  14           HA       PRO  14 137.409 -11.714   1.644
  106   1HB   PRO  14           HB2      PRO  14 137.760 -13.309  -0.882
  107   2HB   PRO  14           HB1      PRO  14 138.939 -12.307  -0.011
  108   1HG   PRO  14           HG2      PRO  14 138.970 -14.983   0.147
  109   2HG   PRO  14           HG1      PRO  14 139.410 -13.955   1.523
  110   1HD   PRO  14           HD2      PRO  14 136.966 -15.604   1.129
  111   2HD   PRO  14           HD1      PRO  14 137.722 -15.042   2.634
  112    H    MET  15           HN       MET  15 136.899 -10.056  -0.010
  113    HA   MET  15           HA       MET  15 134.109 -10.293  -0.970
  114   1HB   MET  15           HB2      MET  15 134.540  -7.875  -1.694
  115   2HB   MET  15           HB1      MET  15 134.597  -8.185   0.041
  116   1HG   MET  15           HG2      MET  15 136.967  -8.121   0.087
  117   2HG   MET  15           HG1      MET  15 137.087  -8.283  -1.665
  118   1HE   MET  15           HE1      MET  15 135.571  -6.333   1.166
  119   2HE   MET  15           HE3      MET  15 137.229  -5.723   1.237
  120   3HE   MET  15           HE2      MET  15 135.905  -4.637   0.820
  121    H    GLY  16           HN       GLY  16 137.333 -10.554  -2.175
  122   1HA   GLY  16           HA2      GLY  16 138.184 -10.832  -4.345
  123   2HA   GLY  16           HA1      GLY  16 136.667 -11.680  -4.637
  124    H    GLU  17           HN       GLU  17 136.192 -10.906  -6.670
  125    HA   GLU  17           HA       GLU  17 136.120  -7.948  -7.093
  126   1HB   GLU  17           HB2      GLU  17 136.099 -10.296  -9.009
  127   2HB   GLU  17           HB1      GLU  17 135.913  -8.615  -9.514
  128   1HG   GLU  17           HG2      GLU  17 138.093  -8.059  -8.518
  129   2HG   GLU  17           HG1      GLU  17 138.280  -9.727  -7.978
  130    H    LYS  18           HN       LYS  18 134.022  -9.492  -5.601
  131    HA   LYS  18           HA       LYS  18 131.726  -9.896  -7.227
  132   1HB   LYS  18           HB2      LYS  18 132.036  -9.124  -4.316
  133   2HB   LYS  18           HB1      LYS  18 130.462  -9.441  -5.038
  134   1HG   LYS  18           HG2      LYS  18 132.667 -11.473  -5.371
  135   2HG   LYS  18           HG1      LYS  18 131.791 -11.397  -3.844
  136   1HD   LYS  18           HD2      LYS  18 129.646 -11.630  -5.102
  137   2HD   LYS  18           HD1      LYS  18 130.570 -11.819  -6.591
  138   1HE   LYS  18           HE2      LYS  18 129.998 -14.024  -5.730
  139   2HE   LYS  18           HE1      LYS  18 131.736 -13.777  -5.567
  140   1HZ   LYS  18           HZ2      LYS  18 129.847 -13.152  -3.379
  141   2HZ   LYS  18           HZ1      LYS  18 130.527 -14.699  -3.568
  142   3HZ   LYS  18           HZ3      LYS  18 131.531 -13.360  -3.290
  143    HA   PRO  19           HA       PRO  19 130.660  -5.742  -8.354
  144   1HB   PRO  19           HB2      PRO  19 127.918  -5.918  -8.568
  145   2HB   PRO  19           HB1      PRO  19 129.040  -6.619  -9.752
  146   1HG   PRO  19           HG2      PRO  19 127.610  -7.953  -7.491
  147   2HG   PRO  19           HG1      PRO  19 127.853  -8.515  -9.156
  148   1HD   PRO  19           HD2      PRO  19 129.376  -9.428  -7.102
  149   2HD   PRO  19           HD1      PRO  19 130.033  -9.229  -8.741
  150    H    VAL  20           HN       VAL  20 129.615  -3.784  -7.604
  151    HA   VAL  20           HA       VAL  20 129.730  -3.358  -4.826
  152    HB   VAL  20           HB       VAL  20 129.897  -1.509  -6.379
  153   1HG1  VAL  20          HG13      VAL  20 128.219  -2.547  -8.016
  154   2HG1  VAL  20          HG12      VAL  20 126.957  -1.844  -7.005
  155   3HG1  VAL  20          HG11      VAL  20 128.126  -0.798  -7.810
  156   1HG2  VAL  20          HG22      VAL  20 128.833  -1.204  -4.050
  157   2HG2  VAL  20          HG21      VAL  20 128.571   0.088  -5.221
  158   3HG2  VAL  20          HG23      VAL  20 127.293  -1.085  -4.900
  159    H    GLY  21           HN       GLY  21 126.866  -3.999  -6.836
  160   1HA   GLY  21           HA2      GLY  21 124.914  -3.629  -4.807
  161   2HA   GLY  21           HA1      GLY  21 124.690  -4.640  -6.232
  162    H    SER  22           HN       SER  22 127.385  -5.888  -4.790
  163    HA   SER  22           HA       SER  22 125.842  -8.107  -3.645
  164   1HB   SER  22           HB2      SER  22 127.909  -8.523  -4.955
  165   2HB   SER  22           HB1      SER  22 128.837  -7.632  -3.753
  166    HG   SER  22           HG       SER  22 127.192  -9.842  -3.099
  167    H    LEU  23           HN       LEU  23 127.508  -5.265  -2.523
  168    HA   LEU  23           HA       LEU  23 128.030  -6.088   0.164
  169   1HB   LEU  23           HB2      LEU  23 127.446  -3.354  -1.010
  170   2HB   LEU  23           HB1      LEU  23 127.988  -3.609   0.646
  171    HG   LEU  23           HG       LEU  23 129.510  -4.611  -1.780
  172   1HD1  LEU  23          HD12      LEU  23 129.714  -2.014  -0.243
  173   2HD1  LEU  23          HD11      LEU  23 131.052  -2.650  -1.201
  174   3HD1  LEU  23          HD13      LEU  23 129.526  -2.238  -1.982
  175   1HD2  LEU  23          HD21      LEU  23 130.048  -4.488   1.193
  176   2HD2  LEU  23          HD23      LEU  23 130.302  -5.828   0.076
  177   3HD2  LEU  23          HD22      LEU  23 131.395  -4.449   0.057
  178    H    ALA  24           HN       ALA  24 126.754  -6.130   1.957
  179    HA   ALA  24           HA       ALA  24 123.912  -6.346   1.630
  180   1HB   ALA  24           HB3      ALA  24 125.632  -6.050   4.104
  181   2HB   ALA  24           HB2      ALA  24 123.893  -6.342   4.158
  182   3HB   ALA  24           HB1      ALA  24 124.967  -7.539   3.434
  183    H    GLY  25           HN       GLY  25 122.319  -4.877   1.856
  184   1HA   GLY  25           HA2      GLY  25 121.336  -2.834   2.791
  185   2HA   GLY  25           HA1      GLY  25 122.958  -2.152   2.927
  186    H    ILE  26           HN       ILE  26 123.458  -3.372   0.122
  187    HA   ILE  26           HA       ILE  26 122.350  -1.040  -1.387
  188    HB   ILE  26           HB       ILE  26 124.482  -3.041  -2.204
  189   1HG1  ILE  26          HG12      ILE  26 125.277  -1.805  -0.268
  190   2HG1  ILE  26          HG11      ILE  26 126.075  -1.169  -1.703
  191   1HG2  ILE  26          HG21      ILE  26 123.329  -1.865  -4.064
  192   2HG2  ILE  26          HG23      ILE  26 123.758  -0.321  -3.330
  193   3HG2  ILE  26          HG22      ILE  26 125.022  -1.393  -3.931
  194   1HD1  ILE  26          HD11      ILE  26 124.104   0.560  -1.729
  195   2HD1  ILE  26          HD13      ILE  26 123.898   0.082  -0.044
  196   3HD1  ILE  26          HD12      ILE  26 125.422   0.782  -0.581
  197    H    GLY  27           HN       GLY  27 120.541  -1.457  -2.634
  198   1HA   GLY  27           HA2      GLY  27 119.885  -4.279  -3.276
  199   2HA   GLY  27           HA1      GLY  27 118.798  -2.899  -3.435
  200    H    GLU  28           HN       GLU  28 118.830  -4.475  -5.596
  201    HA   GLU  28           HA       GLU  28 120.874  -4.078  -7.516
  202   1HB   GLU  28           HB2      GLU  28 117.901  -4.548  -7.861
  203   2HB   GLU  28           HB1      GLU  28 119.037  -4.535  -9.209
  204   1HG   GLU  28           HG2      GLU  28 120.316  -6.359  -8.174
  205   2HG   GLU  28           HG1      GLU  28 119.221  -6.361  -6.793
  206    H    VAL  29           HN       VAL  29 118.009  -2.075  -6.807
  207    HA   VAL  29           HA       VAL  29 118.446  -0.259  -8.998
  208    HB   VAL  29           HB       VAL  29 116.959   0.039  -6.376
  209   1HG1  VAL  29          HG13      VAL  29 117.259   1.950  -8.703
  210   2HG1  VAL  29          HG12      VAL  29 115.889   2.026  -7.594
  211   3HG1  VAL  29          HG11      VAL  29 117.529   2.275  -6.991
  212   1HG2  VAL  29          HG21      VAL  29 116.104  -1.580  -8.097
  213   2HG2  VAL  29          HG23      VAL  29 114.989  -0.253  -7.770
  214   3HG2  VAL  29          HG22      VAL  29 115.976  -0.237  -9.232
  215    H    LEU  30           HN       LEU  30 119.345  -0.104  -5.556
  216    HA   LEU  30           HA       LEU  30 120.703   2.419  -5.765
  217   1HB   LEU  30           HB2      LEU  30 121.116   0.164  -3.777
  218   2HB   LEU  30           HB1      LEU  30 121.710   1.813  -3.588
  219    HG   LEU  30           HG       LEU  30 118.782   1.078  -3.902
  220   1HD1  LEU  30          HD11      LEU  30 120.407   1.744  -1.428
  221   2HD1  LEU  30          HD13      LEU  30 118.648   1.620  -1.467
  222   3HD1  LEU  30          HD12      LEU  30 119.639   0.199  -1.794
  223   1HD2  LEU  30          HD22      LEU  30 120.291   3.657  -3.456
  224   2HD2  LEU  30          HD21      LEU  30 118.962   3.329  -4.566
  225   3HD2  LEU  30          HD23      LEU  30 118.649   3.485  -2.840
  226    H    GLY  31           HN       GLY  31 121.763  -0.940  -6.106
  227   1HA   GLY  31           HA2      GLY  31 124.562  -0.442  -6.226
  228   2HA   GLY  31           HA1      GLY  31 123.753  -1.809  -6.996
  229    H    LYS  32           HN       LYS  32 122.048  -0.300  -8.734
  230    HA   LYS  32           HA       LYS  32 123.829   0.101 -10.940
  231   1HB   LYS  32           HB2      LYS  32 121.384  -0.495 -11.104
  232   2HB   LYS  32           HB1      LYS  32 121.014   1.185 -10.707
  233   1HG   LYS  32           HG2      LYS  32 122.449   1.887 -12.659
  234   2HG   LYS  32           HG1      LYS  32 122.595   0.186 -13.096
  235   1HD   LYS  32           HD2      LYS  32 119.994   1.731 -12.873
  236   2HD   LYS  32           HD1      LYS  32 120.793   1.280 -14.377
  237   1HE   LYS  32           HE2      LYS  32 120.662  -1.158 -13.436
  238   2HE   LYS  32           HE1      LYS  32 119.426  -0.493 -12.365
  239   1HZ   LYS  32           HZ3      LYS  32 118.948   0.439 -14.959
  240   2HZ   LYS  32           HZ2      LYS  32 119.167  -1.244 -15.042
  241   3HZ   LYS  32           HZ1      LYS  32 117.983  -0.588 -14.015
  242    H    LYS  33           HN       LYS  33 122.269   2.442  -8.724
  243    HA   LYS  33           HA       LYS  33 123.090   4.755 -10.204
  244   1HB   LYS  33           HB2      LYS  33 122.496   4.408  -7.250
  245   2HB   LYS  33           HB1      LYS  33 122.754   5.969  -8.026
  246   1HG   LYS  33           HG2      LYS  33 120.856   5.530  -9.547
  247   2HG   LYS  33           HG1      LYS  33 120.595   3.968  -8.768
  248   1HD   LYS  33           HD2      LYS  33 120.190   5.107  -6.614
  249   2HD   LYS  33           HD1      LYS  33 120.444   6.668  -7.394
  250   1HE   LYS  33           HE2      LYS  33 118.276   4.674  -8.117
  251   2HE   LYS  33           HE1      LYS  33 118.036   6.160  -7.202
  252   1HZ   LYS  33           HZ3      LYS  33 119.270   7.122  -9.333
  253   2HZ   LYS  33           HZ2      LYS  33 118.506   5.783 -10.047
  254   3HZ   LYS  33           HZ1      LYS  33 117.584   6.962  -9.243
  255    H    LEU  34           HN       LEU  34 124.634   3.047  -7.459
  256    HA   LEU  34           HA       LEU  34 126.893   4.799  -7.294
  257   1HB   LEU  34           HB2      LEU  34 126.573   1.878  -6.550
  258   2HB   LEU  34           HB1      LEU  34 128.015   2.814  -6.191
  259    HG   LEU  34           HG       LEU  34 125.241   3.623  -5.282
  260   1HD1  LEU  34          HD12      LEU  34 127.421   2.119  -3.800
  261   2HD1  LEU  34          HD11      LEU  34 125.956   2.761  -3.058
  262   3HD1  LEU  34          HD13      LEU  34 125.845   1.480  -4.264
  263   1HD2  LEU  34          HD21      LEU  34 128.046   4.648  -4.788
  264   2HD2  LEU  34          HD23      LEU  34 126.581   5.558  -5.156
  265   3HD2  LEU  34          HD22      LEU  34 126.806   4.866  -3.556
  266    H    GLU  35           HN       GLU  35 126.213   1.944  -9.243
  267    HA   GLU  35           HA       GLU  35 128.819   1.576 -10.346
  268   1HB   GLU  35           HB2      GLU  35 127.004  -0.069 -10.641
  269   2HB   GLU  35           HB1      GLU  35 126.133   1.070 -11.668
  270   1HG   GLU  35           HG2      GLU  35 127.946   1.042 -13.305
  271   2HG   GLU  35           HG1      GLU  35 128.912   0.000 -12.257
  272    H    GLU  36           HN       GLU  36 126.160   3.684 -11.392
  273    HA   GLU  36           HA       GLU  36 127.496   4.627 -13.771
  274   1HB   GLU  36           HB2      GLU  36 125.281   5.806 -12.072
  275   2HB   GLU  36           HB1      GLU  36 125.840   6.535 -13.578
  276   1HG   GLU  36           HG2      GLU  36 125.306   4.452 -14.789
  277   2HG   GLU  36           HG1      GLU  36 124.743   3.722 -13.285
  278    H    ARG  37           HN       ARG  37 127.849   5.269 -10.421
  279    HA   ARG  37           HA       ARG  37 129.153   7.889 -10.853
  280   1HB   ARG  37           HB2      ARG  37 128.717   6.260  -8.340
  281   2HB   ARG  37           HB1      ARG  37 129.383   7.889  -8.381
  282   1HG   ARG  37           HG2      ARG  37 126.676   7.199  -9.547
  283   2HG   ARG  37           HG1      ARG  37 126.876   7.691  -7.871
  284   1HD   ARG  37           HD2      ARG  37 127.484   9.321 -10.354
  285   2HD   ARG  37           HD1      ARG  37 126.296   9.659  -9.107
  286    HE   ARG  37           HE       ARG  37 128.701   9.611  -7.728
  287   1HH1  ARG  37          HH21      ARG  37 127.438  11.206 -10.511
  288   2HH1  ARG  37          HH22      ARG  37 128.384  12.640 -10.284
  289   1HH2  ARG  37          HH11      ARG  37 129.944  11.474  -7.415
  290   2HH2  ARG  37          HH12      ARG  37 129.802  12.792  -8.532
  291    H    GLY  38           HN       GLY  38 130.185   4.769 -11.278
  292   1HA   GLY  38           HA2      GLY  38 132.495   4.387 -11.920
  293   2HA   GLY  38           HA1      GLY  38 133.011   5.611 -10.772
  294    H    PHE  39           HN       PHE  39 130.705   3.634  -9.279
  295    HA   PHE  39           HA       PHE  39 132.891   2.047  -7.965
  296   1HB   PHE  39           HB2      PHE  39 130.075   2.704  -7.074
  297   2HB   PHE  39           HB1      PHE  39 131.203   1.708  -6.161
  298    HD1  PHE  39           HD1      PHE  39 130.397   5.092  -7.308
  299    HD2  PHE  39           HD2      PHE  39 133.166   2.700  -5.083
  300    HE1  PHE  39           HE1      PHE  39 131.384   7.149  -6.345
  301    HE2  PHE  39           HE2      PHE  39 134.166   4.756  -4.115
  302    HZ   PHE  39           HZ       PHE  39 133.275   6.982  -4.747
  303    H    ASP  40           HN       ASP  40 132.756   0.707 -10.011
  304    HA   ASP  40           HA       ASP  40 130.326  -0.873 -10.406
  305   1HB   ASP  40           HB2      ASP  40 131.617  -1.968 -12.192
  306   2HB   ASP  40           HB1      ASP  40 131.753  -0.213 -12.308
  307    H    LYS  41           HN       LYS  41 133.021  -1.154  -8.318
  308    HA   LYS  41           HA       LYS  41 132.281  -4.007  -7.798
  309   1HB   LYS  41           HB2      LYS  41 135.114  -2.940  -7.980
  310   2HB   LYS  41           HB1      LYS  41 134.662  -4.574  -7.485
  311   1HG   LYS  41           HG2      LYS  41 133.545  -4.921  -9.669
  312   2HG   LYS  41           HG1      LYS  41 134.036  -3.303 -10.168
  313   1HD   LYS  41           HD2      LYS  41 136.419  -3.964  -9.864
  314   2HD   LYS  41           HD1      LYS  41 135.882  -5.595  -9.457
  315   1HE   LYS  41           HE2      LYS  41 136.408  -5.706 -11.766
  316   2HE   LYS  41           HE1      LYS  41 134.651  -5.578 -11.715
  317   1HZ   LYS  41           HZ1      LYS  41 136.479  -3.262 -12.042
  318   2HZ   LYS  41           HZ3      LYS  41 135.724  -4.063 -13.332
  319   3HZ   LYS  41           HZ2      LYS  41 134.784  -3.255 -12.171
  320    H    ALA  42           HN       ALA  42 132.745  -4.717  -5.649
  321    HA   ALA  42           HA       ALA  42 132.011  -2.812  -3.660
  322   1HB   ALA  42           HB3      ALA  42 133.170  -5.592  -3.412
  323   2HB   ALA  42           HB2      ALA  42 132.524  -4.667  -2.056
  324   3HB   ALA  42           HB1      ALA  42 131.465  -5.142  -3.385
  325    H    TYR  43           HN       TYR  43 135.247  -4.233  -4.347
  326    HA   TYR  43           HA       TYR  43 136.475  -3.108  -2.048
  327   1HB   TYR  43           HB2      TYR  43 138.608  -3.538  -3.049
  328   2HB   TYR  43           HB1      TYR  43 137.530  -4.857  -3.483
  329    HD1  TYR  43           HD1      TYR  43 138.934  -1.626  -4.745
  330    HD2  TYR  43           HD2      TYR  43 137.168  -5.412  -5.742
  331    HE1  TYR  43           HE1      TYR  43 139.432  -1.226  -7.138
  332    HE2  TYR  43           HE2      TYR  43 137.673  -5.011  -8.134
  333    HH   TYR  43           HH       TYR  43 139.224  -3.681  -9.489
  334    H    VAL  44           HN       VAL  44 135.446  -1.489  -4.934
  335    HA   VAL  44           HA       VAL  44 137.279   0.777  -4.564
  336    HB   VAL  44           HB       VAL  44 134.684   0.602  -6.146
  337   1HG1  VAL  44          HG11      VAL  44 135.426   2.928  -5.543
  338   2HG1  VAL  44          HG13      VAL  44 136.958   2.599  -6.348
  339   3HG1  VAL  44          HG12      VAL  44 135.460   2.614  -7.275
  340   1HG2  VAL  44          HG21      VAL  44 137.585   0.187  -6.907
  341   2HG2  VAL  44          HG23      VAL  44 136.252  -0.955  -7.080
  342   3HG2  VAL  44          HG22      VAL  44 136.316   0.484  -8.095
  343    H    VAL  45           HN       VAL  45 134.135  -0.249  -3.590
  344    HA   VAL  45           HA       VAL  45 133.293   2.276  -2.388
  345    HB   VAL  45           HB       VAL  45 132.270  -0.559  -2.037
  346   1HG1  VAL  45          HG12      VAL  45 131.274   2.098  -0.990
  347   2HG1  VAL  45          HG11      VAL  45 130.235   0.677  -1.114
  348   3HG1  VAL  45          HG13      VAL  45 131.653   0.644  -0.066
  349   1HG2  VAL  45          HG22      VAL  45 131.440   1.800  -3.738
  350   2HG2  VAL  45          HG21      VAL  45 131.831   0.163  -4.263
  351   3HG2  VAL  45          HG23      VAL  45 130.336   0.473  -3.381
  352    H    LEU  46           HN       LEU  46 134.813  -0.729  -1.251
  353    HA   LEU  46           HA       LEU  46 134.763  -0.117   1.537
  354   1HB   LEU  46           HB2      LEU  46 135.428  -2.348   0.669
  355   2HB   LEU  46           HB1      LEU  46 136.876  -1.637  -0.040
  356    HG   LEU  46           HG       LEU  46 137.614  -0.940   2.237
  357   1HD1  LEU  46          HD11      LEU  46 135.001  -2.220   2.994
  358   2HD1  LEU  46          HD13      LEU  46 136.344  -2.240   4.137
  359   3HD1  LEU  46          HD12      LEU  46 135.706  -0.704   3.559
  360   1HD2  LEU  46          HD21      LEU  46 137.898  -3.403   1.098
  361   2HD2  LEU  46          HD23      LEU  46 138.643  -2.941   2.626
  362   3HD2  LEU  46          HD22      LEU  46 137.136  -3.850   2.625
  363    H    GLY  47           HN       GLY  47 136.963   0.734  -1.076
  364   1HA   GLY  47           HA2      GLY  47 139.017   1.987   0.405
  365   2HA   GLY  47           HA1      GLY  47 138.564   2.446  -1.236
  366    H    GLN  48           HN       GLN  48 135.933   3.379  -0.801
  367    HA   GLN  48           HA       GLN  48 136.415   6.039   0.108
  368   1HB   GLN  48           HB2      GLN  48 134.528   5.301  -1.402
  369   2HB   GLN  48           HB1      GLN  48 133.733   4.624   0.019
  370   1HG   GLN  48           HG2      GLN  48 132.835   6.842  -0.358
  371   2HG   GLN  48           HG1      GLN  48 133.849   6.899   1.085
  372   1HE2  GLN  48          HE22      GLN  48 135.937   9.373  -0.279
  373   2HE2  GLN  48          HE21      GLN  48 135.329   8.593   1.101
  374    H    PHE  49           HN       PHE  49 134.944   3.238   1.732
  375    HA   PHE  49           HA       PHE  49 134.223   4.522   4.172
  376   1HB   PHE  49           HB2      PHE  49 133.481   2.252   3.532
  377   2HB   PHE  49           HB1      PHE  49 135.135   1.666   3.684
  378    HD1  PHE  49           HD1      PHE  49 132.487   3.457   5.643
  379    HD2  PHE  49           HD2      PHE  49 135.849   0.785   5.740
  380    HE1  PHE  49           HE1      PHE  49 132.097   3.051   8.059
  381    HE2  PHE  49           HE2      PHE  49 135.460   0.383   8.155
  382    HZ   PHE  49           HZ       PHE  49 133.584   1.515   9.314
  383    H    LEU  50           HN       LEU  50 137.222   3.016   3.095
  384    HA   LEU  50           HA       LEU  50 138.610   3.334   5.618
  385   1HB   LEU  50           HB2      LEU  50 139.739   3.132   2.808
  386   2HB   LEU  50           HB1      LEU  50 140.679   2.976   4.290
  387    HG   LEU  50           HG       LEU  50 138.344   1.192   3.536
  388   1HD1  LEU  50          HD11      LEU  50 141.332   0.680   3.432
  389   2HD1  LEU  50          HD13      LEU  50 140.078  -0.519   3.112
  390   3HD1  LEU  50          HD12      LEU  50 140.268   0.867   2.040
  391   1HD2  LEU  50          HD23      LEU  50 140.218   1.330   5.895
  392   2HD2  LEU  50          HD22      LEU  50 138.475   1.059   5.874
  393   3HD2  LEU  50          HD21      LEU  50 139.570  -0.231   5.391
  394    H    VAL  51           HN       VAL  51 138.268   5.375   2.754
  395    HA   VAL  51           HA       VAL  51 140.144   7.383   3.558
  396    HB   VAL  51           HB       VAL  51 137.694   7.547   1.780
  397   1HG1  VAL  51          HG13      VAL  51 139.847   9.563   2.442
  398   2HG1  VAL  51          HG12      VAL  51 138.980   9.619   0.907
  399   3HG1  VAL  51          HG11      VAL  51 138.098   9.790   2.424
  400   1HG2  VAL  51          HG22      VAL  51 139.724   6.052   1.192
  401   2HG2  VAL  51          HG21      VAL  51 139.199   7.215  -0.023
  402   3HG2  VAL  51          HG23      VAL  51 140.611   7.563   0.977
  403    H    LEU  52           HN       LEU  52 136.804   6.772   4.476
  404    HA   LEU  52           HA       LEU  52 136.538   9.418   5.763
  405   1HB   LEU  52           HB2      LEU  52 134.688   7.017   5.747
  406   2HB   LEU  52           HB1      LEU  52 134.293   8.607   6.401
  407    HG   LEU  52           HG       LEU  52 135.055   8.063   3.513
  408   1HD1  LEU  52          HD13      LEU  52 132.375   8.569   4.830
  409   2HD1  LEU  52          HD12      LEU  52 132.639   8.537   3.087
  410   3HD1  LEU  52          HD11      LEU  52 132.888   7.076   4.044
  411   1HD2  LEU  52          HD23      LEU  52 134.348  10.541   5.085
  412   2HD2  LEU  52          HD22      LEU  52 135.598  10.320   3.861
  413   3HD2  LEU  52          HD21      LEU  52 133.912  10.449   3.378
  414    H    LYS  53           HN       LYS  53 138.390   6.981   6.677
  415    HA   LYS  53           HA       LYS  53 139.017   6.055   8.745
  416   1HB   LYS  53           HB2      LYS  53 138.077   8.830   9.509
  417   2HB   LYS  53           HB1      LYS  53 138.971   7.763  10.594
  418   1HG   LYS  53           HG2      LYS  53 140.820   7.647   8.965
  419   2HG   LYS  53           HG1      LYS  53 139.932   8.716   7.878
  420   1HD   LYS  53           HD2      LYS  53 139.954  10.486   9.597
  421   2HD   LYS  53           HD1      LYS  53 140.846   9.420  10.682
  422   1HE   LYS  53           HE2      LYS  53 142.699   9.305   9.068
  423   2HE   LYS  53           HE1      LYS  53 141.806  10.344   7.957
  424   1HZ   LYS  53           HZ3      LYS  53 141.845  11.604  10.438
  425   2HZ   LYS  53           HZ2      LYS  53 143.432  11.083  10.126
  426   3HZ   LYS  53           HZ1      LYS  53 142.630  12.085   9.013
  427    H    LYS  54           HN       LYS  54 136.396   5.261   7.988
  428    HA   LYS  54           HA       LYS  54 134.506   4.207   8.882
  429   1HB   LYS  54           HB2      LYS  54 135.946   4.537  11.532
  430   2HB   LYS  54           HB1      LYS  54 134.657   3.398  11.168
  431   1HG   LYS  54           HG2      LYS  54 136.121   2.375   9.417
  432   2HG   LYS  54           HG1      LYS  54 137.426   3.432   9.941
  433   1HD   LYS  54           HD2      LYS  54 135.971   1.518  11.788
  434   2HD   LYS  54           HD1      LYS  54 137.479   1.122  10.969
  435   1HE   LYS  54           HE2      LYS  54 138.387   3.313  12.047
  436   2HE   LYS  54           HE1      LYS  54 136.990   3.184  13.114
  437   1HZ   LYS  54           HZ1      LYS  54 138.366   0.699  12.821
  438   2HZ   LYS  54           HZ3      LYS  54 139.379   1.913  13.432
  439   3HZ   LYS  54           HZ2      LYS  54 137.931   1.535  14.234
  440    H    ASP  55           HN       ASP  55 134.808   7.330   8.981
  441    HA   ASP  55           HA       ASP  55 133.211   8.124  11.270
  442   1HB   ASP  55           HB2      ASP  55 134.629   9.727  10.028
  443   2HB   ASP  55           HB1      ASP  55 133.609   9.525   8.608
  444    H    GLU  56           HN       GLU  56 131.217   7.223  11.495
  445    HA   GLU  56           HA       GLU  56 129.609   6.174   9.398
  446   1HB   GLU  56           HB2      GLU  56 129.451   5.522  11.789
  447   2HB   GLU  56           HB1      GLU  56 128.708   7.083  12.139
  448   1HG   GLU  56           HG2      GLU  56 126.857   6.561  10.594
  449   2HG   GLU  56           HG1      GLU  56 127.606   5.009  10.217
  450    H    ASP  57           HN       ASP  57 129.411   9.382  10.978
  451    HA   ASP  57           HA       ASP  57 126.925  10.092   9.686
  452   1HB   ASP  57           HB2      ASP  57 129.106  11.776  10.941
  453   2HB   ASP  57           HB1      ASP  57 127.604  12.452  10.308
  454    H    LEU  58           HN       LEU  58 130.305  10.629   8.873
  455    HA   LEU  58           HA       LEU  58 129.703  12.268   6.550
  456   1HB   LEU  58           HB2      LEU  58 132.179  10.652   7.206
  457   2HB   LEU  58           HB1      LEU  58 132.065  11.807   5.885
  458    HG   LEU  58           HG       LEU  58 131.603  12.496   8.805
  459   1HD1  LEU  58          HD12      LEU  58 133.957  11.823   8.288
  460   2HD1  LEU  58          HD11      LEU  58 134.011  13.083   7.057
  461   3HD1  LEU  58          HD13      LEU  58 133.814  13.518   8.755
  462   1HD2  LEU  58          HD22      LEU  58 131.575  14.059   6.225
  463   2HD2  LEU  58          HD21      LEU  58 130.475  14.159   7.600
  464   3HD2  LEU  58          HD23      LEU  58 132.087  14.859   7.710
  465    H    PHE  59           HN       PHE  59 130.246   8.813   7.060
  466    HA   PHE  59           HA       PHE  59 130.182   8.071   4.285
  467   1HB   PHE  59           HB2      PHE  59 131.027   6.499   5.914
  468   2HB   PHE  59           HB1      PHE  59 129.505   6.527   6.802
  469    HD1  PHE  59           HD1      PHE  59 131.128   5.474   3.632
  470    HD2  PHE  59           HD2      PHE  59 127.619   5.230   6.097
  471    HE1  PHE  59           HE1      PHE  59 130.267   3.623   2.222
  472    HE2  PHE  59           HE2      PHE  59 126.757   3.380   4.690
  473    HZ   PHE  59           HZ       PHE  59 128.081   2.577   2.750
  474    H    ARG  60           HN       ARG  60 127.621   8.146   6.781
  475    HA   ARG  60           HA       ARG  60 125.506   7.269   5.103
  476   1HB   ARG  60           HB2      ARG  60 125.499   9.084   7.523
  477   2HB   ARG  60           HB1      ARG  60 124.026   8.507   6.745
  478   1HG   ARG  60           HG2      ARG  60 124.655   6.197   7.168
  479   2HG   ARG  60           HG1      ARG  60 126.206   6.697   7.825
  480   1HD   ARG  60           HD2      ARG  60 124.603   6.205   9.632
  481   2HD   ARG  60           HD1      ARG  60 125.042   7.914   9.634
  482    HE   ARG  60           HE       ARG  60 122.772   7.852   8.070
  483   1HH1  ARG  60          HH21      ARG  60 123.664   6.650  11.173
  484   2HH1  ARG  60          HH22      ARG  60 122.079   6.828  11.847
  485   1HH2  ARG  60          HH11      ARG  60 120.695   8.097   8.931
  486   2HH2  ARG  60          HH12      ARG  60 120.397   7.648  10.578
  487    H    GLU  61           HN       GLU  61 126.584  10.627   5.806
  488    HA   GLU  61           HA       GLU  61 124.575  11.859   4.181
  489   1HB   GLU  61           HB2      GLU  61 125.925  13.118   5.829
  490   2HB   GLU  61           HB1      GLU  61 127.368  12.843   4.854
  491   1HG   GLU  61           HG2      GLU  61 126.385  14.087   2.988
  492   2HG   GLU  61           HG1      GLU  61 124.889  14.304   3.896
  493    H    TRP  62           HN       TRP  62 127.800  10.578   3.463
  494    HA   TRP  62           HA       TRP  62 127.962  11.587   0.793
  495   1HB   TRP  62           HB2      TRP  62 129.969  10.757   1.807
  496   2HB   TRP  62           HB1      TRP  62 129.232   9.188   2.131
  497    HD1  TRP  62           HD1      TRP  62 130.590  11.323  -0.754
  498    HE1  TRP  62           HE1      TRP  62 131.045   9.785  -2.774
  499    HE3  TRP  62           HE3      TRP  62 128.613   6.951   1.005
  500    HZ2  TRP  62           HZ2      TRP  62 130.609   7.052  -3.546
  501    HZ3  TRP  62           HZ3      TRP  62 128.659   4.903  -0.386
  502    HH2  TRP  62           HH2      TRP  62 129.650   4.950  -2.656
  503    H    LEU  63           HN       LEU  63 126.763   8.444   2.013
  504    HA   LEU  63           HA       LEU  63 126.162   7.449  -0.619
  505   1HB   LEU  63           HB2      LEU  63 126.483   5.952   1.306
  506   2HB   LEU  63           HB1      LEU  63 125.050   6.624   2.078
  507    HG   LEU  63           HG       LEU  63 123.677   5.825   0.156
  508   1HD1  LEU  63          HD12      LEU  63 126.368   4.863  -0.789
  509   2HD1  LEU  63          HD11      LEU  63 124.903   4.009  -1.268
  510   3HD1  LEU  63          HD13      LEU  63 125.114   5.704  -1.697
  511   1HD2  LEU  63          HD21      LEU  63 125.377   3.726   1.527
  512   2HD2  LEU  63          HD23      LEU  63 123.890   4.435   2.156
  513   3HD2  LEU  63          HD22      LEU  63 123.840   3.411   0.721
  514    H    LYS  64           HN       LYS  64 124.105   8.899   1.902
  515    HA   LYS  64           HA       LYS  64 121.655   8.704   0.469
  516   1HB   LYS  64           HB2      LYS  64 121.755   9.286   2.865
  517   2HB   LYS  64           HB1      LYS  64 122.498  10.832   2.451
  518   1HG   LYS  64           HG2      LYS  64 120.522  11.548   1.259
  519   2HG   LYS  64           HG1      LYS  64 119.798   9.948   1.401
  520   1HD   LYS  64           HD2      LYS  64 118.758  11.292   3.085
  521   2HD   LYS  64           HD1      LYS  64 119.904  10.250   3.927
  522   1HE   LYS  64           HE2      LYS  64 121.491  12.027   4.162
  523   2HE   LYS  64           HE1      LYS  64 120.615  13.052   3.026
  524   1HZ   LYS  64           HZ3      LYS  64 119.315  12.086   5.487
  525   2HZ   LYS  64           HZ2      LYS  64 120.323  13.454   5.525
  526   3HZ   LYS  64           HZ1      LYS  64 118.936  13.443   4.543
  527    H    ASP  65           HN       ASP  65 123.952  11.420   0.645
  528    HA   ASP  65           HA       ASP  65 122.490  13.040  -1.237
  529   1HB   ASP  65           HB2      ASP  65 125.362  13.119  -0.278
  530   2HB   ASP  65           HB1      ASP  65 124.671  14.326  -1.363
  531    H    THR  66           HN       THR  66 124.849  10.480  -1.568
  532    HA   THR  66           HA       THR  66 125.526  11.162  -4.317
  533    HB   THR  66           HB       THR  66 126.077   8.695  -2.650
  534    HG1  THR  66           HG1      THR  66 127.725  10.827  -3.537
  535   1HG2  THR  66          HG23      THR  66 126.877   9.454  -5.462
  536   2HG2  THR  66          HG22      THR  66 127.828   8.327  -4.495
  537   3HG2  THR  66          HG21      THR  66 126.155   7.944  -4.902
  538    H    CYS  67           HN       CYS  67 123.219   8.871  -2.790
  539    HA   CYS  67           HA       CYS  67 122.190   8.320  -5.564
  540   1HB   CYS  67           HB2      CYS  67 121.884   6.000  -5.015
  541   2HB   CYS  67           HB1      CYS  67 123.555   6.426  -4.643
  542    HG   CYS  67           HG       CYS  67 122.974   6.453  -2.121
  543    H    GLY  68           HN       GLY  68 121.420   8.684  -2.132
  544   1HA   GLY  68           HA2      GLY  68 119.287   9.753  -1.534
  545   2HA   GLY  68           HA1      GLY  68 118.531   8.932  -2.898
  546    H    ALA  69           HN       ALA  69 120.768   6.985  -1.153
  547    HA   ALA  69           HA       ALA  69 118.907   4.983  -0.486
  548   1HB   ALA  69           HB3      ALA  69 121.392   4.708  -0.446
  549   2HB   ALA  69           HB2      ALA  69 121.440   5.652   1.044
  550   3HB   ALA  69           HB1      ALA  69 120.613   4.094   1.013
  551    H    ASN  70           HN       ASN  70 117.895   4.419   1.564
  552    HA   ASN  70           HA       ASN  70 117.104   6.814   3.112
  553   1HB   ASN  70           HB2      ASN  70 115.475   5.025   2.248
  554   2HB   ASN  70           HB1      ASN  70 116.119   3.984   3.517
  555   1HD2  ASN  70          HD22      ASN  70 113.711   5.394   5.686
  556   2HD2  ASN  70          HD21      ASN  70 114.318   3.986   4.957
  557    H    ALA  71           HN       ALA  71 116.838   6.365   5.562
  558    HA   ALA  71           HA       ALA  71 119.425   6.002   6.693
  559   1HB   ALA  71           HB1      ALA  71 117.468   7.311   7.660
  560   2HB   ALA  71           HB3      ALA  71 116.822   5.763   8.206
  561   3HB   ALA  71           HB2      ALA  71 118.380   6.330   8.809
  562    H    LYS  72           HN       LYS  72 116.762   3.668   6.269
  563    HA   LYS  72           HA       LYS  72 117.900   1.749   8.108
  564   1HB   LYS  72           HB2      LYS  72 115.515   1.699   7.436
  565   2HB   LYS  72           HB1      LYS  72 115.999   1.270   5.795
  566   1HG   LYS  72           HG2      LYS  72 116.931  -0.820   6.519
  567   2HG   LYS  72           HG1      LYS  72 116.800  -0.359   8.215
  568   1HD   LYS  72           HD2      LYS  72 114.973  -1.859   7.757
  569   2HD   LYS  72           HD1      LYS  72 114.290  -0.242   7.901
  570   1HE   LYS  72           HE2      LYS  72 115.095  -1.336   5.205
  571   2HE   LYS  72           HE1      LYS  72 113.525  -1.719   5.908
  572   1HZ   LYS  72           HZ1      LYS  72 113.847   0.990   6.251
  573   2HZ   LYS  72           HZ3      LYS  72 114.393   0.684   4.675
  574   3HZ   LYS  72           HZ2      LYS  72 112.826   0.217   5.135
  575    H    GLN  73           HN       GLN  73 118.119   2.129   4.573
  576    HA   GLN  73           HA       GLN  73 119.657  -0.255   4.163
  577   1HB   GLN  73           HB2      GLN  73 119.229   2.254   2.538
  578   2HB   GLN  73           HB1      GLN  73 120.327   0.987   1.990
  579   1HG   GLN  73           HG2      GLN  73 118.124   0.604   1.018
  580   2HG   GLN  73           HG1      GLN  73 118.460  -0.664   2.197
  581   1HE2  GLN  73          HE22      GLN  73 115.754   0.210   4.277
  582   2HE2  GLN  73          HE21      GLN  73 117.038  -0.857   3.974
  583    H    SER  74           HN       SER  74 120.588   3.090   4.919
  584    HA   SER  74           HA       SER  74 123.371   2.712   4.400
  585   1HB   SER  74           HB2      SER  74 122.034   4.907   4.753
  586   2HB   SER  74           HB1      SER  74 122.296   4.619   6.471
  587    HG   SER  74           HG       SER  74 124.419   4.478   4.618
  588    H    ARG  75           HN       ARG  75 121.392   2.227   7.343
  589    HA   ARG  75           HA       ARG  75 123.570   1.814   9.126
  590   1HB   ARG  75           HB2      ARG  75 120.768   0.663   9.136
  591   2HB   ARG  75           HB1      ARG  75 121.919   0.422  10.450
  592   1HG   ARG  75           HG2      ARG  75 122.106   2.866  10.739
  593   2HG   ARG  75           HG1      ARG  75 120.951   3.109   9.431
  594   1HD   ARG  75           HD2      ARG  75 119.254   1.830  10.721
  595   2HD   ARG  75           HD1      ARG  75 120.411   1.656  12.037
  596    HE   ARG  75           HE       ARG  75 120.270   4.405  11.558
  597   1HH1  ARG  75          HH21      ARG  75 118.102   1.832  12.312
  598   2HH1  ARG  75          HH22      ARG  75 116.983   2.847  13.160
  599   1HH2  ARG  75          HH11      ARG  75 118.823   5.742  12.656
  600   2HH2  ARG  75          HH12      ARG  75 117.390   5.062  13.352
  601    H    ASP  76           HN       ASP  76 121.948  -0.448   6.898
  602    HA   ASP  76           HA       ASP  76 123.330  -2.764   7.887
  603   1HB   ASP  76           HB2      ASP  76 121.994  -2.177   5.238
  604   2HB   ASP  76           HB1      ASP  76 122.672  -3.754   5.651
  605    H    CYS  77           HN       CYS  77 124.148  -0.409   5.318
  606    HA   CYS  77           HA       CYS  77 126.386  -1.936   4.336
  607   1HB   CYS  77           HB2      CYS  77 125.688   1.008   4.192
  608   2HB   CYS  77           HB1      CYS  77 127.091   0.305   3.386
  609    HG   CYS  77           HG       CYS  77 124.291   0.178   2.334
  610    H    PHE  78           HN       PHE  78 126.064   0.659   6.785
  611    HA   PHE  78           HA       PHE  78 128.847   1.005   7.246
  612   1HB   PHE  78           HB2      PHE  78 127.195   2.549   8.159
  613   2HB   PHE  78           HB1      PHE  78 126.516   1.269   9.165
  614    HD1  PHE  78           HD1      PHE  78 129.372   3.550   8.682
  615    HD2  PHE  78           HD2      PHE  78 127.701   0.437  11.125
  616    HE1  PHE  78           HE1      PHE  78 131.021   4.061  10.464
  617    HE2  PHE  78           HE2      PHE  78 129.348   0.947  12.904
  618    HZ   PHE  78           HZ       PHE  78 131.009   2.760  12.575
  619    H    GLY  79           HN       GLY  79 126.565  -0.946   9.213
  620   1HA   GLY  79           HA2      GLY  79 128.565  -2.233  10.754
  621   2HA   GLY  79           HA1      GLY  79 126.943  -2.868  10.487
  622    H    CYS  80           HN       CYS  80 127.260  -2.985   7.570
  623    HA   CYS  80           HA       CYS  80 128.396  -5.640   7.390
  624   1HB   CYS  80           HB2      CYS  80 126.611  -4.869   5.870
  625   2HB   CYS  80           HB1      CYS  80 127.711  -3.677   5.180
  626    HG   CYS  80           HG       CYS  80 128.481  -6.694   5.009
  627    H    LEU  81           HN       LEU  81 129.539  -2.447   6.161
  628    HA   LEU  81           HA       LEU  81 132.048  -3.555   5.253
  629   1HB   LEU  81           HB2      LEU  81 131.309  -0.688   5.921
  630   2HB   LEU  81           HB1      LEU  81 132.755  -1.189   5.048
  631    HG   LEU  81           HG       LEU  81 129.892  -1.631   4.145
  632   1HD1  LEU  81          HD13      LEU  81 132.079   0.232   3.178
  633   2HD1  LEU  81          HD12      LEU  81 130.558  -0.038   2.330
  634   3HD1  LEU  81          HD11      LEU  81 130.555   0.700   3.932
  635   1HD2  LEU  81          HD23      LEU  81 132.553  -2.565   3.090
  636   2HD2  LEU  81          HD22      LEU  81 131.020  -3.432   3.176
  637   3HD2  LEU  81          HD21      LEU  81 131.261  -2.195   1.947
  638    H    ARG  82           HN       ARG  82 131.002  -1.925   8.240
  639    HA   ARG  82           HA       ARG  82 133.565  -1.660   9.440
  640   1HB   ARG  82           HB2      ARG  82 131.518  -0.587  10.329
  641   2HB   ARG  82           HB1      ARG  82 130.899  -2.172  10.789
  642   1HG   ARG  82           HG2      ARG  82 132.712  -2.502  12.357
  643   2HG   ARG  82           HG1      ARG  82 133.519  -1.035  11.799
  644   1HD   ARG  82           HD2      ARG  82 131.747   0.357  12.665
  645   2HD   ARG  82           HD1      ARG  82 130.748  -1.049  13.022
  646    HE   ARG  82           HE       ARG  82 133.084  -1.459  14.486
  647   1HH1  ARG  82          HH21      ARG  82 130.694   1.007  14.161
  648   2HH1  ARG  82          HH22      ARG  82 130.861   1.568  15.792
  649   1HH2  ARG  82          HH11      ARG  82 133.315  -0.739  16.616
  650   2HH2  ARG  82          HH12      ARG  82 132.343   0.579  17.181
  651    H    GLU  83           HN       GLU  83 131.245  -4.359   9.532
  652    HA   GLU  83           HA       GLU  83 132.860  -5.976  11.291
  653   1HB   GLU  83           HB2      GLU  83 130.583  -6.665   9.429
  654   2HB   GLU  83           HB1      GLU  83 131.371  -7.852  10.471
  655   1HG   GLU  83           HG2      GLU  83 130.821  -6.505  12.450
  656   2HG   GLU  83           HG1      GLU  83 130.059  -5.290  11.428
  657    H    TRP  84           HN       TRP  84 132.643  -5.749   7.726
  658    HA   TRP  84           HA       TRP  84 134.236  -8.050   7.173
  659   1HB   TRP  84           HB2      TRP  84 132.960  -6.676   5.461
  660   2HB   TRP  84           HB1      TRP  84 134.230  -5.458   5.592
  661    HD1  TRP  84           HD1      TRP  84 133.537  -8.957   4.281
  662    HE1  TRP  84           HE1      TRP  84 135.507  -9.704   2.788
  663    HE3  TRP  84           HE3      TRP  84 136.821  -5.142   5.159
  664    HZ2  TRP  84           HZ2      TRP  84 138.118  -8.810   2.067
  665    HZ3  TRP  84           HZ3      TRP  84 139.040  -5.118   4.058
  666    HH2  TRP  84           HH2      TRP  84 139.694  -6.947   2.515
  667    H    CYS  85           HN       CYS  85 135.056  -4.663   7.832
  668    HA   CYS  85           HA       CYS  85 137.883  -4.891   7.510
  669   1HB   CYS  85           HB2      CYS  85 136.095  -3.056   9.106
  670   2HB   CYS  85           HB1      CYS  85 137.847  -2.901   9.184
  671    HG   CYS  85           HG       CYS  85 137.863  -2.434   6.599
  672    H    ASP  86           HN       ASP  86 135.761  -5.429  10.297
  673    HA   ASP  86           HA       ASP  86 137.770  -5.856  12.262
  674   1HB   ASP  86           HB2      ASP  86 134.964  -6.961  11.997
  675   2HB   ASP  86           HB1      ASP  86 135.975  -7.218  13.420
  676    H    ALA  87           HN       ALA  87 136.382  -8.038   9.846
  677    HA   ALA  87           HA       ALA  87 137.812 -10.357  10.964
  678   1HB   ALA  87           HB2      ALA  87 135.511 -10.423   9.813
  679   2HB   ALA  87           HB1      ALA  87 136.397 -10.246   8.296
  680   3HB   ALA  87           HB3      ALA  87 136.682 -11.649   9.326
  681    H    PHE  88           HN       PHE  88 138.095  -8.190   8.171
  682    HA   PHE  88           HA       PHE  88 140.592  -9.626   7.351
  683   1HB   PHE  88           HB2      PHE  88 138.831  -7.642   5.888
  684   2HB   PHE  88           HB1      PHE  88 140.330  -8.310   5.240
  685    HD1  PHE  88           HD2      PHE  88 140.540 -10.798   4.911
  686    HD2  PHE  88           HD1      PHE  88 136.806  -8.916   5.888
  687    HE1  PHE  88           HE2      PHE  88 139.325 -12.826   4.169
  688    HE2  PHE  88           HE1      PHE  88 135.588 -10.944   5.143
  689    HZ   PHE  88           HZ       PHE  88 136.850 -12.898   4.283
  690    H    LEU  89           HN       LEU  89 139.855  -6.254   6.654
  691    HA   LEU  89           HA       LEU  89 142.488  -5.495   7.746
  692   1HB   LEU  89           HB2      LEU  89 141.957  -4.559   5.595
  693   2HB   LEU  89           HB1      LEU  89 140.379  -4.008   6.155
  694    HG   LEU  89           HG       LEU  89 141.386  -2.346   7.588
  695   1HD1  LEU  89          HD12      LEU  89 143.951  -3.785   6.895
  696   2HD1  LEU  89          HD11      LEU  89 143.957  -2.133   7.511
  697   3HD1  LEU  89          HD13      LEU  89 143.291  -3.437   8.493
  698   1HD2  LEU  89          HD22      LEU  89 141.231  -1.888   5.105
  699   2HD2  LEU  89          HD21      LEU  89 142.453  -0.933   5.946
  700   3HD2  LEU  89          HD23      LEU  89 142.935  -2.329   4.983
  701   1H    MET   1           HT1      MET   1 169.864  -4.270  -2.632
  702   2H    MET   1           HT3      MET   1 171.292  -5.012  -2.097
  703   3H    MET   1           HT2      MET   1 171.271  -4.181  -3.580
  704    HA   MET   1           HA       MET   1 170.274  -5.855  -4.694
  705   1HB   MET   1           HB2      MET   1 171.439  -7.291  -2.287
  706   2HB   MET   1           HB1      MET   1 171.081  -8.037  -3.846
  707   1HG   MET   1           HG2      MET   1 172.944  -5.671  -3.528
  708   2HG   MET   1           HG1      MET   1 173.502  -7.342  -3.531
  709   1HE   MET   1           HE2      MET   1 172.914  -8.980  -5.054
  710   2HE   MET   1           HE1      MET   1 171.620  -8.743  -6.224
  711   3HE   MET   1           HE3      MET   1 173.306  -8.740  -6.753
  712    H    THR   2           HN       THR   2 169.724  -7.171  -1.421
  713    HA   THR   2           HA       THR   2 167.028  -7.999  -2.198
  714    HB   THR   2           HB       THR   2 166.916  -9.017  -0.007
  715    HG1  THR   2           HG1      THR   2 168.908  -8.575   1.333
  716   1HG2  THR   2          HG21      THR   2 168.360 -10.133  -1.673
  717   2HG2  THR   2          HG23      THR   2 169.742  -9.203  -1.091
  718   3HG2  THR   2          HG22      THR   2 168.963 -10.382  -0.034
  719    H    THR   3           HN       THR   3 165.103  -7.361  -0.931
  720    HA   THR   3           HA       THR   3 164.990  -4.470  -0.571
  721    HB   THR   3           HB       THR   3 162.615  -4.881   0.004
  722    HG1  THR   3           HG1      THR   3 161.989  -6.794   0.590
  723   1HG2  THR   3          HG22      THR   3 163.454  -4.856  -2.391
  724   2HG2  THR   3          HG21      THR   3 163.445  -6.619  -2.333
  725   3HG2  THR   3          HG23      THR   3 161.938  -5.723  -2.141
  726    H    SER   4           HN       SER   4 164.150  -3.491   1.470
  727    HA   SER   4           HA       SER   4 165.724  -4.265   3.737
  728   1HB   SER   4           HB2      SER   4 164.870  -1.954   3.362
  729   2HB   SER   4           HB1      SER   4 163.233  -2.530   3.662
  730    HG   SER   4           HG       SER   4 163.692  -2.797   5.744
  731    H    GLN   5           HN       GLN   5 165.037  -5.223   5.704
  732    HA   GLN   5           HA       GLN   5 163.320  -7.462   5.465
  733   1HB   GLN   5           HB2      GLN   5 163.505  -7.627   7.927
  734   2HB   GLN   5           HB1      GLN   5 165.071  -7.320   7.175
  735   1HG   GLN   5           HG2      GLN   5 164.848  -4.917   7.682
  736   2HG   GLN   5           HG1      GLN   5 163.284  -5.218   8.438
  737   1HE2  GLN   5          HE22      GLN   5 164.693  -6.271  11.486
  738   2HE2  GLN   5          HE21      GLN   5 163.292  -5.869  10.616
  739    H    LYS   6           HN       LYS   6 162.526  -4.139   6.056
  740    HA   LYS   6           HA       LYS   6 160.090  -4.513   7.503
  741   1HB   LYS   6           HB2      LYS   6 161.005  -2.331   5.621
  742   2HB   LYS   6           HB1      LYS   6 159.495  -2.259   6.531
  743   1HG   LYS   6           HG2      LYS   6 160.752  -2.487   8.645
  744   2HG   LYS   6           HG1      LYS   6 162.263  -2.552   7.735
  745   1HD   LYS   6           HD2      LYS   6 161.820  -0.305   6.823
  746   2HD   LYS   6           HD1      LYS   6 160.310  -0.234   7.731
  747   1HE   LYS   6           HE2      LYS   6 161.582  -0.471   9.844
  748   2HE   LYS   6           HE1      LYS   6 163.087  -0.492   8.924
  749   1HZ   LYS   6           HZ3      LYS   6 162.550   1.704   8.071
  750   2HZ   LYS   6           HZ2      LYS   6 161.109   1.723   8.971
  751   3HZ   LYS   6           HZ1      LYS   6 162.610   1.715   9.765
  752    H    HIS   7           HN       HIS   7 160.875  -4.512   4.048
  753    HA   HIS   7           HA       HIS   7 158.232  -4.460   3.034
  754   1HB   HIS   7           HB2      HIS   7 160.148  -4.210   1.555
  755   2HB   HIS   7           HB1      HIS   7 160.715  -5.830   1.957
  756    HD2  HIS   7           HD2      HIS   7 159.440  -7.914   0.566
  757    HE1  HIS   7           HE1      HIS   7 156.748  -5.496  -1.610
  758    HE2  HIS   7           HE2      HIS   7 157.660  -7.846  -1.338
  759    H    ARG   8           HN       ARG   8 160.263  -7.310   3.793
  760    HA   ARG   8           HA       ARG   8 158.167  -9.186   3.216
  761   1HB   ARG   8           HB2      ARG   8 160.742  -9.420   4.797
  762   2HB   ARG   8           HB1      ARG   8 159.677 -10.789   4.465
  763   1HG   ARG   8           HG2      ARG   8 159.873 -10.221   2.005
  764   2HG   ARG   8           HG1      ARG   8 161.122  -9.061   2.441
  765   1HD   ARG   8           HD2      ARG   8 161.175 -12.039   2.957
  766   2HD   ARG   8           HD1      ARG   8 162.154 -11.184   1.774
  767    HE   ARG   8           HE       ARG   8 162.727 -11.543   4.581
  768   1HH1  ARG   8          HH21      ARG   8 162.862  -9.132   2.107
  769   2HH1  ARG   8          HH22      ARG   8 164.010  -8.158   2.960
  770   1HH2  ARG   8          HH11      ARG   8 164.225 -10.297   5.672
  771   2HH2  ARG   8          HH12      ARG   8 164.784  -8.817   4.968
  772    H    ASP   9           HN       ASP   9 159.146  -7.413   6.069
  773    HA   ASP   9           HA       ASP   9 157.564  -9.004   7.910
  774   1HB   ASP   9           HB2      ASP   9 158.809  -6.267   8.139
  775   2HB   ASP   9           HB1      ASP   9 157.933  -7.040   9.454
  776    H    PHE  10           HN       PHE  10 157.032  -5.976   6.102
  777    HA   PHE  10           HA       PHE  10 154.537  -5.352   7.383
  778   1HB   PHE  10           HB2      PHE  10 155.889  -3.729   6.039
  779   2HB   PHE  10           HB1      PHE  10 155.422  -4.603   4.581
  780    HD1  PHE  10           HD1      PHE  10 154.238  -2.453   7.333
  781    HD2  PHE  10           HD2      PHE  10 153.137  -4.506   3.723
  782    HE1  PHE  10           HE1      PHE  10 152.116  -1.172   7.254
  783    HE2  PHE  10           HE2      PHE  10 151.013  -3.227   3.644
  784    HZ   PHE  10           HZ       PHE  10 150.502  -1.560   5.410
  785    H    VAL  11           HN       VAL  11 155.334  -7.244   4.467
  786    HA   VAL  11           HA       VAL  11 152.481  -7.766   3.946
  787    HB   VAL  11           HB       VAL  11 153.288  -9.134   2.088
  788   1HG1  VAL  11          HG13      VAL  11 154.853  -6.552   2.396
  789   2HG1  VAL  11          HG12      VAL  11 154.578  -7.396   0.873
  790   3HG1  VAL  11          HG11      VAL  11 153.219  -6.701   1.753
  791   1HG2  VAL  11          HG23      VAL  11 155.919  -8.803   3.524
  792   2HG2  VAL  11          HG22      VAL  11 155.167 -10.282   2.929
  793   3HG2  VAL  11          HG21      VAL  11 155.881  -9.138   1.793
  794    H    ALA  12           HN       ALA  12 154.050  -8.677   6.466
  795    HA   ALA  12           HA       ALA  12 153.307 -11.588   6.316
  796   1HB   ALA  12           HB1      ALA  12 155.489 -10.215   7.907
  797   2HB   ALA  12           HB3      ALA  12 155.019 -11.901   8.121
  798   3HB   ALA  12           HB2      ALA  12 155.704 -11.364   6.587
  799    H    GLU  13           HN       GLU  13 152.481  -8.614   7.721
  800    HA   GLU  13           HA       GLU  13 150.783 -10.021   9.677
  801   1HB   GLU  13           HB2      GLU  13 151.542  -8.413  11.509
  802   2HB   GLU  13           HB1      GLU  13 152.690  -9.678  11.074
  803   1HG   GLU  13           HG2      GLU  13 154.021  -8.182   9.811
  804   2HG   GLU  13           HG1      GLU  13 152.760  -6.950   9.779
  805    HA   PRO  14           HA       PRO  14 147.737  -6.947   8.628
  806   1HB   PRO  14           HB2      PRO  14 147.563  -6.366  11.574
  807   2HB   PRO  14           HB1      PRO  14 146.261  -6.684  10.412
  808   1HG   PRO  14           HG2      PRO  14 147.092  -8.549  12.146
  809   2HG   PRO  14           HG1      PRO  14 146.544  -8.964  10.512
  810   1HD   PRO  14           HD2      PRO  14 149.304  -8.992  11.621
  811   2HD   PRO  14           HD1      PRO  14 148.624  -9.901  10.253
  812    H    MET  15           HN       MET  15 147.469  -4.566   8.599
  813    HA   MET  15           HA       MET  15 150.031  -3.172   9.097
  814   1HB   MET  15           HB2      MET  15 148.771  -1.233   8.000
  815   2HB   MET  15           HB1      MET  15 149.051  -2.647   6.984
  816   1HG   MET  15           HG2      MET  15 146.810  -3.389   7.206
  817   2HG   MET  15           HG1      MET  15 146.508  -2.329   8.583
  818   1HE   MET  15           HE1      MET  15 147.709  -2.514   5.024
  819   2HE   MET  15           HE3      MET  15 145.967  -2.697   4.768
  820   3HE   MET  15           HE2      MET  15 146.808  -1.279   4.147
  821    H    GLY  16           HN       GLY  16 146.916  -3.538  10.544
  822   1HA   GLY  16           HA2      GLY  16 145.913  -2.503  12.396
  823   2HA   GLY  16           HA1      GLY  16 147.566  -2.371  12.994
  824    H    GLU  17           HN       GLU  17 147.492  -0.318  13.849
  825    HA   GLU  17           HA       GLU  17 146.567   1.926  12.105
  826   1HB   GLU  17           HB2      GLU  17 147.063   1.715  15.087
  827   2HB   GLU  17           HB1      GLU  17 146.642   3.220  14.267
  828   1HG   GLU  17           HG2      GLU  17 144.554   2.205  13.447
  829   2HG   GLU  17           HG1      GLU  17 144.976   0.684  14.234
  830    H    LYS  18           HN       LYS  18 149.226   0.560  11.841
  831    HA   LYS  18           HA       LYS  18 151.290   2.146  12.985
  832   1HB   LYS  18           HB2      LYS  18 151.154   0.549  10.416
  833   2HB   LYS  18           HB1      LYS  18 152.635   1.339  10.952
  834   1HG   LYS  18           HG2      LYS  18 151.153  -0.461  12.867
  835   2HG   LYS  18           HG1      LYS  18 152.163  -1.181  11.616
  836   1HD   LYS  18           HD2      LYS  18 154.079   0.216  12.402
  837   2HD   LYS  18           HD1      LYS  18 153.064   0.820  13.712
  838   1HE   LYS  18           HE2      LYS  18 154.417  -1.028  14.545
  839   2HE   LYS  18           HE1      LYS  18 152.729  -1.534  14.481
  840   1HZ   LYS  18           HZ2      LYS  18 154.606  -2.028  12.248
  841   2HZ   LYS  18           HZ1      LYS  18 154.426  -3.123  13.534
  842   3HZ   LYS  18           HZ3      LYS  18 153.101  -2.760  12.541
  843    HA   PRO  19           HA       PRO  19 150.834   5.972  10.793
  844   1HB   PRO  19           HB2      PRO  19 153.434   6.877  10.718
  845   2HB   PRO  19           HB1      PRO  19 152.440   6.879  12.189
  846   1HG   PRO  19           HG2      PRO  19 154.512   4.908  11.317
  847   2HG   PRO  19           HG1      PRO  19 154.230   5.608  12.922
  848   1HD   PRO  19           HD2      PRO  19 153.368   3.113  12.276
  849   2HD   PRO  19           HD1      PRO  19 152.464   4.160  13.392
  850    H    VAL  20           HN       VAL  20 151.299   7.066   8.778
  851    HA   VAL  20           HA       VAL  20 151.440   5.403   6.515
  852    HB   VAL  20           HB       VAL  20 150.490   7.623   6.372
  853   1HG1  VAL  20          HG13      VAL  20 152.169   8.604   8.041
  854   2HG1  VAL  20          HG12      VAL  20 153.272   8.771   6.677
  855   3HG1  VAL  20          HG11      VAL  20 151.733   9.634   6.679
  856   1HG2  VAL  20          HG22      VAL  20 151.712   6.561   4.365
  857   2HG2  VAL  20          HG21      VAL  20 151.390   8.294   4.278
  858   3HG2  VAL  20          HG23      VAL  20 153.004   7.716   4.695
  859    H    GLY  21           HN       GLY  21 154.059   7.280   8.025
  860   1HA   GLY  21           HA2      GLY  21 156.056   6.747   6.079
  861   2HA   GLY  21           HA1      GLY  21 156.386   7.134   7.766
  862    H    SER  22           HN       SER  22 154.444   4.474   7.941
  863    HA   SER  22           HA       SER  22 156.745   2.726   8.456
  864   1HB   SER  22           HB2      SER  22 154.755   2.694   9.937
  865   2HB   SER  22           HB1      SER  22 153.768   2.154   8.583
  866    HG   SER  22           HG       SER  22 156.099   0.788   9.432
  867    H    LEU  23           HN       LEU  23 154.444   3.282   5.906
  868    HA   LEU  23           HA       LEU  23 154.579   0.731   4.620
  869   1HB   LEU  23           HB2      LEU  23 154.109   3.509   3.503
  870   2HB   LEU  23           HB1      LEU  23 153.906   2.033   2.565
  871    HG   LEU  23           HG       LEU  23 152.459   2.560   5.179
  872   1HD1  LEU  23          HD12      LEU  23 151.664   3.136   2.318
  873   2HD1  LEU  23          HD11      LEU  23 150.475   2.952   3.609
  874   3HD1  LEU  23          HD13      LEU  23 151.672   4.244   3.689
  875   1HD2  LEU  23          HD21      LEU  23 152.323   0.427   3.041
  876   2HD2  LEU  23          HD23      LEU  23 152.351   0.238   4.793
  877   3HD2  LEU  23          HD22      LEU  23 150.890   0.803   3.993
  878    H    ALA  24           HN       ALA  24 156.034  -0.122   3.210
  879    HA   ALA  24           HA       ALA  24 158.729   0.868   3.235
  880   1HB   ALA  24           HB3      ALA  24 157.362  -1.185   1.480
  881   2HB   ALA  24           HB2      ALA  24 159.094  -0.859   1.425
  882   3HB   ALA  24           HB1      ALA  24 158.361  -1.488   2.901
  883    H    GLY  25           HN       GLY  25 159.800   2.174   1.853
  884   1HA   GLY  25           HA2      GLY  25 160.203   3.183  -0.343
  885   2HA   GLY  25           HA1      GLY  25 158.485   3.017  -0.703
  886    H    ILE  26           HN       ILE  26 158.017   3.989   2.203
  887    HA   ILE  26           HA       ILE  26 158.116   6.902   1.532
  888    HB   ILE  26           HB       ILE  26 156.629   5.479   3.764
  889   1HG1  ILE  26          HG12      ILE  26 155.761   4.702   1.631
  890   2HG1  ILE  26          HG11      ILE  26 154.614   5.848   2.318
  891   1HG2  ILE  26          HG21      ILE  26 157.089   7.893   4.133
  892   2HG2  ILE  26          HG23      ILE  26 156.302   8.259   2.598
  893   3HG2  ILE  26          HG22      ILE  26 155.369   7.571   3.927
  894   1HD1  ILE  26          HD11      ILE  26 155.919   7.624   0.896
  895   2HD1  ILE  26          HD13      ILE  26 156.492   6.219  -0.004
  896   3HD1  ILE  26          HD12      ILE  26 154.767   6.561   0.092
  897    H    GLY  27           HN       GLY  27 159.776   8.062   2.482
  898   1HA   GLY  27           HA2      GLY  27 161.191   6.869   4.801
  899   2HA   GLY  27           HA1      GLY  27 161.756   8.226   3.825
  900    H    GLU  28           HN       GLU  28 161.925   8.672   6.457
  901    HA   GLU  28           HA       GLU  28 159.620   9.600   7.813
  902   1HB   GLU  28           HB2      GLU  28 162.512  10.475   8.005
  903   2HB   GLU  28           HB1      GLU  28 161.258  11.051   9.103
  904   1HG   GLU  28           HG2      GLU  28 160.768   8.740   9.782
  905   2HG   GLU  28           HG1      GLU  28 161.989   8.139   8.659
  906    H    VAL  29           HN       VAL  29 161.778  11.334   5.563
  907    HA   VAL  29           HA       VAL  29 160.496  13.886   5.930
  908    HB   VAL  29           HB       VAL  29 162.161  12.753   3.666
  909   1HG1  VAL  29          HG13      VAL  29 160.960  15.503   4.049
  910   2HG1  VAL  29          HG12      VAL  29 162.374  15.227   3.032
  911   3HG1  VAL  29          HG11      VAL  29 160.839  14.453   2.637
  912   1HG2  VAL  29          HG21      VAL  29 163.235  13.148   5.903
  913   2HG2  VAL  29          HG23      VAL  29 163.912  14.146   4.616
  914   3HG2  VAL  29          HG22      VAL  29 162.779  14.846   5.771
  915    H    LEU  30           HN       LEU  30 160.073  11.333   3.483
  916    HA   LEU  30           HA       LEU  30 157.976  12.695   2.065
  917   1HB   LEU  30           HB2      LEU  30 158.570   9.726   2.252
  918   2HB   LEU  30           HB1      LEU  30 157.520  10.481   1.056
  919    HG   LEU  30           HG       LEU  30 160.458  11.150   1.416
  920   1HD1  LEU  30          HD11      LEU  30 159.061   9.367  -0.602
  921   2HD1  LEU  30          HD13      LEU  30 160.747   9.873  -0.711
  922   3HD1  LEU  30          HD12      LEU  30 160.218   8.854   0.626
  923   1HD2  LEU  30          HD22      LEU  30 158.292  12.045  -0.490
  924   2HD2  LEU  30          HD21      LEU  30 159.490  13.018   0.363
  925   3HD2  LEU  30          HD23      LEU  30 159.975  12.036  -1.015
  926    H    GLY  31           HN       GLY  31 157.991  10.397   4.757
  927   1HA   GLY  31           HA2      GLY  31 155.189   9.912   4.853
  928   2HA   GLY  31           HA1      GLY  31 156.273   9.808   6.242
  929    H    LYS  32           HN       LYS  32 157.161  12.529   6.230
  930    HA   LYS  32           HA       LYS  32 155.059  13.742   7.750
  931   1HB   LYS  32           HB2      LYS  32 157.523  14.242   7.968
  932   2HB   LYS  32           HB1      LYS  32 157.397  15.184   6.481
  933   1HG   LYS  32           HG2      LYS  32 155.563  16.527   7.568
  934   2HG   LYS  32           HG1      LYS  32 155.898  15.670   9.072
  935   1HD   LYS  32           HD2      LYS  32 157.886  17.356   7.521
  936   2HD   LYS  32           HD1      LYS  32 157.071  17.838   9.008
  937   1HE   LYS  32           HE2      LYS  32 158.089  15.641   9.995
  938   2HE   LYS  32           HE1      LYS  32 159.187  15.735   8.617
  939   1HZ   LYS  32           HZ3      LYS  32 158.989  18.277   9.767
  940   2HZ   LYS  32           HZ2      LYS  32 159.300  17.164  11.013
  941   3HZ   LYS  32           HZ1      LYS  32 160.347  17.265   9.679
  942    H    LYS  33           HN       LYS  33 156.092  14.241   4.355
  943    HA   LYS  33           HA       LYS  33 154.394  16.509   3.922
  944   1HB   LYS  33           HB2      LYS  33 155.464  14.442   1.978
  945   2HB   LYS  33           HB1      LYS  33 154.627  15.915   1.490
  946   1HG   LYS  33           HG2      LYS  33 156.340  17.274   2.639
  947   2HG   LYS  33           HG1      LYS  33 157.181  15.801   3.126
  948   1HD   LYS  33           HD2      LYS  33 157.500  15.196   0.753
  949   2HD   LYS  33           HD1      LYS  33 156.663  16.670   0.266
  950   1HE   LYS  33           HE2      LYS  33 159.229  16.556   1.882
  951   2HE   LYS  33           HE1      LYS  33 159.111  16.975   0.174
  952   1HZ   LYS  33           HZ3      LYS  33 157.357  18.673   1.188
  953   2HZ   LYS  33           HZ2      LYS  33 158.397  18.533   2.524
  954   3HZ   LYS  33           HZ1      LYS  33 159.003  19.044   1.021
  955    H    LEU  34           HN       LEU  34 153.856  13.016   3.336
  956    HA   LEU  34           HA       LEU  34 151.204  13.328   2.297
  957   1HB   LEU  34           HB2      LEU  34 152.525  11.012   3.739
  958   2HB   LEU  34           HB1      LEU  34 150.925  10.917   3.020
  959    HG   LEU  34           HG       LEU  34 153.401  11.704   1.464
  960   1HD1  LEU  34          HD12      LEU  34 152.029   9.010   1.718
  961   2HD1  LEU  34          HD11      LEU  34 153.305   9.385   0.561
  962   3HD1  LEU  34          HD13      LEU  34 153.647   9.413   2.291
  963   1HD2  LEU  34          HD21      LEU  34 150.513  11.138   0.759
  964   2HD2  LEU  34          HD23      LEU  34 151.550  12.454   0.212
  965   3HD2  LEU  34          HD22      LEU  34 151.780  10.833  -0.428
  966    H    GLU  35           HN       GLU  35 152.474  13.017   5.570
  967    HA   GLU  35           HA       GLU  35 149.991  12.705   6.940
  968   1HB   GLU  35           HB2      GLU  35 152.172  12.413   8.054
  969   2HB   GLU  35           HB1      GLU  35 152.493  14.141   7.892
  970   1HG   GLU  35           HG2      GLU  35 150.571  14.669   9.307
  971   2HG   GLU  35           HG1      GLU  35 150.138  12.961   9.400
  972    H    GLU  36           HN       GLU  36 151.683  15.648   5.901
  973    HA   GLU  36           HA       GLU  36 149.807  17.471   7.115
  974   1HB   GLU  36           HB2      GLU  36 151.750  17.783   4.809
  975   2HB   GLU  36           HB1      GLU  36 150.790  19.115   5.455
  976   1HG   GLU  36           HG2      GLU  36 151.781  18.754   7.685
  977   2HG   GLU  36           HG1      GLU  36 152.745  17.425   7.042
  978    H    ARG  37           HN       ARG  37 149.729  15.475   4.328
  979    HA   ARG  37           HA       ARG  37 147.625  17.072   2.995
  980   1HB   ARG  37           HB2      ARG  37 148.886  14.419   2.266
  981   2HB   ARG  37           HB1      ARG  37 147.746  15.301   1.258
  982   1HG   ARG  37           HG2      ARG  37 150.346  16.511   2.224
  983   2HG   ARG  37           HG1      ARG  37 150.232  15.616   0.714
  984   1HD   ARG  37           HD2      ARG  37 148.811  18.194   1.437
  985   2HD   ARG  37           HD1      ARG  37 149.991  17.935   0.164
  986    HE   ARG  37           HE       ARG  37 147.937  16.192  -0.484
  987   1HH1  ARG  37          HH21      ARG  37 148.242  19.549   0.245
  988   2HH1  ARG  37          HH22      ARG  37 146.933  20.027  -0.784
  989   1HH2  ARG  37          HH11      ARG  37 146.225  16.798  -1.830
  990   2HH2  ARG  37          HH12      ARG  37 145.793  18.470  -1.960
  991    H    GLY  38           HN       GLY  38 147.579  14.995   5.572
  992   1HA   GLY  38           HA2      GLY  38 145.440  14.452   6.590
  993   2HA   GLY  38           HA1      GLY  38 144.727  14.298   4.992
  994    H    PHE  39           HN       PHE  39 147.718  12.714   4.996
  995    HA   PHE  39           HA       PHE  39 146.345  10.079   5.429
  996   1HB   PHE  39           HB2      PHE  39 148.904  10.798   3.987
  997   2HB   PHE  39           HB1      PHE  39 148.286   9.159   4.162
  998    HD1  PHE  39           HD1      PHE  39 147.820  12.412   2.549
  999    HD2  PHE  39           HD2      PHE  39 146.275   8.440   2.958
 1000    HE1  PHE  39           HE1      PHE  39 146.380  12.780   0.568
 1001    HE2  PHE  39           HE2      PHE  39 144.823   8.799   0.977
 1002    HZ   PHE  39           HZ       PHE  39 144.875  10.971  -0.220
 1003    H    ASP  40           HN       ASP  40 146.613  10.657   7.796
 1004    HA   ASP  40           HA       ASP  40 149.336  10.668   8.859
 1005   1HB   ASP  40           HB2      ASP  40 148.225  10.767  11.051
 1006   2HB   ASP  40           HB1      ASP  40 147.531  11.950   9.943
 1007    H    LYS  41           HN       LYS  41 147.174   8.191   7.908
 1008    HA   LYS  41           HA       LYS  41 148.841   6.206   9.405
 1009   1HB   LYS  41           HB2      LYS  41 145.820   6.124   9.160
 1010   2HB   LYS  41           HB1      LYS  41 146.829   4.861   9.876
 1011   1HG   LYS  41           HG2      LYS  41 147.683   6.492  11.534
 1012   2HG   LYS  41           HG1      LYS  41 146.648   7.735  10.835
 1013   1HD   LYS  41           HD2      LYS  41 144.657   6.338  11.372
 1014   2HD   LYS  41           HD1      LYS  41 145.728   5.164  12.139
 1015   1HE   LYS  41           HE2      LYS  41 144.951   6.508  13.929
 1016   2HE   LYS  41           HE1      LYS  41 146.570   7.116  13.584
 1017   1HZ   LYS  41           HZ1      LYS  41 144.082   8.273  12.452
 1018   2HZ   LYS  41           HZ3      LYS  41 144.866   8.874  13.831
 1019   3HZ   LYS  41           HZ2      LYS  41 145.653   8.906  12.326
 1020    H    ALA  42           HN       ALA  42 148.925   4.122   8.418
 1021    HA   ALA  42           HA       ALA  42 149.287   4.230   5.595
 1022   1HB   ALA  42           HB3      ALA  42 149.103   1.877   7.481
 1023   2HB   ALA  42           HB2      ALA  42 149.607   1.754   5.795
 1024   3HB   ALA  42           HB1      ALA  42 150.568   2.694   6.937
 1025    H    TYR  43           HN       TYR  43 146.600   2.743   7.474
 1026    HA   TYR  43           HA       TYR  43 145.403   1.507   5.215
 1027   1HB   TYR  43           HB2      TYR  43 143.401   1.236   6.497
 1028   2HB   TYR  43           HB1      TYR  43 144.770   1.017   7.578
 1029    HD1  TYR  43           HD1      TYR  43 142.261   3.550   6.429
 1030    HD2  TYR  43           HD2      TYR  43 144.972   2.325   9.528
 1031    HE1  TYR  43           HE1      TYR  43 141.336   5.295   7.922
 1032    HE2  TYR  43           HE2      TYR  43 144.043   4.070  11.020
 1033    HH   TYR  43           HH       TYR  43 141.982   5.372  11.267
 1034    H    VAL  44           HN       VAL  44 145.471   4.875   6.023
 1035    HA   VAL  44           HA       VAL  44 143.084   5.517   4.433
 1036    HB   VAL  44           HB       VAL  44 145.362   7.316   5.352
 1037   1HG1  VAL  44          HG11      VAL  44 144.013   8.183   3.413
 1038   2HG1  VAL  44          HG13      VAL  44 142.568   8.035   4.411
 1039   3HG1  VAL  44          HG12      VAL  44 143.846   9.159   4.869
 1040   1HG2  VAL  44          HG21      VAL  44 142.664   6.643   6.549
 1041   2HG2  VAL  44          HG23      VAL  44 144.252   6.439   7.290
 1042   3HG2  VAL  44          HG22      VAL  44 143.601   8.057   7.033
 1043    H    VAL  45           HN       VAL  45 146.498   5.184   4.046
 1044    HA   VAL  45           HA       VAL  45 146.659   6.272   1.342
 1045    HB   VAL  45           HB       VAL  45 148.556   4.502   2.918
 1046   1HG1  VAL  45          HG12      VAL  45 148.802   5.836   0.214
 1047   2HG1  VAL  45          HG11      VAL  45 150.207   5.327   1.151
 1048   3HG1  VAL  45          HG13      VAL  45 149.031   4.131   0.606
 1049   1HG2  VAL  45          HG22      VAL  45 148.364   7.478   2.401
 1050   2HG2  VAL  45          HG21      VAL  45 148.438   6.644   3.953
 1051   3HG2  VAL  45          HG23      VAL  45 149.867   6.716   2.922
 1052    H    LEU  46           HN       LEU  46 146.329   3.044   2.795
 1053    HA   LEU  46           HA       LEU  46 146.566   1.542   0.379
 1054   1HB   LEU  46           HB2      LEU  46 146.523   0.470   2.620
 1055   2HB   LEU  46           HB1      LEU  46 144.842   0.960   2.819
 1056    HG   LEU  46           HG       LEU  46 144.243  -0.385   0.806
 1057   1HD1  LEU  46          HD11      LEU  46 147.202  -0.907   0.816
 1058   2HD1  LEU  46          HD13      LEU  46 146.103  -2.135   0.187
 1059   3HD1  LEU  46          HD12      LEU  46 146.140  -0.533  -0.541
 1060   1HD2  LEU  46          HD21      LEU  46 144.591  -1.301   3.352
 1061   2HD2  LEU  46          HD23      LEU  46 143.958  -2.285   2.036
 1062   3HD2  LEU  46          HD22      LEU  46 145.658  -2.400   2.475
 1063    H    GLY  47           HN       GLY  47 143.878   3.194   1.933
 1064   1HA   GLY  47           HA2      GLY  47 141.756   2.338   0.273
 1065   2HA   GLY  47           HA1      GLY  47 141.810   3.908   1.074
 1066    H    GLN  48           HN       GLN  48 144.054   5.054  -0.217
 1067    HA   GLN  48           HA       GLN  48 142.883   6.016  -2.636
 1068   1HB   GLN  48           HB2      GLN  48 144.675   7.180  -1.290
 1069   2HB   GLN  48           HB1      GLN  48 145.834   6.015  -1.930
 1070   1HG   GLN  48           HG2      GLN  48 145.933   7.998  -3.312
 1071   2HG   GLN  48           HG1      GLN  48 145.155   6.723  -4.250
 1072   1HE2  GLN  48          HE22      GLN  48 142.234   8.618  -4.716
 1073   2HE2  GLN  48          HE21      GLN  48 143.233   7.351  -5.241
 1074    H    PHE  49           HN       PHE  49 145.367   3.541  -2.050
 1075    HA   PHE  49           HA       PHE  49 145.977   2.933  -4.767
 1076   1HB   PHE  49           HB2      PHE  49 147.300   2.128  -2.841
 1077   2HB   PHE  49           HB1      PHE  49 145.951   1.113  -2.335
 1078    HD1  PHE  49           HD1      PHE  49 148.144   1.779  -5.303
 1079    HD2  PHE  49           HD2      PHE  49 145.838  -1.101  -3.104
 1080    HE1  PHE  49           HE1      PHE  49 148.968  -0.022  -6.796
 1081    HE2  PHE  49           HE2      PHE  49 146.659  -2.900  -4.598
 1082    HZ   PHE  49           HZ       PHE  49 148.224  -2.361  -6.444
 1083    H    LEU  50           HN       LEU  50 143.487   1.734  -2.581
 1084    HA   LEU  50           HA       LEU  50 142.426  -0.234  -4.425
 1085   1HB   LEU  50           HB2      LEU  50 141.045   1.205  -2.138
 1086   2HB   LEU  50           HB1      LEU  50 140.413  -0.216  -2.969
 1087    HG   LEU  50           HG       LEU  50 143.064  -0.117  -1.499
 1088   1HD1  LEU  50          HD11      LEU  50 140.404  -1.330  -0.693
 1089   2HD1  LEU  50          HD13      LEU  50 141.915  -1.496   0.202
 1090   3HD1  LEU  50          HD12      LEU  50 141.156   0.086   0.038
 1091   1HD2  LEU  50          HD23      LEU  50 141.584  -2.246  -3.038
 1092   2HD2  LEU  50          HD22      LEU  50 143.304  -1.854  -3.057
 1093   3HD2  LEU  50          HD21      LEU  50 142.614  -2.712  -1.685
 1094    H    VAL  51           HN       VAL  51 141.720   3.178  -3.837
 1095    HA   VAL  51           HA       VAL  51 139.433   3.338  -5.553
 1096    HB   VAL  51           HB       VAL  51 141.439   5.447  -4.707
 1097   1HG1  VAL  51          HG13      VAL  51 138.874   5.622  -6.296
 1098   2HG1  VAL  51          HG12      VAL  51 139.458   6.990  -5.348
 1099   3HG1  VAL  51          HG11      VAL  51 140.443   6.343  -6.660
 1100   1HG2  VAL  51          HG22      VAL  51 139.924   4.230  -2.999
 1101   2HG2  VAL  51          HG21      VAL  51 139.880   5.992  -3.003
 1102   3HG2  VAL  51          HG23      VAL  51 138.585   5.077  -3.775
 1103    H    LEU  52           HN       LEU  52 142.891   3.374  -6.211
 1104    HA   LEU  52           HA       LEU  52 142.482   4.301  -8.984
 1105   1HB   LEU  52           HB2      LEU  52 144.973   3.333  -7.554
 1106   2HB   LEU  52           HB1      LEU  52 144.934   4.049  -9.164
 1107    HG   LEU  52           HG       LEU  52 143.993   5.433  -6.632
 1108   1HD1  LEU  52          HD13      LEU  52 146.534   5.712  -8.257
 1109   2HD1  LEU  52          HD12      LEU  52 146.056   6.806  -6.959
 1110   3HD1  LEU  52          HD11      LEU  52 146.411   5.115  -6.602
 1111   1HD2  LEU  52          HD23      LEU  52 144.092   6.197  -9.550
 1112   2HD2  LEU  52          HD22      LEU  52 142.822   6.498  -8.365
 1113   3HD2  LEU  52          HD21      LEU  52 144.302   7.448  -8.325
 1114    H    LYS  53           HN       LYS  53 141.640   1.497  -7.720
 1115    HA   LYS  53           HA       LYS  53 141.617  -0.730  -8.477
 1116   1HB   LYS  53           HB2      LYS  53 141.734   0.853 -11.055
 1117   2HB   LYS  53           HB1      LYS  53 141.379  -0.874 -10.981
 1118   1HG   LYS  53           HG2      LYS  53 139.454  -0.418  -9.505
 1119   2HG   LYS  53           HG1      LYS  53 139.805   1.309  -9.582
 1120   1HD   LYS  53           HD2      LYS  53 139.462   1.273 -12.025
 1121   2HD   LYS  53           HD1      LYS  53 139.107  -0.453 -11.949
 1122   1HE   LYS  53           HE2      LYS  53 137.182  -0.008 -10.484
 1123   2HE   LYS  53           HE1      LYS  53 137.542   1.718 -10.521
 1124   1HZ   LYS  53           HZ3      LYS  53 137.449   0.826 -13.156
 1125   2HZ   LYS  53           HZ2      LYS  53 136.079   0.194 -12.373
 1126   3HZ   LYS  53           HZ1      LYS  53 136.366   1.868 -12.372
 1127    H    LYS  54           HN       LYS  54 144.230   0.103  -7.723
 1128    HA   LYS  54           HA       LYS  54 146.457  -0.601  -7.876
 1129   1HB   LYS  54           HB2      LYS  54 145.360  -2.662  -9.813
 1130   2HB   LYS  54           HB1      LYS  54 146.880  -2.748  -8.931
 1131   1HG   LYS  54           HG2      LYS  54 145.587  -2.676  -6.791
 1132   2HG   LYS  54           HG1      LYS  54 144.099  -2.762  -7.728
 1133   1HD   LYS  54           HD2      LYS  54 146.321  -4.819  -7.910
 1134   2HD   LYS  54           HD1      LYS  54 144.915  -4.995  -6.862
 1135   1HE   LYS  54           HE2      LYS  54 143.523  -4.594  -9.026
 1136   2HE   LYS  54           HE1      LYS  54 145.022  -4.965  -9.877
 1137   1HZ   LYS  54           HZ1      LYS  54 144.470  -6.826  -7.781
 1138   2HZ   LYS  54           HZ3      LYS  54 143.221  -6.777  -8.926
 1139   3HZ   LYS  54           HZ2      LYS  54 144.811  -7.112  -9.421
 1140    H    ASP  55           HN       ASP  55 145.210   1.280 -10.055
 1141    HA   ASP  55           HA       ASP  55 146.773   0.731 -12.437
 1142   1HB   ASP  55           HB2      ASP  55 144.764   2.169 -12.489
 1143   2HB   ASP  55           HB1      ASP  55 145.580   3.343 -11.461
 1144    H    GLU  56           HN       GLU  56 148.955   0.622 -12.227
 1145    HA   GLU  56           HA       GLU  56 150.512   1.891 -10.217
 1146   1HB   GLU  56           HB2      GLU  56 151.188  -0.127 -11.493
 1147   2HB   GLU  56           HB1      GLU  56 151.445   0.886 -12.913
 1148   1HG   GLU  56           HG2      GLU  56 153.136   2.199 -11.684
 1149   2HG   GLU  56           HG1      GLU  56 152.868   1.204 -10.252
 1150    H    ASP  57           HN       ASP  57 149.901   2.964 -13.578
 1151    HA   ASP  57           HA       ASP  57 151.839   5.108 -13.464
 1152   1HB   ASP  57           HB2      ASP  57 149.434   4.644 -15.243
 1153   2HB   ASP  57           HB1      ASP  57 150.543   6.000 -15.450
 1154    H    LEU  58           HN       LEU  58 148.381   4.940 -12.826
 1155    HA   LEU  58           HA       LEU  58 148.117   7.798 -12.374
 1156   1HB   LEU  58           HB2      LEU  58 146.387   5.502 -11.414
 1157   2HB   LEU  58           HB1      LEU  58 145.952   7.202 -11.282
 1158    HG   LEU  58           HG       LEU  58 146.569   5.793 -13.897
 1159   1HD1  LEU  58          HD12      LEU  58 144.499   4.959 -12.767
 1160   2HD1  LEU  58          HD11      LEU  58 143.883   6.611 -12.752
 1161   3HD1  LEU  58          HD13      LEU  58 144.166   5.788 -14.287
 1162   1HD2  LEU  58          HD22      LEU  58 145.753   8.596 -13.138
 1163   2HD2  LEU  58          HD21      LEU  58 146.940   8.065 -14.328
 1164   3HD2  LEU  58          HD23      LEU  58 145.221   7.934 -14.682
 1165    H    PHE  59           HN       PHE  59 148.757   5.017 -10.286
 1166    HA   PHE  59           HA       PHE  59 148.674   6.460  -7.804
 1167   1HB   PHE  59           HB2      PHE  59 148.597   4.044  -7.777
 1168   2HB   PHE  59           HB1      PHE  59 150.140   3.938  -8.622
 1169    HD1  PHE  59           HD1      PHE  59 148.511   4.911  -5.430
 1170    HD2  PHE  59           HD2      PHE  59 152.222   4.176  -7.464
 1171    HE1  PHE  59           HE1      PHE  59 149.709   4.946  -3.257
 1172    HE2  PHE  59           HE2      PHE  59 153.420   4.210  -5.293
 1173    HZ   PHE  59           HZ       PHE  59 152.163   4.596  -3.189
 1174    H    ARG  60           HN       ARG  60 151.398   5.610  -9.960
 1175    HA   ARG  60           HA       ARG  60 153.431   6.864  -8.426
 1176   1HB   ARG  60           HB2      ARG  60 153.200   6.386 -11.405
 1177   2HB   ARG  60           HB1      ARG  60 154.657   7.013 -10.638
 1178   1HG   ARG  60           HG2      ARG  60 154.851   5.014  -9.268
 1179   2HG   ARG  60           HG1      ARG  60 153.326   4.395  -9.885
 1180   1HD   ARG  60           HD2      ARG  60 155.236   3.343 -11.039
 1181   2HD   ARG  60           HD1      ARG  60 154.283   4.316 -12.162
 1182    HE   ARG  60           HE       ARG  60 156.219   6.078 -11.293
 1183   1HH1  ARG  60          HH21      ARG  60 156.186   2.876 -12.566
 1184   2HH1  ARG  60          HH22      ARG  60 157.714   3.033 -13.366
 1185   1HH2  ARG  60          HH11      ARG  60 158.214   6.307 -12.335
 1186   2HH2  ARG  60          HH12      ARG  60 158.862   4.978 -13.237
 1187    H    GLU  61           HN       GLU  61 151.455   8.231 -11.101
 1188    HA   GLU  61           HA       GLU  61 152.736  10.791 -11.049
 1189   1HB   GLU  61           HB2      GLU  61 151.298  10.051 -12.921
 1190   2HB   GLU  61           HB1      GLU  61 149.895  10.082 -11.851
 1191   1HG   GLU  61           HG2      GLU  61 150.173  12.490 -11.503
 1192   2HG   GLU  61           HG1      GLU  61 151.636  12.484 -12.490
 1193    H    TRP  62           HN       TRP  62 150.010   9.423  -9.244
 1194    HA   TRP  62           HA       TRP  62 149.177  11.865  -8.015
 1195   1HB   TRP  62           HB2      TRP  62 147.694   9.984  -7.912
 1196   2HB   TRP  62           HB1      TRP  62 148.925   8.975  -7.156
 1197    HD1  TRP  62           HD1      TRP  62 146.580  11.917  -6.399
 1198    HE1  TRP  62           HE1      TRP  62 146.362  12.158  -3.840
 1199    HE3  TRP  62           HE3      TRP  62 150.051   8.483  -4.890
 1200    HZ2  TRP  62           HZ2      TRP  62 147.521  11.040  -1.460
 1201    HZ3  TRP  62           HZ3      TRP  62 150.461   8.086  -2.481
 1202    HH2  TRP  62           HH2      TRP  62 149.204   9.360  -0.767
 1203    H    LEU  63           HN       LEU  63 151.455   9.355  -6.870
 1204    HA   LEU  63           HA       LEU  63 151.974  10.706  -4.385
 1205   1HB   LEU  63           HB2      LEU  63 152.404   8.304  -4.686
 1206   2HB   LEU  63           HB1      LEU  63 153.645   8.667  -5.881
 1207    HG   LEU  63           HG       LEU  63 154.924   9.902  -4.134
 1208   1HD1  LEU  63          HD12      LEU  63 152.569   9.065  -2.455
 1209   2HD1  LEU  63          HD11      LEU  63 154.148   9.303  -1.712
 1210   3HD1  LEU  63          HD13      LEU  63 153.357  10.639  -2.544
 1211   1HD2  LEU  63          HD21      LEU  63 154.173   7.048  -3.451
 1212   2HD2  LEU  63          HD23      LEU  63 155.434   7.552  -4.575
 1213   3HD2  LEU  63          HD22      LEU  63 155.605   7.887  -2.852
 1214    H    LYS  64           HN       LYS  64 153.793  10.575  -7.441
 1215    HA   LYS  64           HA       LYS  64 155.964  12.212  -6.594
 1216   1HB   LYS  64           HB2      LYS  64 156.017  10.913  -8.692
 1217   2HB   LYS  64           HB1      LYS  64 154.776  11.967  -9.370
 1218   1HG   LYS  64           HG2      LYS  64 156.243  13.885  -9.261
 1219   2HG   LYS  64           HG1      LYS  64 157.445  12.974  -8.351
 1220   1HD   LYS  64           HD2      LYS  64 158.231  13.027 -10.610
 1221   2HD   LYS  64           HD1      LYS  64 157.597  11.403 -10.349
 1222   1HE   LYS  64           HE2      LYS  64 155.580  11.897 -11.540
 1223   2HE   LYS  64           HE1      LYS  64 155.924  13.625 -11.546
 1224   1HZ   LYS  64           HZ3      LYS  64 157.785  11.717 -12.801
 1225   2HZ   LYS  64           HZ2      LYS  64 156.414  12.263 -13.642
 1226   3HZ   LYS  64           HZ1      LYS  64 157.587  13.373 -13.111
 1227    H    ASP  65           HN       ASP  65 152.977  13.133  -8.304
 1228    HA   ASP  65           HA       ASP  65 153.581  15.951  -8.262
 1229   1HB   ASP  65           HB2      ASP  65 150.990  14.426  -8.639
 1230   2HB   ASP  65           HB1      ASP  65 151.110  16.180  -8.781
 1231    H    THR  66           HN       THR  66 152.126  13.754  -5.961
 1232    HA   THR  66           HA       THR  66 150.900  15.872  -4.385
 1233    HB   THR  66           HB       THR  66 151.385  12.941  -3.805
 1234    HG1  THR  66           HG1      THR  66 149.046  14.417  -4.432
 1235   1HG2  THR  66          HG23      THR  66 150.010  15.113  -2.220
 1236   2HG2  THR  66          HG22      THR  66 149.603  13.410  -2.014
 1237   3HG2  THR  66          HG21      THR  66 151.238  13.973  -1.671
 1238    H    CYS  67           HN       CYS  67 153.997  14.063  -4.186
 1239    HA   CYS  67           HA       CYS  67 154.756  15.936  -1.957
 1240   1HB   CYS  67           HB2      CYS  67 155.849  14.140  -0.790
 1241   2HB   CYS  67           HB1      CYS  67 154.196  13.631  -1.136
 1242    HG   CYS  67           HG       CYS  67 155.076  12.101  -3.029
 1243    H    GLY  68           HN       GLY  68 155.832  14.064  -4.753
 1244   1HA   GLY  68           HA2      GLY  68 157.584  15.029  -6.187
 1245   2HA   GLY  68           HA1      GLY  68 158.367  15.670  -4.745
 1246    H    ALA  69           HN       ALA  69 157.116  12.488  -4.360
 1247    HA   ALA  69           HA       ALA  69 159.584  11.312  -3.697
 1248   1HB   ALA  69           HB3      ALA  69 157.340  10.313  -3.222
 1249   2HB   ALA  69           HB2      ALA  69 157.203   9.891  -4.930
 1250   3HB   ALA  69           HB1      ALA  69 158.465   9.159  -3.938
 1251    H    ASN  70           HN       ASN  70 160.994   9.859  -4.900
 1252    HA   ASN  70           HA       ASN  70 161.194  10.610  -7.754
 1253   1HB   ASN  70           HB2      ASN  70 163.169  10.554  -6.109
 1254   2HB   ASN  70           HB1      ASN  70 163.063   8.796  -6.218
 1255   1HD2  ASN  70          HD22      ASN  70 165.181   8.995  -9.039
 1256   2HD2  ASN  70          HD21      ASN  70 164.952   8.384  -7.473
 1257    H    ALA  71           HN       ALA  71 161.918   8.718  -9.225
 1258    HA   ALA  71           HA       ALA  71 159.759   6.880  -9.455
 1259   1HB   ALA  71           HB1      ALA  71 161.320   7.695 -11.293
 1260   2HB   ALA  71           HB3      ALA  71 162.487   6.515 -10.698
 1261   3HB   ALA  71           HB2      ALA  71 160.930   5.976 -11.324
 1262    H    LYS  72           HN       LYS  72 162.936   6.495  -7.884
 1263    HA   LYS  72           HA       LYS  72 162.721   3.616  -7.727
 1264   1HB   LYS  72           HB2      LYS  72 164.886   4.803  -7.517
 1265   2HB   LYS  72           HB1      LYS  72 164.343   5.498  -5.989
 1266   1HG   LYS  72           HG2      LYS  72 164.223   3.338  -4.948
 1267   2HG   LYS  72           HG1      LYS  72 164.436   2.515  -6.490
 1268   1HD   LYS  72           HD2      LYS  72 166.558   2.435  -5.360
 1269   2HD   LYS  72           HD1      LYS  72 166.712   3.608  -6.663
 1270   1HE   LYS  72           HE2      LYS  72 165.928   4.491  -3.886
 1271   2HE   LYS  72           HE1      LYS  72 167.619   4.258  -4.319
 1272   1HZ   LYS  72           HZ1      LYS  72 166.515   5.687  -6.392
 1273   2HZ   LYS  72           HZ3      LYS  72 165.881   6.398  -4.988
 1274   3HZ   LYS  72           HZ2      LYS  72 167.563   6.275  -5.192
 1275    H    GLN  73           HN       GLN  73 161.914   6.226  -5.439
 1276    HA   GLN  73           HA       GLN  73 161.160   4.461  -3.308
 1277   1HB   GLN  73           HB2      GLN  73 160.549   7.353  -3.930
 1278   2HB   GLN  73           HB1      GLN  73 159.842   6.550  -2.528
 1279   1HG   GLN  73           HG2      GLN  73 161.901   7.670  -1.851
 1280   2HG   GLN  73           HG1      GLN  73 162.143   5.925  -1.776
 1281   1HE2  GLN  73          HE22      GLN  73 164.696   5.929  -4.204
 1282   2HE2  GLN  73          HE21      GLN  73 163.783   5.030  -3.090
 1283    H    SER  74           HN       SER  74 159.336   5.830  -6.036
 1284    HA   SER  74           HA       SER  74 156.771   5.052  -5.053
 1285   1HB   SER  74           HB2      SER  74 157.388   6.666  -6.988
 1286   2HB   SER  74           HB1      SER  74 157.466   5.214  -7.982
 1287    HG   SER  74           HG       SER  74 155.262   5.720  -6.295
 1288    H    ARG  75           HN       ARG  75 159.183   3.341  -7.071
 1289    HA   ARG  75           HA       ARG  75 157.513   1.153  -7.782
 1290   1HB   ARG  75           HB2      ARG  75 160.507   1.288  -7.349
 1291   2HB   ARG  75           HB1      ARG  75 159.683  -0.139  -7.978
 1292   1HG   ARG  75           HG2      ARG  75 158.779   1.201  -9.842
 1293   2HG   ARG  75           HG1      ARG  75 159.610   2.625  -9.221
 1294   1HD   ARG  75           HD2      ARG  75 161.783   1.442  -9.475
 1295   2HD   ARG  75           HD1      ARG  75 160.930   0.057 -10.150
 1296    HE   ARG  75           HE       ARG  75 160.135   2.228 -11.719
 1297   1HH1  ARG  75          HH21      ARG  75 163.083   0.720 -10.757
 1298   2HH1  ARG  75          HH22      ARG  75 163.931   1.155 -12.204
 1299   1HH2  ARG  75          HH11      ARG  75 161.225   2.806 -13.608
 1300   2HH2  ARG  75          HH12      ARG  75 162.879   2.336 -13.818
 1301    H    ASP  76           HN       ASP  76 159.447   1.723  -4.840
 1302    HA   ASP  76           HA       ASP  76 159.010  -0.909  -3.772
 1303   1HB   ASP  76           HB2      ASP  76 159.717   1.721  -2.458
 1304   2HB   ASP  76           HB1      ASP  76 159.633   0.193  -1.580
 1305    H    CYS  77           HN       CYS  77 157.146   2.134  -3.462
 1306    HA   CYS  77           HA       CYS  77 155.390   1.098  -1.424
 1307   1HB   CYS  77           HB2      CYS  77 155.104   3.342  -3.438
 1308   2HB   CYS  77           HB1      CYS  77 153.896   2.992  -2.203
 1309    HG   CYS  77           HG       CYS  77 156.421   4.523  -1.717
 1310    H    PHE  78           HN       PHE  78 155.212   1.217  -5.001
 1311    HA   PHE  78           HA       PHE  78 152.551   0.237  -5.217
 1312   1HB   PHE  78           HB2      PHE  78 153.746   1.143  -7.141
 1313   2HB   PHE  78           HB1      PHE  78 154.922  -0.168  -7.062
 1314    HD1  PHE  78           HD1      PHE  78 151.457   0.745  -7.929
 1315    HD2  PHE  78           HD2      PHE  78 154.339  -2.435  -7.737
 1316    HE1  PHE  78           HE1      PHE  78 149.992  -0.671  -9.347
 1317    HE2  PHE  78           HE2      PHE  78 152.874  -3.850  -9.150
 1318    HZ   PHE  78           HZ       PHE  78 150.702  -2.967  -9.956
 1319    H    GLY  79           HN       GLY  79 155.577  -1.661  -5.566
 1320   1HA   GLY  79           HA2      GLY  79 154.315  -4.198  -5.523
 1321   2HA   GLY  79           HA1      GLY  79 156.001  -3.911  -5.099
 1322    H    CYS  80           HN       CYS  80 155.340  -2.085  -2.898
 1323    HA   CYS  80           HA       CYS  80 155.085  -4.057  -0.796
 1324   1HB   CYS  80           HB2      CYS  80 156.310  -1.938  -0.467
 1325   2HB   CYS  80           HB1      CYS  80 154.805  -1.039  -0.656
 1326    HG   CYS  80           HG       CYS  80 155.009  -3.139   1.640
 1327    H    LEU  81           HN       LEU  81 152.838  -1.490  -1.976
 1328    HA   LEU  81           HA       LEU  81 150.705  -2.391  -0.247
 1329   1HB   LEU  81           HB2      LEU  81 150.592  -0.742  -2.794
 1330   2HB   LEU  81           HB1      LEU  81 149.271  -0.931  -1.644
 1331    HG   LEU  81           HG       LEU  81 151.976   0.315  -1.053
 1332   1HD1  LEU  81          HD13      LEU  81 149.202   1.497  -1.372
 1333   2HD1  LEU  81          HD12      LEU  81 150.600   2.389  -0.773
 1334   3HD1  LEU  81          HD11      LEU  81 150.591   1.771  -2.425
 1335   1HD2  LEU  81          HD23      LEU  81 149.623  -0.421   0.677
 1336   2HD2  LEU  81          HD22      LEU  81 151.347  -0.558   1.020
 1337   3HD2  LEU  81          HD21      LEU  81 150.562   1.016   1.076
 1338    H    ARG  82           HN       ARG  82 151.584  -3.046  -3.635
 1339    HA   ARG  82           HA       ARG  82 149.258  -4.512  -4.350
 1340   1HB   ARG  82           HB2      ARG  82 150.966  -3.774  -5.980
 1341   2HB   ARG  82           HB1      ARG  82 152.108  -4.928  -5.294
 1342   1HG   ARG  82           HG2      ARG  82 150.726  -6.797  -5.958
 1343   2HG   ARG  82           HG1      ARG  82 149.429  -5.714  -6.468
 1344   1HD   ARG  82           HD2      ARG  82 150.776  -4.833  -8.269
 1345   2HD   ARG  82           HD1      ARG  82 152.205  -5.680  -7.683
 1346    HE   ARG  82           HE       ARG  82 150.335  -7.695  -8.151
 1347   1HH1  ARG  82          HH21      ARG  82 151.761  -5.101  -9.919
 1348   2HH1  ARG  82          HH22      ARG  82 151.655  -5.909 -11.447
 1349   1HH2  ARG  82          HH11      ARG  82 150.187  -8.762 -10.136
 1350   2HH2  ARG  82          HH12      ARG  82 150.765  -7.982 -11.569
 1351    H    GLU  83           HN       GLU  83 152.298  -5.601  -2.850
 1352    HA   GLU  83           HA       GLU  83 151.530  -8.379  -2.785
 1353   1HB   GLU  83           HB2      GLU  83 153.630  -6.823  -1.269
 1354   2HB   GLU  83           HB1      GLU  83 153.405  -8.564  -1.094
 1355   1HG   GLU  83           HG2      GLU  83 153.768  -8.873  -3.502
 1356   2HG   GLU  83           HG1      GLU  83 153.964  -7.135  -3.711
 1357    H    TRP  84           HN       TRP  84 151.174  -5.712  -0.426
 1358    HA   TRP  84           HA       TRP  84 150.327  -7.342   1.756
 1359   1HB   TRP  84           HB2      TRP  84 150.858  -4.863   1.868
 1360   2HB   TRP  84           HB1      TRP  84 149.301  -4.562   1.098
 1361    HD1  TRP  84           HD1      TRP  84 150.869  -5.726   4.356
 1362    HE1  TRP  84           HE1      TRP  84 149.050  -5.813   6.186
 1363    HE3  TRP  84           HE3      TRP  84 146.709  -4.882   1.516
 1364    HZ2  TRP  84           HZ2      TRP  84 146.216  -5.566   6.414
 1365    HZ3  TRP  84           HZ3      TRP  84 144.466  -4.816   2.565
 1366    HH2  TRP  84           HH2      TRP  84 144.214  -5.156   5.007
 1367    H    CYS  85           HN       CYS  85 148.579  -5.846  -0.945
 1368    HA   CYS  85           HA       CYS  85 145.953  -6.674  -0.199
 1369   1HB   CYS  85           HB2      CYS  85 147.275  -6.005  -2.829
 1370   2HB   CYS  85           HB1      CYS  85 145.590  -6.514  -2.769
 1371    HG   CYS  85           HG       CYS  85 145.074  -4.439  -1.245
 1372    H    ASP  86           HN       ASP  86 148.496  -8.264  -2.086
 1373    HA   ASP  86           HA       ASP  86 147.010 -10.532  -2.939
 1374   1HB   ASP  86           HB2      ASP  86 149.958 -10.179  -2.342
 1375   2HB   ASP  86           HB1      ASP  86 149.284 -11.646  -3.053
 1376    H    ALA  87           HN       ALA  87 148.673  -9.856   0.112
 1377    HA   ALA  87           HA       ALA  87 148.208 -12.593   1.094
 1378   1HB   ALA  87           HB2      ALA  87 150.233 -11.112   1.665
 1379   2HB   ALA  87           HB1      ALA  87 149.140 -10.238   2.740
 1380   3HB   ALA  87           HB3      ALA  87 149.454 -11.953   3.006
 1381    H    PHE  88           HN       PHE  88 146.879  -9.347   1.626
 1382    HA   PHE  88           HA       PHE  88 144.875 -10.518   3.520
 1383   1HB   PHE  88           HB2      PHE  88 145.701  -7.656   2.973
 1384   2HB   PHE  88           HB1      PHE  88 144.416  -8.126   4.087
 1385    HD1  PHE  88           HD2      PHE  88 144.955  -9.591   6.061
 1386    HD2  PHE  88           HD1      PHE  88 148.007  -7.845   3.594
 1387    HE1  PHE  88           HE2      PHE  88 146.632 -10.017   7.835
 1388    HE2  PHE  88           HE1      PHE  88 149.685  -8.270   5.368
 1389    HZ   PHE  88           HZ       PHE  88 148.997  -9.355   7.489
 1390    H    LEU  89           HN       LEU  89 144.412  -7.602   1.597
 1391    HA   LEU  89           HA       LEU  89 141.843  -8.693   0.634
 1392   1HB   LEU  89           HB2      LEU  89 141.758  -6.434   1.452
 1393   2HB   LEU  89           HB1      LEU  89 143.144  -5.960   0.472
 1394    HG   LEU  89           HG       LEU  89 141.874  -6.178  -1.567
 1395   1HD1  LEU  89          HD12      LEU  89 139.819  -7.461   0.240
 1396   2HD1  LEU  89          HD11      LEU  89 139.380  -6.805  -1.338
 1397   3HD1  LEU  89          HD13      LEU  89 140.551  -8.119  -1.224
 1398   1HD2  LEU  89          HD22      LEU  89 141.532  -4.124  -0.132
 1399   2HD2  LEU  89          HD21      LEU  89 140.201  -4.467  -1.237
 1400   3HD2  LEU  89          HD23      LEU  89 140.054  -4.871   0.475
   
  No H/Q in entry =        1400
  Start of MODEL   15
    1   1H    MET   1           HT3      MET   1 119.974  -8.980  12.260
    2   2H    MET   1           HT2      MET   1 120.394  -9.280  13.879
    3   3H    MET   1           HT1      MET   1 121.244 -10.045  12.623
    4    HA   MET   1           HA       MET   1 119.885 -11.765  12.852
    5   1HB   MET   1           HB2      MET   1 118.204  -9.854  14.497
    6   2HB   MET   1           HB1      MET   1 117.817 -11.564  14.286
    7   1HG   MET   1           HG2      MET   1 120.012 -12.178  15.234
    8   2HG   MET   1           HG1      MET   1 120.395 -10.471  15.451
    9   1HE   MET   1           HE1      MET   1 120.886 -12.114  17.563
   10   2HE   MET   1           HE3      MET   1 120.675 -10.489  18.226
   11   3HE   MET   1           HE2      MET   1 119.902 -11.868  19.002
   12    H    THR   2           HN       THR   2 118.201  -8.721  12.109
   13    HA   THR   2           HA       THR   2 116.276 -10.143  10.374
   14    HB   THR   2           HB       THR   2 115.353  -7.882   9.963
   15    HG1  THR   2           HG1      THR   2 117.784  -7.201  10.947
   16   1HG2  THR   2          HG23      THR   2 115.917  -8.590  12.852
   17   2HG2  THR   2          HG22      THR   2 114.747  -7.370  12.353
   18   3HG2  THR   2          HG21      THR   2 114.511  -9.056  11.895
   19    H    THR   3           HN       THR   3 119.428  -9.225  10.075
   20    HA   THR   3           HA       THR   3 119.391  -7.995   7.451
   21    HB   THR   3           HB       THR   3 121.792  -8.369   7.451
   22    HG1  THR   3           HG1      THR   3 122.734  -9.767   8.855
   23   1HG2  THR   3          HG21      THR   3 120.814  -6.637   9.001
   24   2HG2  THR   3          HG23      THR   3 120.934  -7.822  10.303
   25   3HG2  THR   3          HG22      THR   3 122.394  -7.243   9.499
   26    H    SER   4           HN       SER   4 120.181  -9.095   5.473
   27    HA   SER   4           HA       SER   4 118.903 -11.699   5.166
   28   1HB   SER   4           HB2      SER   4 118.850 -10.002   3.361
   29   2HB   SER   4           HB1      SER   4 120.601 -10.116   3.213
   30    HG   SER   4           HG       SER   4 120.375 -12.249   2.580
   31    H    GLN   5           HN       GLN   5 120.089 -13.511   4.142
   32    HA   GLN   5           HA       GLN   5 122.260 -14.396   5.738
   33   1HB   GLN   5           HB2      GLN   5 120.690 -15.871   4.483
   34   2HB   GLN   5           HB1      GLN   5 121.457 -15.366   2.978
   35   1HG   GLN   5           HG2      GLN   5 123.608 -16.267   3.757
   36   2HG   GLN   5           HG1      GLN   5 122.863 -16.746   5.283
   37   1HE2  GLN   5          HE22      GLN   5 122.820 -19.632   2.817
   38   2HE2  GLN   5          HE21      GLN   5 124.065 -18.612   3.354
   39    H    LYS   6           HN       LYS   6 122.225 -12.500   2.793
   40    HA   LYS   6           HA       LYS   6 124.866 -13.017   1.881
   41   1HB   LYS   6           HB2      LYS   6 123.120 -10.556   1.670
   42   2HB   LYS   6           HB1      LYS   6 124.681 -10.702   0.861
   43   1HG   LYS   6           HG2      LYS   6 123.893 -12.735  -0.296
   44   2HG   LYS   6           HG1      LYS   6 122.331 -12.588   0.508
   45   1HD   LYS   6           HD2      LYS   6 121.982 -10.393  -0.562
   46   2HD   LYS   6           HD1      LYS   6 123.545 -10.535  -1.369
   47   1HE   LYS   6           HE2      LYS   6 122.673 -12.733  -2.350
   48   2HE   LYS   6           HE1      LYS   6 121.079 -12.238  -1.781
   49   1HZ   LYS   6           HZ2      LYS   6 122.488 -10.176  -3.205
   50   2HZ   LYS   6           HZ1      LYS   6 122.176 -11.550  -4.154
   51   3HZ   LYS   6           HZ3      LYS   6 120.895 -10.734  -3.399
   52    H    HIS   7           HN       HIS   7 123.677 -10.822   4.412
   53    HA   HIS   7           HA       HIS   7 126.084  -9.348   4.752
   54   1HB   HIS   7           HB2      HIS   7 124.137  -8.550   5.884
   55   2HB   HIS   7           HB1      HIS   7 123.877 -10.098   6.685
   56    HD2  HIS   7           HD2      HIS   7 125.534 -10.564   8.955
   57    HE1  HIS   7           HE1      HIS   7 127.295  -6.729   9.025
   58    HE2  HIS   7           HE2      HIS   7 127.026  -8.903  10.298
   59    H    ARG   8           HN       ARG   8 125.028 -12.347   6.402
   60    HA   ARG   8           HA       ARG   8 127.444 -12.631   7.919
   61   1HB   ARG   8           HB2      ARG   8 125.270 -14.594   7.139
   62   2HB   ARG   8           HB1      ARG   8 126.577 -14.974   8.265
   63   1HG   ARG   8           HG2      ARG   8 125.875 -13.101   9.708
   64   2HG   ARG   8           HG1      ARG   8 124.563 -12.728   8.593
   65   1HD   ARG   8           HD2      ARG   8 123.744 -15.099   8.930
   66   2HD   ARG   8           HD1      ARG   8 124.919 -15.259  10.230
   67    HE   ARG   8           HE       ARG   8 122.336 -13.999  10.387
   68   1HH1  ARG   8          HH21      ARG   8 125.607 -13.523  11.393
   69   2HH1  ARG   8          HH22      ARG   8 125.188 -12.367  12.611
   70   1HH2  ARG   8          HH11      ARG   8 121.790 -12.518  11.973
   71   2HH2  ARG   8          HH12      ARG   8 123.034 -11.804  12.943
   72    H    ASP   9           HN       ASP   9 126.405 -13.771   4.749
   73    HA   ASP   9           HA       ASP   9 128.613 -15.610   4.383
   74   1HB   ASP   9           HB2      ASP   9 126.750 -14.260   2.422
   75   2HB   ASP   9           HB1      ASP   9 127.991 -15.410   1.932
   76    H    PHE  10           HN       PHE  10 128.059 -12.198   3.637
   77    HA   PHE  10           HA       PHE  10 130.375 -11.788   2.018
   78   1HB   PHE  10           HB2      PHE  10 128.405 -10.212   2.362
   79   2HB   PHE  10           HB1      PHE  10 129.129  -9.778   3.909
   80    HD1  PHE  10           HD2      PHE  10 131.251  -8.537   4.011
   81    HD2  PHE  10           HD1      PHE  10 129.441  -9.583   0.258
   82    HE1  PHE  10           HE2      PHE  10 132.748  -6.940   2.841
   83    HE2  PHE  10           HE1      PHE  10 130.934  -7.987  -0.910
   84    HZ   PHE  10           HZ       PHE  10 132.585  -6.665   0.380
   85    H    VAL  11           HN       VAL  11 129.881 -11.386   5.539
   86    HA   VAL  11           HA       VAL  11 132.702 -10.719   5.969
   87    HB   VAL  11           HB       VAL  11 132.076 -10.706   8.353
   88   1HG1  VAL  11          HG12      VAL  11 130.138  -9.374   6.443
   89   2HG1  VAL  11          HG11      VAL  11 130.196  -9.012   8.168
   90   3HG1  VAL  11          HG13      VAL  11 131.596  -8.677   7.150
   91   1HG2  VAL  11          HG21      VAL  11 129.553 -11.945   7.247
   92   2HG2  VAL  11          HG23      VAL  11 130.580 -12.539   8.550
   93   3HG2  VAL  11          HG22      VAL  11 129.567 -11.119   8.806
   94    H    ALA  12           HN       ALA  12 131.625 -13.506   4.959
   95    HA   ALA  12           HA       ALA  12 133.082 -15.191   6.977
   96   1HB   ALA  12           HB1      ALA  12 130.661 -15.743   6.551
   97   2HB   ALA  12           HB3      ALA  12 131.101 -16.120   4.885
   98   3HB   ALA  12           HB2      ALA  12 131.778 -17.065   6.212
   99    H    GLU  13           HN       GLU  13 133.329 -13.845   3.864
  100    HA   GLU  13           HA       GLU  13 135.674 -15.534   3.315
  101   1HB   GLU  13           HB2      GLU  13 134.817 -15.974   0.949
  102   2HB   GLU  13           HB1      GLU  13 134.022 -16.885   2.233
  103   1HG   GLU  13           HG2      GLU  13 132.130 -15.424   2.226
  104   2HG   GLU  13           HG1      GLU  13 132.962 -14.243   1.215
  105    HA   PRO  14           HA       PRO  14 137.424 -11.767   1.683
  106   1HB   PRO  14           HB2      PRO  14 137.981 -13.313  -0.834
  107   2HB   PRO  14           HB1      PRO  14 139.072 -12.291   0.124
  108   1HG   PRO  14           HG2      PRO  14 139.181 -14.963   0.248
  109   2HG   PRO  14           HG1      PRO  14 139.487 -13.947   1.668
  110   1HD   PRO  14           HD2      PRO  14 137.122 -15.657   1.065
  111   2HD   PRO  14           HD1      PRO  14 137.766 -15.123   2.633
  112    H    MET  15           HN       MET  15 136.999 -10.126  -0.025
  113    HA   MET  15           HA       MET  15 134.261 -10.416  -1.120
  114   1HB   MET  15           HB2      MET  15 134.749  -7.950  -1.796
  115   2HB   MET  15           HB1      MET  15 134.548  -8.329  -0.087
  116   1HG   MET  15           HG2      MET  15 136.856  -8.198   0.345
  117   2HG   MET  15           HG1      MET  15 137.283  -8.388  -1.355
  118   1HE   MET  15           HE1      MET  15 134.826  -6.193   0.750
  119   2HE   MET  15           HE3      MET  15 136.405  -6.047   1.522
  120   3HE   MET  15           HE2      MET  15 135.657  -4.649   0.756
  121    H    GLY  16           HN       GLY  16 137.578 -10.407  -2.206
  122   1HA   GLY  16           HA2      GLY  16 138.509 -10.618  -4.348
  123   2HA   GLY  16           HA1      GLY  16 137.064 -11.562  -4.705
  124    H    GLU  17           HN       GLU  17 136.477 -10.796  -6.700
  125    HA   GLU  17           HA       GLU  17 136.313  -7.838  -7.116
  126   1HB   GLU  17           HB2      GLU  17 136.381 -10.171  -9.045
  127   2HB   GLU  17           HB1      GLU  17 136.078  -8.508  -9.542
  128   1HG   GLU  17           HG2      GLU  17 138.240  -7.817  -8.575
  129   2HG   GLU  17           HG1      GLU  17 138.548  -9.481  -8.079
  130    H    LYS  18           HN       LYS  18 134.249  -9.441  -5.624
  131    HA   LYS  18           HA       LYS  18 131.973  -9.901  -7.266
  132   1HB   LYS  18           HB2      LYS  18 132.103  -8.967  -4.378
  133   2HB   LYS  18           HB1      LYS  18 130.668  -9.630  -5.153
  134   1HG   LYS  18           HG2      LYS  18 133.222 -11.231  -5.208
  135   2HG   LYS  18           HG1      LYS  18 132.266 -11.199  -3.728
  136   1HD   LYS  18           HD2      LYS  18 130.340 -12.097  -4.846
  137   2HD   LYS  18           HD1      LYS  18 131.084 -11.886  -6.431
  138   1HE   LYS  18           HE2      LYS  18 131.238 -14.235  -5.739
  139   2HE   LYS  18           HE1      LYS  18 132.848 -13.515  -5.802
  140   1HZ   LYS  18           HZ2      LYS  18 131.499 -13.248  -3.261
  141   2HZ   LYS  18           HZ1      LYS  18 131.864 -14.850  -3.696
  142   3HZ   LYS  18           HZ3      LYS  18 133.102 -13.695  -3.601
  143    HA   PRO  19           HA       PRO  19 130.902  -5.759  -8.437
  144   1HB   PRO  19           HB2      PRO  19 128.149  -5.947  -8.658
  145   2HB   PRO  19           HB1      PRO  19 129.286  -6.594  -9.857
  146   1HG   PRO  19           HG2      PRO  19 127.828  -8.018  -7.677
  147   2HG   PRO  19           HG1      PRO  19 128.161  -8.539  -9.339
  148   1HD   PRO  19           HD2      PRO  19 129.607  -9.445  -7.211
  149   2HD   PRO  19           HD1      PRO  19 130.315  -9.254  -8.829
  150    H    VAL  20           HN       VAL  20 129.937  -3.795  -7.661
  151    HA   VAL  20           HA       VAL  20 129.992  -3.401  -4.885
  152    HB   VAL  20           HB       VAL  20 130.175  -1.550  -6.463
  153   1HG1  VAL  20          HG13      VAL  20 128.387  -2.572  -8.019
  154   2HG1  VAL  20          HG12      VAL  20 127.206  -1.785  -6.976
  155   3HG1  VAL  20          HG11      VAL  20 128.395  -0.819  -7.848
  156   1HG2  VAL  20          HG21      VAL  20 129.224  -1.242  -4.098
  157   2HG2  VAL  20          HG23      VAL  20 128.899   0.055  -5.247
  158   3HG2  VAL  20          HG22      VAL  20 127.642  -1.120  -4.867
  159    H    GLY  21           HN       GLY  21 127.113  -3.849  -6.950
  160   1HA   GLY  21           HA2      GLY  21 125.131  -3.529  -4.993
  161   2HA   GLY  21           HA1      GLY  21 124.956  -4.571  -6.403
  162    H    SER  22           HN       SER  22 127.590  -5.819  -4.888
  163    HA   SER  22           HA       SER  22 126.000  -7.993  -3.734
  164   1HB   SER  22           HB2      SER  22 128.123  -8.431  -4.964
  165   2HB   SER  22           HB1      SER  22 129.004  -7.557  -3.714
  166    HG   SER  22           HG       SER  22 128.894  -9.890  -3.444
  167    H    LEU  23           HN       LEU  23 127.512  -5.093  -2.624
  168    HA   LEU  23           HA       LEU  23 127.995  -5.849   0.100
  169   1HB   LEU  23           HB2      LEU  23 127.369  -3.160  -1.143
  170   2HB   LEU  23           HB1      LEU  23 127.871  -3.370   0.533
  171    HG   LEU  23           HG       LEU  23 129.487  -4.344  -1.844
  172   1HD1  LEU  23          HD12      LEU  23 129.168  -1.793  -1.640
  173   2HD1  LEU  23          HD11      LEU  23 130.110  -1.917  -0.153
  174   3HD1  LEU  23          HD13      LEU  23 130.826  -2.388  -1.693
  175   1HD2  LEU  23          HD22      LEU  23 129.896  -4.306   1.144
  176   2HD2  LEU  23          HD21      LEU  23 130.269  -5.577  -0.018
  177   3HD2  LEU  23          HD23      LEU  23 131.300  -4.154   0.092
  178    H    ALA  24           HN       ALA  24 126.670  -5.888   1.855
  179    HA   ALA  24           HA       ALA  24 123.846  -6.191   1.473
  180   1HB   ALA  24           HB1      ALA  24 125.544  -5.762   3.938
  181   2HB   ALA  24           HB3      ALA  24 123.801  -6.017   4.021
  182   3HB   ALA  24           HB2      ALA  24 124.847  -7.273   3.357
  183    H    GLY  25           HN       GLY  25 122.194  -4.732   1.609
  184   1HA   GLY  25           HA2      GLY  25 121.130  -2.690   2.348
  185   2HA   GLY  25           HA1      GLY  25 122.720  -2.000   2.677
  186    H    ILE  26           HN       ILE  26 123.550  -3.156  -0.078
  187    HA   ILE  26           HA       ILE  26 122.590  -0.801  -1.650
  188    HB   ILE  26           HB       ILE  26 124.797  -2.775  -2.317
  189   1HG1  ILE  26          HG12      ILE  26 125.396  -1.688  -0.234
  190   2HG1  ILE  26          HG11      ILE  26 126.330  -0.940  -1.527
  191   1HG2  ILE  26          HG23      ILE  26 124.082  -0.022  -3.362
  192   2HG2  ILE  26          HG22      ILE  26 125.554  -0.898  -3.786
  193   3HG2  ILE  26          HG21      ILE  26 123.978  -1.545  -4.246
  194   1HD1  ILE  26          HD13      ILE  26 124.364   0.783  -1.624
  195   2HD1  ILE  26          HD12      ILE  26 123.972   0.171  -0.019
  196   3HD1  ILE  26          HD11      ILE  26 125.542   0.913  -0.319
  197    H    GLY  27           HN       GLY  27 120.773  -1.281  -2.911
  198   1HA   GLY  27           HA2      GLY  27 120.368  -4.087  -3.772
  199   2HA   GLY  27           HA1      GLY  27 119.188  -2.784  -3.875
  200    H    GLU  28           HN       GLU  28 119.277  -4.121  -6.106
  201    HA   GLU  28           HA       GLU  28 121.324  -3.582  -7.985
  202   1HB   GLU  28           HB2      GLU  28 118.361  -4.067  -8.369
  203   2HB   GLU  28           HB1      GLU  28 119.498  -3.941  -9.713
  204   1HG   GLU  28           HG2      GLU  28 120.807  -5.811  -8.810
  205   2HG   GLU  28           HG1      GLU  28 119.717  -5.924  -7.426
  206    H    VAL  29           HN       VAL  29 118.438  -1.652  -7.151
  207    HA   VAL  29           HA       VAL  29 118.842   0.301  -9.221
  208    HB   VAL  29           HB       VAL  29 117.500   0.621  -6.519
  209   1HG1  VAL  29          HG12      VAL  29 117.539   2.310  -9.028
  210   2HG1  VAL  29          HG11      VAL  29 116.273   2.460  -7.808
  211   3HG1  VAL  29          HG13      VAL  29 117.952   2.799  -7.385
  212   1HG2  VAL  29          HG21      VAL  29 116.391  -0.073  -9.260
  213   2HG2  VAL  29          HG23      VAL  29 116.483  -1.159  -7.873
  214   3HG2  VAL  29          HG22      VAL  29 115.418   0.245  -7.824
  215    H    LEU  30           HN       LEU  30 119.787   0.278  -5.780
  216    HA   LEU  30           HA       LEU  30 121.162   2.797  -5.891
  217   1HB   LEU  30           HB2      LEU  30 121.599   0.451  -4.016
  218   2HB   LEU  30           HB1      LEU  30 122.212   2.083  -3.764
  219    HG   LEU  30           HG       LEU  30 119.271   1.377  -4.022
  220   1HD1  LEU  30          HD12      LEU  30 121.014   1.901  -1.598
  221   2HD1  LEU  30          HD11      LEU  30 119.251   1.900  -1.552
  222   3HD1  LEU  30          HD13      LEU  30 120.123   0.426  -1.970
  223   1HD2  LEU  30          HD23      LEU  30 120.804   3.933  -3.514
  224   2HD2  LEU  30          HD22      LEU  30 119.458   3.654  -4.619
  225   3HD2  LEU  30          HD21      LEU  30 119.167   3.741  -2.888
  226    H    GLY  31           HN       GLY  31 122.188  -0.544  -6.433
  227   1HA   GLY  31           HA2      GLY  31 124.989  -0.072  -6.580
  228   2HA   GLY  31           HA1      GLY  31 124.145  -1.372  -7.427
  229    H    LYS  32           HN       LYS  32 122.424   0.259  -9.015
  230    HA   LYS  32           HA       LYS  32 124.139   0.810 -11.240
  231   1HB   LYS  32           HB2      LYS  32 121.702   0.255 -11.414
  232   2HB   LYS  32           HB1      LYS  32 121.332   1.860 -10.782
  233   1HG   LYS  32           HG2      LYS  32 122.548   2.887 -12.671
  234   2HG   LYS  32           HG1      LYS  32 122.917   1.283 -13.304
  235   1HD   LYS  32           HD2      LYS  32 120.500   0.820 -13.531
  236   2HD   LYS  32           HD1      LYS  32 120.138   2.432 -12.911
  237   1HE   LYS  32           HE2      LYS  32 121.252   3.470 -14.801
  238   2HE   LYS  32           HE1      LYS  32 121.808   1.901 -15.385
  239   1HZ   LYS  32           HZ3      LYS  32 118.988   1.946 -14.975
  240   2HZ   LYS  32           HZ2      LYS  32 119.474   3.155 -16.066
  241   3HZ   LYS  32           HZ1      LYS  32 119.868   1.529 -16.364
  242    H    LYS  33           HN       LYS  33 122.666   2.969  -8.803
  243    HA   LYS  33           HA       LYS  33 123.498   5.406 -10.070
  244   1HB   LYS  33           HB2      LYS  33 122.948   4.769  -7.154
  245   2HB   LYS  33           HB1      LYS  33 123.183   6.400  -7.785
  246   1HG   LYS  33           HG2      LYS  33 121.275   6.090  -9.310
  247   2HG   LYS  33           HG1      LYS  33 121.028   4.461  -8.680
  248   1HD   LYS  33           HD2      LYS  33 120.644   5.391  -6.421
  249   2HD   LYS  33           HD1      LYS  33 120.879   7.020  -7.054
  250   1HE   LYS  33           HE2      LYS  33 118.594   5.122  -7.519
  251   2HE   LYS  33           HE1      LYS  33 118.549   6.834  -7.105
  252   1HZ   LYS  33           HZ2      LYS  33 119.576   7.216  -9.363
  253   2HZ   LYS  33           HZ1      LYS  33 119.190   5.600  -9.716
  254   3HZ   LYS  33           HZ3      LYS  33 117.956   6.705  -9.352
  255    H    LEU  34           HN       LEU  34 124.998   3.459  -7.475
  256    HA   LEU  34           HA       LEU  34 127.316   5.116  -7.198
  257   1HB   LEU  34           HB2      LEU  34 126.852   2.181  -6.607
  258   2HB   LEU  34           HB1      LEU  34 128.322   3.035  -6.164
  259    HG   LEU  34           HG       LEU  34 125.595   4.036  -5.330
  260   1HD1  LEU  34          HD12      LEU  34 125.872   1.729  -4.492
  261   2HD1  LEU  34          HD11      LEU  34 127.433   2.169  -3.799
  262   3HD1  LEU  34          HD13      LEU  34 125.955   2.897  -3.173
  263   1HD2  LEU  34          HD22      LEU  34 128.455   4.564  -4.460
  264   2HD2  LEU  34          HD21      LEU  34 127.244   5.725  -4.998
  265   3HD2  LEU  34          HD23      LEU  34 127.091   4.961  -3.422
  266    H    GLU  35           HN       GLU  35 126.601   2.325  -9.244
  267    HA   GLU  35           HA       GLU  35 129.211   1.983 -10.348
  268   1HB   GLU  35           HB2      GLU  35 127.388   0.352 -10.695
  269   2HB   GLU  35           HB1      GLU  35 126.532   1.525 -11.696
  270   1HG   GLU  35           HG2      GLU  35 128.326   1.527 -13.331
  271   2HG   GLU  35           HG1      GLU  35 129.320   0.498 -12.298
  272    H    GLU  36           HN       GLU  36 126.542   4.094 -11.344
  273    HA   GLU  36           HA       GLU  36 127.857   5.132 -13.687
  274   1HB   GLU  36           HB2      GLU  36 125.658   6.248 -11.923
  275   2HB   GLU  36           HB1      GLU  36 126.197   7.029 -13.408
  276   1HG   GLU  36           HG2      GLU  36 125.217   4.165 -13.280
  277   2HG   GLU  36           HG1      GLU  36 124.188   5.533 -13.703
  278    H    ARG  37           HN       ARG  37 128.230   5.668 -10.312
  279    HA   ARG  37           HA       ARG  37 129.528   8.302 -10.679
  280   1HB   ARG  37           HB2      ARG  37 128.956   6.607  -8.249
  281   2HB   ARG  37           HB1      ARG  37 129.882   8.106  -8.172
  282   1HG   ARG  37           HG2      ARG  37 127.984   9.315  -9.186
  283   2HG   ARG  37           HG1      ARG  37 127.054   7.820  -9.226
  284   1HD   ARG  37           HD2      ARG  37 127.290   7.636  -6.764
  285   2HD   ARG  37           HD1      ARG  37 128.150   9.172  -6.740
  286    HE   ARG  37           HE       ARG  37 125.288   8.778  -6.801
  287   1HH1  ARG  37          HH21      ARG  37 127.764  10.767  -8.158
  288   2HH1  ARG  37          HH22      ARG  37 126.662  12.003  -8.660
  289   1HH2  ARG  37          HH11      ARG  37 123.859  10.379  -7.440
  290   2HH2  ARG  37          HH12      ARG  37 124.458  11.787  -8.253
  291    H    GLY  38           HN       GLY  38 130.578   5.180 -11.161
  292   1HA   GLY  38           HA2      GLY  38 132.902   4.845 -11.817
  293   2HA   GLY  38           HA1      GLY  38 133.400   6.023 -10.611
  294    H    PHE  39           HN       PHE  39 131.065   3.990  -9.237
  295    HA   PHE  39           HA       PHE  39 133.220   2.351  -7.944
  296   1HB   PHE  39           HB2      PHE  39 130.386   2.954  -7.071
  297   2HB   PHE  39           HB1      PHE  39 131.532   1.974  -6.166
  298    HD1  PHE  39           HD2      PHE  39 133.461   2.996  -5.057
  299    HD2  PHE  39           HD1      PHE  39 130.638   5.365  -7.246
  300    HE1  PHE  39           HE2      PHE  39 134.392   5.052  -4.028
  301    HE2  PHE  39           HE1      PHE  39 131.559   7.424  -6.218
  302    HZ   PHE  39           HZ       PHE  39 133.443   7.268  -4.606
  303    H    ASP  40           HN       ASP  40 133.093   1.071 -10.050
  304    HA   ASP  40           HA       ASP  40 130.657  -0.481 -10.498
  305   1HB   ASP  40           HB2      ASP  40 131.966  -1.563 -12.289
  306   2HB   ASP  40           HB1      ASP  40 132.068   0.195 -12.385
  307    H    LYS  41           HN       LYS  41 133.310  -0.861  -8.373
  308    HA   LYS  41           HA       LYS  41 132.517  -3.716  -7.961
  309   1HB   LYS  41           HB2      LYS  41 135.374  -2.710  -8.092
  310   2HB   LYS  41           HB1      LYS  41 134.880  -4.350  -7.661
  311   1HG   LYS  41           HG2      LYS  41 133.765  -4.584  -9.862
  312   2HG   LYS  41           HG1      LYS  41 134.302  -2.961 -10.297
  313   1HD   LYS  41           HD2      LYS  41 136.653  -3.677 -10.052
  314   2HD   LYS  41           HD1      LYS  41 136.102  -5.299  -9.631
  315   1HE   LYS  41           HE2      LYS  41 136.692  -5.237 -12.001
  316   2HE   LYS  41           HE1      LYS  41 134.950  -5.454 -11.828
  317   1HZ   LYS  41           HZ3      LYS  41 135.729  -2.698 -11.882
  318   2HZ   LYS  41           HZ2      LYS  41 136.173  -3.525 -13.300
  319   3HZ   LYS  41           HZ1      LYS  41 134.550  -3.507 -12.795
  320    H    ALA  42           HN       ALA  42 132.986  -4.517  -5.836
  321    HA   ALA  42           HA       ALA  42 132.242  -2.699  -3.781
  322   1HB   ALA  42           HB1      ALA  42 133.409  -5.481  -3.657
  323   2HB   ALA  42           HB3      ALA  42 132.804  -4.613  -2.245
  324   3HB   ALA  42           HB2      ALA  42 131.708  -5.022  -3.564
  325    H    TYR  43           HN       TYR  43 135.498  -4.101  -4.444
  326    HA   TYR  43           HA       TYR  43 136.698  -3.010  -2.121
  327   1HB   TYR  43           HB2      TYR  43 138.865  -3.276  -3.201
  328   2HB   TYR  43           HB1      TYR  43 137.851  -4.681  -3.493
  329    HD1  TYR  43           HD1      TYR  43 138.929  -1.435  -5.039
  330    HD2  TYR  43           HD2      TYR  43 137.472  -5.425  -5.688
  331    HE1  TYR  43           HE1      TYR  43 139.285  -1.171  -7.469
  332    HE2  TYR  43           HE2      TYR  43 137.835  -5.155  -8.122
  333    HH   TYR  43           HH       TYR  43 139.688  -3.236  -9.505
  334    H    VAL  44           HN       VAL  44 135.632  -1.315  -4.941
  335    HA   VAL  44           HA       VAL  44 137.426   0.972  -4.516
  336    HB   VAL  44           HB       VAL  44 134.828   0.828  -6.091
  337   1HG1  VAL  44          HG11      VAL  44 135.748   3.124  -5.440
  338   2HG1  VAL  44          HG13      VAL  44 137.158   2.734  -6.420
  339   3HG1  VAL  44          HG12      VAL  44 135.567   2.841  -7.168
  340   1HG2  VAL  44          HG23      VAL  44 137.705   0.475  -6.988
  341   2HG2  VAL  44          HG22      VAL  44 136.493  -0.804  -6.901
  342   3HG2  VAL  44          HG21      VAL  44 136.300   0.516  -8.053
  343    H    VAL  45           HN       VAL  45 134.248  -0.082  -3.616
  344    HA   VAL  45           HA       VAL  45 133.445   2.416  -2.315
  345    HB   VAL  45           HB       VAL  45 132.333  -0.405  -2.133
  346   1HG1  VAL  45          HG13      VAL  45 131.370   2.213  -0.956
  347   2HG1  VAL  45          HG12      VAL  45 130.327   0.804  -1.146
  348   3HG1  VAL  45          HG11      VAL  45 131.740   0.719  -0.096
  349   1HG2  VAL  45          HG21      VAL  45 131.594   2.072  -3.704
  350   2HG2  VAL  45          HG23      VAL  45 131.927   0.451  -4.314
  351   3HG2  VAL  45          HG22      VAL  45 130.438   0.770  -3.426
  352    H    LEU  46           HN       LEU  46 134.956  -0.627  -1.399
  353    HA   LEU  46           HA       LEU  46 134.882  -0.314   1.440
  354   1HB   LEU  46           HB2      LEU  46 135.626  -2.403   0.286
  355   2HB   LEU  46           HB1      LEU  46 137.054  -1.555  -0.288
  356    HG   LEU  46           HG       LEU  46 137.626  -1.087   2.152
  357   1HD1  LEU  46          HD11      LEU  46 135.246  -2.887   2.517
  358   2HD1  LEU  46          HD13      LEU  46 136.535  -2.855   3.720
  359   3HD1  LEU  46          HD12      LEU  46 135.642  -1.385   3.350
  360   1HD2  LEU  46          HD23      LEU  46 138.413  -3.148   0.624
  361   2HD2  LEU  46          HD22      LEU  46 138.892  -2.999   2.310
  362   3HD2  LEU  46          HD21      LEU  46 137.565  -4.059   1.868
  363    H    GLY  47           HN       GLY  47 137.025   0.859  -1.082
  364   1HA   GLY  47           HA2      GLY  47 139.064   2.006   0.527
  365   2HA   GLY  47           HA1      GLY  47 138.633   2.570  -1.087
  366    H    GLN  48           HN       GLN  48 135.943   3.381  -0.580
  367    HA   GLN  48           HA       GLN  48 136.354   6.003   0.467
  368   1HB   GLN  48           HB2      GLN  48 134.478   5.312  -1.055
  369   2HB   GLN  48           HB1      GLN  48 133.742   4.465   0.305
  370   1HG   GLN  48           HG2      GLN  48 132.709   6.646   0.141
  371   2HG   GLN  48           HG1      GLN  48 133.743   6.648   1.568
  372   1HE2  GLN  48          HE22      GLN  48 135.500   8.470  -1.658
  373   2HE2  GLN  48          HE21      GLN  48 134.858   6.909  -1.823
  374    H    PHE  49           HN       PHE  49 134.937   3.082   1.938
  375    HA   PHE  49           HA       PHE  49 134.268   4.211   4.466
  376   1HB   PHE  49           HB2      PHE  49 133.508   1.987   3.690
  377   2HB   PHE  49           HB1      PHE  49 135.161   1.390   3.791
  378    HD1  PHE  49           HD1      PHE  49 132.669   3.214   5.925
  379    HD2  PHE  49           HD2      PHE  49 135.761   0.235   5.739
  380    HE1  PHE  49           HE1      PHE  49 132.290   2.669   8.314
  381    HE2  PHE  49           HE2      PHE  49 135.383  -0.304   8.129
  382    HZ   PHE  49           HZ       PHE  49 133.647   0.911   9.417
  383    H    LEU  50           HN       LEU  50 137.246   2.764   3.253
  384    HA   LEU  50           HA       LEU  50 138.666   2.921   5.771
  385   1HB   LEU  50           HB2      LEU  50 139.687   2.785   2.918
  386   2HB   LEU  50           HB1      LEU  50 140.718   2.641   4.340
  387    HG   LEU  50           HG       LEU  50 138.337   0.840   3.787
  388   1HD1  LEU  50          HD11      LEU  50 141.282   0.472   3.182
  389   2HD1  LEU  50          HD13      LEU  50 140.140  -0.871   3.250
  390   3HD1  LEU  50          HD12      LEU  50 139.931   0.403   2.049
  391   1HD2  LEU  50          HD22      LEU  50 140.457   0.973   5.926
  392   2HD2  LEU  50          HD21      LEU  50 138.735   0.632   6.079
  393   3HD2  LEU  50          HD23      LEU  50 139.824  -0.603   5.457
  394    H    VAL  51           HN       VAL  51 138.362   5.109   3.003
  395    HA   VAL  51           HA       VAL  51 140.274   7.045   3.908
  396    HB   VAL  51           HB       VAL  51 137.899   7.269   2.041
  397   1HG1  VAL  51          HG12      VAL  51 140.017   9.291   2.806
  398   2HG1  VAL  51          HG11      VAL  51 139.134   9.384   1.281
  399   3HG1  VAL  51          HG13      VAL  51 138.266   9.500   2.813
  400   1HG2  VAL  51          HG23      VAL  51 139.914   5.817   1.453
  401   2HG2  VAL  51          HG22      VAL  51 139.539   7.099   0.301
  402   3HG2  VAL  51          HG21      VAL  51 140.868   7.299   1.444
  403    H    LEU  52           HN       LEU  52 136.915   6.511   4.776
  404    HA   LEU  52           HA       LEU  52 136.697   9.182   6.040
  405   1HB   LEU  52           HB2      LEU  52 134.760   6.854   5.974
  406   2HB   LEU  52           HB1      LEU  52 134.408   8.446   6.640
  407    HG   LEU  52           HG       LEU  52 135.232   7.926   3.767
  408   1HD1  LEU  52          HD11      LEU  52 132.537   8.345   5.070
  409   2HD1  LEU  52          HD13      LEU  52 132.803   8.606   3.347
  410   3HD1  LEU  52          HD12      LEU  52 133.048   7.004   4.045
  411   1HD2  LEU  52          HD21      LEU  52 134.586  10.397   5.364
  412   2HD2  LEU  52          HD23      LEU  52 135.825  10.155   4.133
  413   3HD2  LEU  52          HD22      LEU  52 134.143  10.353   3.659
  414    H    LYS  53           HN       LYS  53 138.488   6.796   7.000
  415    HA   LYS  53           HA       LYS  53 139.155   5.909   9.070
  416   1HB   LYS  53           HB2      LYS  53 137.990   8.577   9.886
  417   2HB   LYS  53           HB1      LYS  53 138.866   7.528  10.997
  418   1HG   LYS  53           HG2      LYS  53 140.814   7.560   9.447
  419   2HG   LYS  53           HG1      LYS  53 139.954   8.695   8.412
  420   1HD   LYS  53           HD2      LYS  53 140.224   9.412  11.318
  421   2HD   LYS  53           HD1      LYS  53 141.673   9.516  10.324
  422   1HE   LYS  53           HE2      LYS  53 140.214  11.633  10.504
  423   2HE   LYS  53           HE1      LYS  53 140.721  11.137   8.890
  424   1HZ   LYS  53           HZ1      LYS  53 138.583  10.006   8.636
  425   2HZ   LYS  53           HZ3      LYS  53 138.100  10.565  10.162
  426   3HZ   LYS  53           HZ2      LYS  53 138.387  11.672   8.906
  427    H    LYS  54           HN       LYS  54 136.479   5.126   8.158
  428    HA   LYS  54           HA       LYS  54 134.642   3.918   8.948
  429   1HB   LYS  54           HB2      LYS  54 136.204   3.906  11.552
  430   2HB   LYS  54           HB1      LYS  54 134.889   2.822  11.117
  431   1HG   LYS  54           HG2      LYS  54 136.208   1.960   9.227
  432   2HG   LYS  54           HG1      LYS  54 137.530   3.048   9.647
  433   1HD   LYS  54           HD2      LYS  54 137.707   1.959  11.866
  434   2HD   LYS  54           HD1      LYS  54 136.415   0.848  11.411
  435   1HE   LYS  54           HE2      LYS  54 137.748  -0.094   9.635
  436   2HE   LYS  54           HE1      LYS  54 138.990   1.140   9.845
  437   1HZ   LYS  54           HZ1      LYS  54 139.024   0.217  12.261
  438   2HZ   LYS  54           HZ3      LYS  54 138.360  -1.171  11.543
  439   3HZ   LYS  54           HZ2      LYS  54 139.871  -0.589  11.028
  440    H    ASP  55           HN       ASP  55 134.878   7.002   9.485
  441    HA   ASP  55           HA       ASP  55 133.353   7.425  11.911
  442   1HB   ASP  55           HB2      ASP  55 134.680   9.217  10.809
  443   2HB   ASP  55           HB1      ASP  55 133.552   9.189   9.459
  444    H    GLU  56           HN       GLU  56 131.295   6.739  12.179
  445    HA   GLU  56           HA       GLU  56 129.662   5.713  10.086
  446   1HB   GLU  56           HB2      GLU  56 129.508   5.021  12.445
  447   2HB   GLU  56           HB1      GLU  56 128.859   6.604  12.864
  448   1HG   GLU  56           HG2      GLU  56 126.917   6.221  11.415
  449   2HG   GLU  56           HG1      GLU  56 127.579   4.667  10.912
  450    H    ASP  57           HN       ASP  57 129.514   8.914  11.695
  451    HA   ASP  57           HA       ASP  57 127.048   9.664  10.385
  452   1HB   ASP  57           HB2      ASP  57 129.216  11.303  11.714
  453   2HB   ASP  57           HB1      ASP  57 127.734  12.008  11.067
  454    H    LEU  58           HN       LEU  58 130.444  10.171   9.593
  455    HA   LEU  58           HA       LEU  58 129.862  11.868   7.299
  456   1HB   LEU  58           HB2      LEU  58 132.321  10.174   7.810
  457   2HB   LEU  58           HB1      LEU  58 132.188  11.448   6.607
  458    HG   LEU  58           HG       LEU  58 131.914  11.837   9.604
  459   1HD1  LEU  58          HD13      LEU  58 134.226  11.323   8.824
  460   2HD1  LEU  58          HD12      LEU  58 134.121  12.671   7.694
  461   3HD1  LEU  58          HD11      LEU  58 134.079  12.970   9.430
  462   1HD2  LEU  58          HD22      LEU  58 131.615  13.661   7.217
  463   2HD2  LEU  58          HD21      LEU  58 130.620  13.563   8.670
  464   3HD2  LEU  58          HD23      LEU  58 132.210  14.316   8.742
  465    H    PHE  59           HN       PHE  59 130.362   8.390   7.732
  466    HA   PHE  59           HA       PHE  59 130.287   7.724   4.935
  467   1HB   PHE  59           HB2      PHE  59 131.122   6.118   6.571
  468   2HB   PHE  59           HB1      PHE  59 129.558   6.087   7.384
  469    HD1  PHE  59           HD1      PHE  59 131.277   5.308   4.167
  470    HD2  PHE  59           HD2      PHE  59 127.798   4.687   6.610
  471    HE1  PHE  59           HE1      PHE  59 130.516   3.515   2.629
  472    HE2  PHE  59           HE2      PHE  59 127.036   2.897   5.073
  473    HZ   PHE  59           HZ       PHE  59 128.396   2.311   3.083
  474    H    ARG  60           HN       ARG  60 127.747   7.716   7.456
  475    HA   ARG  60           HA       ARG  60 125.611   6.910   5.767
  476   1HB   ARG  60           HB2      ARG  60 125.633   8.637   8.253
  477   2HB   ARG  60           HB1      ARG  60 124.152   8.088   7.470
  478   1HG   ARG  60           HG2      ARG  60 124.807   5.757   7.796
  479   2HG   ARG  60           HG1      ARG  60 126.338   6.255   8.498
  480   1HD   ARG  60           HD2      ARG  60 124.726   5.691  10.270
  481   2HD   ARG  60           HD1      ARG  60 125.115   7.411  10.319
  482    HE   ARG  60           HE       ARG  60 122.859   7.264   8.698
  483   1HH1  ARG  60          HH21      ARG  60 123.776   6.233  11.858
  484   2HH1  ARG  60          HH22      ARG  60 122.173   6.344  12.505
  485   1HH2  ARG  60          HH11      ARG  60 120.759   7.414   9.526
  486   2HH2  ARG  60          HH12      ARG  60 120.466   7.012  11.185
  487    H    GLU  61           HN       GLU  61 126.705  10.221   6.613
  488    HA   GLU  61           HA       GLU  61 124.707  11.547   5.054
  489   1HB   GLU  61           HB2      GLU  61 126.161  12.627   6.807
  490   2HB   GLU  61           HB1      GLU  61 127.509  12.527   5.675
  491   1HG   GLU  61           HG2      GLU  61 126.532  14.739   5.497
  492   2HG   GLU  61           HG1      GLU  61 126.144  13.844   4.028
  493    H    TRP  62           HN       TRP  62 127.930  10.297   4.269
  494    HA   TRP  62           HA       TRP  62 128.041  11.455   1.637
  495   1HB   TRP  62           HB2      TRP  62 130.105  10.714   2.584
  496   2HB   TRP  62           HB1      TRP  62 129.458   9.106   2.912
  497    HD1  TRP  62           HD1      TRP  62 130.747  11.301   0.066
  498    HE1  TRP  62           HE1      TRP  62 131.208   9.815  -1.992
  499    HE3  TRP  62           HE3      TRP  62 128.803   6.882   1.728
  500    HZ2  TRP  62           HZ2      TRP  62 130.784   7.094  -2.827
  501    HZ3  TRP  62           HZ3      TRP  62 128.858   4.866   0.294
  502    HH2  TRP  62           HH2      TRP  62 129.837   4.966  -1.978
  503    H    LEU  63           HN       LEU  63 126.930   8.269   2.798
  504    HA   LEU  63           HA       LEU  63 126.416   7.258   0.153
  505   1HB   LEU  63           HB2      LEU  63 126.727   5.755   2.060
  506   2HB   LEU  63           HB1      LEU  63 125.291   6.413   2.836
  507    HG   LEU  63           HG       LEU  63 123.898   5.588   0.973
  508   1HD1  LEU  63          HD12      LEU  63 126.581   4.769  -0.121
  509   2HD1  LEU  63          HD11      LEU  63 125.135   3.865  -0.564
  510   3HD1  LEU  63          HD13      LEU  63 125.253   5.581  -0.945
  511   1HD2  LEU  63          HD23      LEU  63 125.730   3.595   2.321
  512   2HD2  LEU  63          HD22      LEU  63 124.118   4.096   2.833
  513   3HD2  LEU  63          HD21      LEU  63 124.315   3.110   1.384
  514    H    LYS  64           HN       LYS  64 124.289   8.704   2.607
  515    HA   LYS  64           HA       LYS  64 121.879   8.449   1.095
  516   1HB   LYS  64           HB2      LYS  64 121.946   9.006   3.524
  517   2HB   LYS  64           HB1      LYS  64 122.542  10.613   3.105
  518   1HG   LYS  64           HG2      LYS  64 120.521  11.076   1.820
  519   2HG   LYS  64           HG1      LYS  64 119.932   9.438   2.107
  520   1HD   LYS  64           HD2      LYS  64 119.844   9.863   4.514
  521   2HD   LYS  64           HD1      LYS  64 120.485  11.488   4.268
  522   1HE   LYS  64           HE2      LYS  64 118.514  12.075   2.918
  523   2HE   LYS  64           HE1      LYS  64 117.878  10.444   3.123
  524   1HZ   LYS  64           HZ2      LYS  64 117.909  10.840   5.548
  525   2HZ   LYS  64           HZ1      LYS  64 118.349  12.455   5.254
  526   3HZ   LYS  64           HZ3      LYS  64 116.850  11.872   4.714
  527    H    ASP  65           HN       ASP  65 124.120  11.208   1.371
  528    HA   ASP  65           HA       ASP  65 122.670  12.821  -0.531
  529   1HB   ASP  65           HB2      ASP  65 125.516  12.958   0.494
  530   2HB   ASP  65           HB1      ASP  65 124.824  14.154  -0.602
  531    H    THR  66           HN       THR  66 125.060  10.299  -0.823
  532    HA   THR  66           HA       THR  66 125.819  11.018  -3.539
  533    HB   THR  66           HB       THR  66 126.321   8.550  -1.859
  534    HG1  THR  66           HG1      THR  66 128.221  10.385  -2.797
  535   1HG2  THR  66          HG22      THR  66 127.094   9.237  -4.686
  536   2HG2  THR  66          HG21      THR  66 128.123   8.201  -3.700
  537   3HG2  THR  66          HG23      THR  66 126.464   7.718  -4.054
  538    H    CYS  67           HN       CYS  67 123.465   8.737  -2.095
  539    HA   CYS  67           HA       CYS  67 122.496   8.201  -4.892
  540   1HB   CYS  67           HB2      CYS  67 122.036   5.875  -4.201
  541   2HB   CYS  67           HB1      CYS  67 123.755   6.259  -4.110
  542    HG   CYS  67           HG       CYS  67 121.990   6.392  -1.533
  543    H    GLY  68           HN       GLY  68 121.670   8.623  -1.492
  544   1HA   GLY  68           HA2      GLY  68 119.538   9.659  -0.893
  545   2HA   GLY  68           HA1      GLY  68 118.799   8.896  -2.301
  546    H    ALA  69           HN       ALA  69 120.985   6.864  -0.616
  547    HA   ALA  69           HA       ALA  69 119.098   4.858  -0.046
  548   1HB   ALA  69           HB2      ALA  69 121.586   4.558   0.016
  549   2HB   ALA  69           HB1      ALA  69 121.616   5.430   1.549
  550   3HB   ALA  69           HB3      ALA  69 120.775   3.884   1.429
  551    H    ASN  70           HN       ASN  70 118.072   4.237   1.997
  552    HA   ASN  70           HA       ASN  70 117.271   6.615   3.565
  553   1HB   ASN  70           HB2      ASN  70 116.263   3.755   3.625
  554   2HB   ASN  70           HB1      ASN  70 115.539   5.123   4.474
  555   1HD2  ASN  70          HD22      ASN  70 115.134   6.517   0.874
  556   2HD2  ASN  70          HD21      ASN  70 116.368   6.834   1.994
  557    H    ALA  71           HN       ALA  71 116.908   6.116   5.985
  558    HA   ALA  71           HA       ALA  71 119.423   5.737   7.238
  559   1HB   ALA  71           HB3      ALA  71 117.420   6.945   8.196
  560   2HB   ALA  71           HB2      ALA  71 116.715   5.365   8.541
  561   3HB   ALA  71           HB1      ALA  71 118.220   5.849   9.323
  562    H    LYS  72           HN       LYS  72 116.792   3.418   6.610
  563    HA   LYS  72           HA       LYS  72 117.927   1.358   8.293
  564   1HB   LYS  72           HB2      LYS  72 115.977   1.240   5.973
  565   2HB   LYS  72           HB1      LYS  72 116.409  -0.161   6.953
  566   1HG   LYS  72           HG2      LYS  72 115.611   1.006   8.979
  567   2HG   LYS  72           HG1      LYS  72 115.174   2.406   7.998
  568   1HD   LYS  72           HD2      LYS  72 113.601   1.014   6.702
  569   2HD   LYS  72           HD1      LYS  72 114.033  -0.387   7.683
  570   1HE   LYS  72           HE2      LYS  72 112.887   2.176   8.821
  571   2HE   LYS  72           HE1      LYS  72 111.917   0.760   8.422
  572   1HZ   LYS  72           HZ1      LYS  72 113.834  -0.351   9.888
  573   2HZ   LYS  72           HZ3      LYS  72 113.771   1.181  10.615
  574   3HZ   LYS  72           HZ2      LYS  72 112.372   0.219  10.540
  575    H    GLN  73           HN       GLN  73 118.175   2.108   4.837
  576    HA   GLN  73           HA       GLN  73 119.706  -0.209   4.136
  577   1HB   GLN  73           HB2      GLN  73 119.413   2.507   2.834
  578   2HB   GLN  73           HB1      GLN  73 120.325   1.184   2.110
  579   1HG   GLN  73           HG2      GLN  73 118.322  -0.238   2.135
  580   2HG   GLN  73           HG1      GLN  73 117.401   1.055   2.904
  581   1HE2  GLN  73          HE22      GLN  73 117.345   1.031  -1.005
  582   2HE2  GLN  73          HE21      GLN  73 117.463  -0.312   0.026
  583    H    SER  74           HN       SER  74 120.656   3.054   5.174
  584    HA   SER  74           HA       SER  74 123.445   2.688   4.659
  585   1HB   SER  74           HB2      SER  74 123.743   4.660   6.072
  586   2HB   SER  74           HB1      SER  74 122.390   4.899   4.975
  587    HG   SER  74           HG       SER  74 122.404   4.991   7.627
  588    H    ARG  75           HN       ARG  75 121.435   2.037   7.547
  589    HA   ARG  75           HA       ARG  75 123.592   1.502   9.326
  590   1HB   ARG  75           HB2      ARG  75 120.780   0.383   9.210
  591   2HB   ARG  75           HB1      ARG  75 121.901   0.046  10.530
  592   1HG   ARG  75           HG2      ARG  75 122.074   2.419  11.048
  593   2HG   ARG  75           HG1      ARG  75 121.068   2.828   9.662
  594   1HD   ARG  75           HD2      ARG  75 119.210   1.497  10.661
  595   2HD   ARG  75           HD1      ARG  75 120.219   1.211  12.078
  596    HE   ARG  75           HE       ARG  75 120.200   3.962  11.863
  597   1HH1  ARG  75          HH21      ARG  75 117.842   1.451  11.911
  598   2HH1  ARG  75          HH22      ARG  75 116.623   2.424  12.666
  599   1HH2  ARG  75          HH11      ARG  75 118.619   5.253  12.850
  600   2HH2  ARG  75          HH12      ARG  75 117.063   4.576  13.198
  601    H    ASP  76           HN       ASP  76 121.964  -0.590   6.944
  602    HA   ASP  76           HA       ASP  76 123.273  -2.996   7.759
  603   1HB   ASP  76           HB2      ASP  76 122.050  -2.136   5.129
  604   2HB   ASP  76           HB1      ASP  76 122.661  -3.765   5.424
  605    H    CYS  77           HN       CYS  77 124.203  -0.507   5.355
  606    HA   CYS  77           HA       CYS  77 126.467  -1.996   4.381
  607   1HB   CYS  77           HB2      CYS  77 125.737   0.938   4.306
  608   2HB   CYS  77           HB1      CYS  77 127.212   0.308   3.572
  609    HG   CYS  77           HG       CYS  77 124.387  -0.721   2.697
  610    H    PHE  78           HN       PHE  78 126.103   0.463   6.968
  611    HA   PHE  78           HA       PHE  78 128.878   0.816   7.452
  612   1HB   PHE  78           HB2      PHE  78 127.179   2.259   8.469
  613   2HB   PHE  78           HB1      PHE  78 126.576   0.903   9.423
  614    HD1  PHE  78           HD1      PHE  78 129.344   3.294   8.971
  615    HD2  PHE  78           HD2      PHE  78 127.844   0.013  11.304
  616    HE1  PHE  78           HE1      PHE  78 131.037   3.763  10.721
  617    HE2  PHE  78           HE2      PHE  78 129.536   0.482  13.051
  618    HZ   PHE  78           HZ       PHE  78 131.134   2.357  12.761
  619    H    GLY  79           HN       GLY  79 126.658  -1.272   9.335
  620   1HA   GLY  79           HA2      GLY  79 128.712  -2.608  10.767
  621   2HA   GLY  79           HA1      GLY  79 127.092  -3.253  10.512
  622    H    CYS  80           HN       CYS  80 127.382  -3.202   7.569
  623    HA   CYS  80           HA       CYS  80 128.522  -5.845   7.263
  624   1HB   CYS  80           HB2      CYS  80 126.692  -5.007   5.827
  625   2HB   CYS  80           HB1      CYS  80 127.789  -3.810   5.139
  626    HG   CYS  80           HG       CYS  80 127.607  -6.649   4.224
  627    H    LEU  81           HN       LEU  81 129.628  -2.596   6.154
  628    HA   LEU  81           HA       LEU  81 132.127  -3.658   5.153
  629   1HB   LEU  81           HB2      LEU  81 131.352  -0.829   5.923
  630   2HB   LEU  81           HB1      LEU  81 132.795  -1.274   5.015
  631    HG   LEU  81           HG       LEU  81 129.968  -1.913   4.118
  632   1HD1  LEU  81          HD13      LEU  81 131.813   0.382   3.410
  633   2HD1  LEU  81          HD12      LEU  81 130.407  -0.064   2.444
  634   3HD1  LEU  81          HD11      LEU  81 130.195   0.482   4.107
  635   1HD2  LEU  81          HD21      LEU  81 132.718  -2.249   2.912
  636   2HD2  LEU  81          HD23      LEU  81 131.393  -3.410   2.987
  637   3HD2  LEU  81          HD22      LEU  81 131.313  -2.057   1.866
  638    H    ARG  82           HN       ARG  82 131.138  -2.110   8.212
  639    HA   ARG  82           HA       ARG  82 133.762  -1.898   9.314
  640   1HB   ARG  82           HB2      ARG  82 131.810  -0.735  10.278
  641   2HB   ARG  82           HB1      ARG  82 131.136  -2.287  10.776
  642   1HG   ARG  82           HG2      ARG  82 133.078  -2.696  12.215
  643   2HG   ARG  82           HG1      ARG  82 133.815  -1.186  11.687
  644   1HD   ARG  82           HD2      ARG  82 131.802   0.017  12.561
  645   2HD   ARG  82           HD1      ARG  82 131.217  -1.499  13.230
  646    HE   ARG  82           HE       ARG  82 133.165   0.269  14.396
  647   1HH1  ARG  82          HH21      ARG  82 132.601  -3.099  13.861
  648   2HH1  ARG  82          HH22      ARG  82 133.745  -3.599  15.060
  649   1HH2  ARG  82          HH11      ARG  82 134.627  -0.375  15.956
  650   2HH2  ARG  82          HH12      ARG  82 134.884  -2.063  16.246
  651    H    GLU  83           HN       GLU  83 131.393  -4.545   9.441
  652    HA   GLU  83           HA       GLU  83 132.970  -6.168  11.223
  653   1HB   GLU  83           HB2      GLU  83 130.720  -6.847   9.319
  654   2HB   GLU  83           HB1      GLU  83 131.473  -8.032  10.388
  655   1HG   GLU  83           HG2      GLU  83 130.816  -6.799  12.348
  656   2HG   GLU  83           HG1      GLU  83 130.280  -5.429  11.378
  657    H    TRP  84           HN       TRP  84 132.771  -5.970   7.663
  658    HA   TRP  84           HA       TRP  84 134.375  -8.273   7.132
  659   1HB   TRP  84           HB2      TRP  84 133.045  -7.080   5.397
  660   2HB   TRP  84           HB1      TRP  84 134.157  -5.714   5.514
  661    HD1  TRP  84           HD1      TRP  84 133.905  -9.287   4.259
  662    HE1  TRP  84           HE1      TRP  84 135.940  -9.813   2.776
  663    HE3  TRP  84           HE3      TRP  84 136.680  -5.076   5.059
  664    HZ2  TRP  84           HZ2      TRP  84 138.429  -8.604   2.024
  665    HZ3  TRP  84           HZ3      TRP  84 138.877  -4.789   3.950
  666    HH2  TRP  84           HH2      TRP  84 139.754  -6.544   2.433
  667    H    CYS  85           HN       CYS  85 135.208  -4.835   7.554
  668    HA   CYS  85           HA       CYS  85 137.993  -5.103   7.068
  669   1HB   CYS  85           HB2      CYS  85 136.460  -3.171   8.826
  670   2HB   CYS  85           HB1      CYS  85 138.188  -3.022   8.506
  671    HG   CYS  85           HG       CYS  85 137.346  -3.039   5.851
  672    H    ASP  86           HN       ASP  86 136.115  -5.484  10.047
  673    HA   ASP  86           HA       ASP  86 138.273  -5.790  11.858
  674   1HB   ASP  86           HB2      ASP  86 135.499  -6.998  11.828
  675   2HB   ASP  86           HB1      ASP  86 136.614  -7.187  13.181
  676    H    ALA  87           HN       ALA  87 136.920  -8.004   9.500
  677    HA   ALA  87           HA       ALA  87 138.518 -10.262  10.589
  678   1HB   ALA  87           HB3      ALA  87 136.520 -10.093   8.320
  679   2HB   ALA  87           HB2      ALA  87 137.377 -11.564   8.777
  680   3HB   ALA  87           HB1      ALA  87 136.259 -10.807   9.912
  681    H    PHE  88           HN       PHE  88 138.396  -8.139   7.750
  682    HA   PHE  88           HA       PHE  88 140.800  -9.548   6.639
  683   1HB   PHE  88           HB2      PHE  88 138.746  -7.780   5.308
  684   2HB   PHE  88           HB1      PHE  88 140.151  -8.472   4.500
  685    HD1  PHE  88           HD2      PHE  88 140.404 -10.985   4.396
  686    HD2  PHE  88           HD1      PHE  88 136.786  -9.082   5.707
  687    HE1  PHE  88           HE2      PHE  88 139.153 -13.090   4.004
  688    HE2  PHE  88           HE1      PHE  88 135.534 -11.184   5.313
  689    HZ   PHE  88           HZ       PHE  88 136.717 -13.185   4.455
  690    H    LEU  89           HN       LEU  89 140.021  -6.552   8.187
  691    HA   LEU  89           HA       LEU  89 142.187  -5.119   6.732
  692   1HB   LEU  89           HB2      LEU  89 139.995  -3.982   7.323
  693   2HB   LEU  89           HB1      LEU  89 140.484  -4.084   9.009
  694    HG   LEU  89           HG       LEU  89 142.615  -2.867   8.360
  695   1HD1  LEU  89          HD12      LEU  89 141.117  -2.730   5.742
  696   2HD1  LEU  89          HD11      LEU  89 142.179  -1.403   6.209
  697   3HD1  LEU  89          HD13      LEU  89 142.830  -3.028   6.026
  698   1HD2  LEU  89          HD22      LEU  89 139.941  -1.489   7.962
  699   2HD2  LEU  89          HD21      LEU  89 140.775  -1.731   9.497
  700   3HD2  LEU  89          HD23      LEU  89 141.463  -0.654   8.281
  701   1H    MET   1           HT3      MET   1 164.562  -6.991  -3.128
  702   2H    MET   1           HT2      MET   1 164.461  -8.434  -4.019
  703   3H    MET   1           HT1      MET   1 163.742  -8.327  -2.483
  704    HA   MET   1           HA       MET   1 165.584  -9.198  -1.645
  705   1HB   MET   1           HB2      MET   1 166.780  -8.562  -4.356
  706   2HB   MET   1           HB1      MET   1 167.649  -9.418  -3.081
  707   1HG   MET   1           HG2      MET   1 165.889 -11.149  -3.043
  708   2HG   MET   1           HG1      MET   1 165.027 -10.297  -4.323
  709   1HE   MET   1           HE1      MET   1 165.342 -12.986  -4.632
  710   2HE   MET   1           HE3      MET   1 165.113 -12.307  -6.248
  711   3HE   MET   1           HE2      MET   1 166.369 -13.509  -5.964
  712    H    THR   2           HN       THR   2 166.136  -6.171  -3.433
  713    HA   THR   2           HA       THR   2 168.174  -5.316  -1.471
  714    HB   THR   2           HB       THR   2 168.290  -3.266  -2.856
  715    HG1  THR   2           HG1      THR   2 165.912  -4.247  -3.705
  716   1HG2  THR   2          HG23      THR   2 168.338  -5.895  -4.358
  717   2HG2  THR   2          HG22      THR   2 169.005  -4.390  -4.991
  718   3HG2  THR   2          HG21      THR   2 169.689  -5.114  -3.535
  719    H    THR   3           HN       THR   3 164.883  -5.476  -1.471
  720    HA   THR   3           HA       THR   3 164.210  -2.848  -0.449
  721    HB   THR   3           HB       THR   3 162.063  -3.831   0.125
  722    HG1  THR   3           HG1      THR   3 161.781  -6.007   0.210
  723   1HG2  THR   3          HG21      THR   3 162.640  -3.465  -2.302
  724   2HG2  THR   3          HG23      THR   3 163.055  -5.177  -2.399
  725   3HG2  THR   3          HG22      THR   3 161.401  -4.691  -2.030
  726    H    SER   4           HN       SER   4 163.559  -2.449   1.823
  727    HA   SER   4           HA       SER   4 165.536  -3.554   3.665
  728   1HB   SER   4           HB2      SER   4 164.831  -1.179   3.778
  729   2HB   SER   4           HB1      SER   4 163.199  -1.692   4.196
  730    HG   SER   4           HG       SER   4 164.001  -2.586   6.083
  731    H    GLN   5           HN       GLN   5 164.852  -4.400   5.800
  732    HA   GLN   5           HA       GLN   5 163.280  -6.750   5.557
  733   1HB   GLN   5           HB2      GLN   5 165.062  -6.369   7.259
  734   2HB   GLN   5           HB1      GLN   5 163.994  -5.236   8.087
  735   1HG   GLN   5           HG2      GLN   5 162.344  -7.026   8.437
  736   2HG   GLN   5           HG1      GLN   5 163.385  -8.162   7.577
  737   1HE2  GLN   5          HE22      GLN   5 164.017  -8.340  11.317
  738   2HE2  GLN   5          HE21      GLN   5 162.591  -8.421  10.400
  739    H    LYS   6           HN       LYS   6 162.357  -3.465   6.349
  740    HA   LYS   6           HA       LYS   6 159.916  -3.987   7.705
  741   1HB   LYS   6           HB2      LYS   6 160.769  -1.691   5.930
  742   2HB   LYS   6           HB1      LYS   6 159.244  -1.708   6.817
  743   1HG   LYS   6           HG2      LYS   6 160.474  -2.003   8.935
  744   2HG   LYS   6           HG1      LYS   6 162.000  -1.980   8.053
  745   1HD   LYS   6           HD2      LYS   6 161.512   0.305   7.260
  746   2HD   LYS   6           HD1      LYS   6 159.985   0.287   8.143
  747   1HE   LYS   6           HE2      LYS   6 161.370  -0.210  10.238
  748   2HE   LYS   6           HE1      LYS   6 162.788   0.213   9.278
  749   1HZ   LYS   6           HZ2      LYS   6 160.641   2.113   9.065
  750   2HZ   LYS   6           HZ1      LYS   6 161.244   1.961  10.646
  751   3HZ   LYS   6           HZ3      LYS   6 162.292   2.371   9.376
  752    H    HIS   7           HN       HIS   7 160.668  -3.924   4.231
  753    HA   HIS   7           HA       HIS   7 157.985  -3.935   3.294
  754   1HB   HIS   7           HB2      HIS   7 159.713  -3.593   1.679
  755   2HB   HIS   7           HB1      HIS   7 160.537  -5.081   2.138
  756    HD2  HIS   7           HD2      HIS   7 159.404  -7.461   1.059
  757    HE1  HIS   7           HE1      HIS   7 156.560  -5.535  -1.395
  758    HE2  HIS   7           HE2      HIS   7 157.648  -7.756  -0.844
  759    H    ARG   8           HN       ARG   8 160.118  -6.713   4.039
  760    HA   ARG   8           HA       ARG   8 158.118  -8.689   3.474
  761   1HB   ARG   8           HB2      ARG   8 160.681  -8.770   5.092
  762   2HB   ARG   8           HB1      ARG   8 159.707 -10.197   4.724
  763   1HG   ARG   8           HG2      ARG   8 159.966  -9.748   2.313
  764   2HG   ARG   8           HG1      ARG   8 160.948  -8.332   2.677
  765   1HD   ARG   8           HD2      ARG   8 162.498  -9.868   3.960
  766   2HD   ARG   8           HD1      ARG   8 161.603 -11.229   3.297
  767    HE   ARG   8           HE       ARG   8 163.664  -9.718   1.977
  768   1HH1  ARG   8          HH21      ARG   8 160.560 -11.103   1.364
  769   2HH1  ARG   8          HH22      ARG   8 160.747 -11.056  -0.356
  770   1HH2  ARG   8          HH11      ARG   8 163.917  -9.670  -0.246
  771   2HH2  ARG   8          HH12      ARG   8 162.644 -10.253  -1.265
  772    H    ASP   9           HN       ASP   9 159.057  -6.931   6.383
  773    HA   ASP   9           HA       ASP   9 157.502  -8.563   8.201
  774   1HB   ASP   9           HB2      ASP   9 158.592  -5.753   8.424
  775   2HB   ASP   9           HB1      ASP   9 157.720  -6.552   9.730
  776    H    PHE  10           HN       PHE  10 156.872  -5.641   6.316
  777    HA   PHE  10           HA       PHE  10 154.360  -4.970   7.493
  778   1HB   PHE  10           HB2      PHE  10 155.768  -3.567   5.903
  779   2HB   PHE  10           HB1      PHE  10 155.144  -4.569   4.596
  780    HD1  PHE  10           HD2      PHE  10 152.771  -4.478   3.952
  781    HD2  PHE  10           HD1      PHE  10 154.335  -2.023   7.111
  782    HE1  PHE  10           HE2      PHE  10 150.719  -3.084   3.888
  783    HE2  PHE  10           HE1      PHE  10 152.286  -0.630   7.046
  784    HZ   PHE  10           HZ       PHE  10 150.481  -1.158   5.435
  785    H    VAL  11           HN       VAL  11 155.138  -6.981   4.639
  786    HA   VAL  11           HA       VAL  11 152.327  -7.707   4.249
  787    HB   VAL  11           HB       VAL  11 153.209  -9.149   2.454
  788   1HG1  VAL  11          HG12      VAL  11 154.381  -6.362   2.644
  789   2HG1  VAL  11          HG11      VAL  11 154.432  -7.331   1.172
  790   3HG1  VAL  11          HG13      VAL  11 152.881  -6.843   1.852
  791   1HG2  VAL  11          HG21      VAL  11 155.834  -8.424   3.759
  792   2HG2  VAL  11          HG23      VAL  11 155.213 -10.027   3.375
  793   3HG2  VAL  11          HG22      VAL  11 155.758  -8.960   2.081
  794    H    ALA  12           HN       ALA  12 154.079  -8.507   6.744
  795    HA   ALA  12           HA       ALA  12 153.484 -11.452   6.655
  796   1HB   ALA  12           HB1      ALA  12 155.885 -10.774   7.018
  797   2HB   ALA  12           HB3      ALA  12 155.378 -10.010   8.525
  798   3HB   ALA  12           HB2      ALA  12 155.201 -11.751   8.317
  799    H    GLU  13           HN       GLU  13 152.447  -8.498   7.983
  800    HA   GLU  13           HA       GLU  13 150.692  -9.950   9.846
  801   1HB   GLU  13           HB2      GLU  13 151.341  -8.345  11.725
  802   2HB   GLU  13           HB1      GLU  13 152.533  -9.583  11.329
  803   1HG   GLU  13           HG2      GLU  13 153.862  -8.038  10.079
  804   2HG   GLU  13           HG1      GLU  13 152.585  -6.820  10.100
  805    HA   PRO  14           HA       PRO  14 147.669  -6.891   8.653
  806   1HB   PRO  14           HB2      PRO  14 147.312  -6.342  11.588
  807   2HB   PRO  14           HB1      PRO  14 146.085  -6.667  10.346
  808   1HG   PRO  14           HG2      PRO  14 146.829  -8.538  12.108
  809   2HG   PRO  14           HG1      PRO  14 146.401  -8.944  10.436
  810   1HD   PRO  14           HD2      PRO  14 149.086  -8.925  11.728
  811   2HD   PRO  14           HD1      PRO  14 148.508  -9.853  10.327
  812    H    MET  15           HN       MET  15 147.346  -4.506   8.688
  813    HA   MET  15           HA       MET  15 149.882  -3.101   9.304
  814   1HB   MET  15           HB2      MET  15 148.567  -1.164   8.158
  815   2HB   MET  15           HB1      MET  15 149.092  -2.527   7.170
  816   1HG   MET  15           HG2      MET  15 146.934  -3.457   7.075
  817   2HG   MET  15           HG1      MET  15 146.374  -2.543   8.477
  818   1HE   MET  15           HE1      MET  15 148.270  -1.793   5.140
  819   2HE   MET  15           HE3      MET  15 146.832  -2.717   4.697
  820   3HE   MET  15           HE2      MET  15 147.007  -1.041   4.184
  821    H    GLY  16           HN       GLY  16 146.622  -3.368  10.514
  822   1HA   GLY  16           HA2      GLY  16 145.539  -2.316  12.310
  823   2HA   GLY  16           HA1      GLY  16 147.149  -2.245  13.024
  824    H    GLU  17           HN       GLU  17 147.214  -0.186  13.844
  825    HA   GLU  17           HA       GLU  17 146.400   2.091  12.085
  826   1HB   GLU  17           HB2      GLU  17 146.822   1.867  15.075
  827   2HB   GLU  17           HB1      GLU  17 146.529   3.397  14.245
  828   1HG   GLU  17           HG2      GLU  17 144.397   2.518  13.367
  829   2HG   GLU  17           HG1      GLU  17 144.686   0.989  14.198
  830    H    LYS  18           HN       LYS  18 149.032   0.647  11.846
  831    HA   LYS  18           HA       LYS  18 151.112   2.177  13.034
  832   1HB   LYS  18           HB2      LYS  18 151.059   0.759  10.346
  833   2HB   LYS  18           HB1      LYS  18 152.521   1.299  11.166
  834   1HG   LYS  18           HG2      LYS  18 150.606  -0.497  12.646
  835   2HG   LYS  18           HG1      LYS  18 151.681  -1.203  11.442
  836   1HD   LYS  18           HD2      LYS  18 153.635  -0.429  12.600
  837   2HD   LYS  18           HD1      LYS  18 152.673   0.573  13.684
  838   1HE   LYS  18           HE2      LYS  18 153.342  -1.490  14.827
  839   2HE   LYS  18           HE1      LYS  18 151.595  -1.471  14.590
  840   1HZ   LYS  18           HZ2      LYS  18 153.100  -2.633  12.416
  841   2HZ   LYS  18           HZ1      LYS  18 153.199  -3.496  13.876
  842   3HZ   LYS  18           HZ3      LYS  18 151.685  -3.185  13.177
  843    HA   PRO  19           HA       PRO  19 150.688   6.031  10.876
  844   1HB   PRO  19           HB2      PRO  19 153.312   6.906  10.798
  845   2HB   PRO  19           HB1      PRO  19 152.293   6.959  12.251
  846   1HG   PRO  19           HG2      PRO  19 154.381   4.971  11.479
  847   2HG   PRO  19           HG1      PRO  19 154.024   5.672  13.069
  848   1HD   PRO  19           HD2      PRO  19 153.208   3.166  12.364
  849   2HD   PRO  19           HD1      PRO  19 152.279   4.188  13.482
  850    H    VAL  20           HN       VAL  20 151.084   7.080   8.844
  851    HA   VAL  20           HA       VAL  20 151.254   5.408   6.599
  852    HB   VAL  20           HB       VAL  20 150.311   7.655   6.477
  853   1HG1  VAL  20          HG13      VAL  20 152.119   8.605   8.054
  854   2HG1  VAL  20          HG12      VAL  20 153.119   8.767   6.609
  855   3HG1  VAL  20          HG11      VAL  20 151.589   9.635   6.726
  856   1HG2  VAL  20          HG21      VAL  20 151.406   6.518   4.451
  857   2HG2  VAL  20          HG23      VAL  20 151.166   8.262   4.335
  858   3HG2  VAL  20          HG22      VAL  20 152.763   7.614   4.707
  859    H    GLY  21           HN       GLY  21 153.847   7.424   7.999
  860   1HA   GLY  21           HA2      GLY  21 155.861   6.893   6.120
  861   2HA   GLY  21           HA1      GLY  21 156.173   7.237   7.819
  862    H    SER  22           HN       SER  22 154.267   4.563   7.943
  863    HA   SER  22           HA       SER  22 156.586   2.831   8.409
  864   1HB   SER  22           HB2      SER  22 154.568   2.740   9.869
  865   2HB   SER  22           HB1      SER  22 153.622   2.181   8.491
  866    HG   SER  22           HG       SER  22 154.482   0.498   9.891
  867    H    LEU  23           HN       LEU  23 154.398   3.502   5.822
  868    HA   LEU  23           HA       LEU  23 154.517   0.980   4.463
  869   1HB   LEU  23           HB2      LEU  23 154.115   3.792   3.416
  870   2HB   LEU  23           HB1      LEU  23 153.916   2.345   2.433
  871    HG   LEU  23           HG       LEU  23 152.400   2.850   5.012
  872   1HD1  LEU  23          HD12      LEU  23 151.934   4.478   3.069
  873   2HD1  LEU  23          HD11      LEU  23 151.270   3.083   2.220
  874   3HD1  LEU  23          HD13      LEU  23 150.551   3.617   3.738
  875   1HD2  LEU  23          HD22      LEU  23 152.376   0.689   2.909
  876   2HD2  LEU  23          HD21      LEU  23 152.274   0.541   4.662
  877   3HD2  LEU  23          HD23      LEU  23 150.875   1.082   3.744
  878    H    ALA  24           HN       ALA  24 155.997   0.152   3.061
  879    HA   ALA  24           HA       ALA  24 158.704   1.085   3.168
  880   1HB   ALA  24           HB1      ALA  24 157.278  -0.857   1.340
  881   2HB   ALA  24           HB3      ALA  24 159.010  -0.545   1.224
  882   3HB   ALA  24           HB2      ALA  24 158.333  -1.232   2.702
  883    H    GLY  25           HN       GLY  25 159.822   2.456   1.850
  884   1HA   GLY  25           HA2      GLY  25 160.285   3.611  -0.225
  885   2HA   GLY  25           HA1      GLY  25 158.613   3.349  -0.724
  886    H    ILE  26           HN       ILE  26 157.846   4.236   2.146
  887    HA   ILE  26           HA       ILE  26 157.825   7.160   1.519
  888    HB   ILE  26           HB       ILE  26 156.275   5.646   3.647
  889   1HG1  ILE  26          HG12      ILE  26 155.631   4.740   1.492
  890   2HG1  ILE  26          HG11      ILE  26 154.359   5.834   2.025
  891   1HG2  ILE  26          HG23      ILE  26 155.965   8.392   2.404
  892   2HG2  ILE  26          HG22      ILE  26 154.795   7.659   3.503
  893   3HG2  ILE  26          HG21      ILE  26 156.424   8.034   4.069
  894   1HD1  ILE  26          HD13      ILE  26 155.663   7.636   0.648
  895   2HD1  ILE  26          HD12      ILE  26 156.422   6.248  -0.129
  896   3HD1  ILE  26          HD11      ILE  26 154.674   6.460  -0.217
  897    H    GLY  27           HN       GLY  27 159.527   8.273   2.509
  898   1HA   GLY  27           HA2      GLY  27 160.674   7.151   5.001
  899   2HA   GLY  27           HA1      GLY  27 161.370   8.440   4.021
  900    H    GLU  28           HN       GLU  28 161.422   9.072   6.546
  901    HA   GLU  28           HA       GLU  28 159.090  10.092   7.786
  902   1HB   GLU  28           HB2      GLU  28 161.984  10.951   8.002
  903   2HB   GLU  28           HB1      GLU  28 160.707  11.608   9.026
  904   1HG   GLU  28           HG2      GLU  28 160.168   9.356   9.839
  905   2HG   GLU  28           HG1      GLU  28 161.402   8.665   8.785
  906    H    VAL  29           HN       VAL  29 161.314  11.671   5.481
  907    HA   VAL  29           HA       VAL  29 160.070  14.254   5.668
  908    HB   VAL  29           HB       VAL  29 161.570  13.013   3.343
  909   1HG1  VAL  29          HG12      VAL  29 160.698  15.839   3.975
  910   2HG1  VAL  29          HG11      VAL  29 161.993  15.485   2.833
  911   3HG1  VAL  29          HG13      VAL  29 160.359  14.899   2.522
  912   1HG2  VAL  29          HG21      VAL  29 162.489  14.790   5.628
  913   2HG2  VAL  29          HG23      VAL  29 162.913  13.094   5.399
  914   3HG2  VAL  29          HG22      VAL  29 163.488  14.307   4.256
  915    H    LEU  30           HN       LEU  30 159.616  11.578   3.353
  916    HA   LEU  30           HA       LEU  30 157.522  12.883   1.882
  917   1HB   LEU  30           HB2      LEU  30 158.075   9.917   2.215
  918   2HB   LEU  30           HB1      LEU  30 157.019  10.625   0.996
  919    HG   LEU  30           HG       LEU  30 159.977  11.247   1.273
  920   1HD1  LEU  30          HD12      LEU  30 158.475   9.379  -0.582
  921   2HD1  LEU  30          HD11      LEU  30 160.140   9.893  -0.851
  922   3HD1  LEU  30          HD13      LEU  30 159.730   8.946   0.578
  923   1HD2  LEU  30          HD23      LEU  30 157.801  12.098  -0.644
  924   2HD2  LEU  30          HD22      LEU  30 159.016  13.093   0.158
  925   3HD2  LEU  30          HD21      LEU  30 159.481  12.045  -1.178
  926    H    GLY  31           HN       GLY  31 157.527  10.749   4.703
  927   1HA   GLY  31           HA2      GLY  31 154.723  10.300   4.854
  928   2HA   GLY  31           HA1      GLY  31 155.815  10.290   6.241
  929    H    LYS  32           HN       LYS  32 156.733  12.984   6.026
  930    HA   LYS  32           HA       LYS  32 154.670  14.351   7.461
  931   1HB   LYS  32           HB2      LYS  32 157.116  14.856   7.643
  932   2HB   LYS  32           HB1      LYS  32 157.043  15.588   6.039
  933   1HG   LYS  32           HG2      LYS  32 155.344  17.190   6.843
  934   2HG   LYS  32           HG1      LYS  32 155.417  16.460   8.447
  935   1HD   LYS  32           HD2      LYS  32 157.811  17.055   8.605
  936   2HD   LYS  32           HD1      LYS  32 157.726  17.798   7.007
  937   1HE   LYS  32           HE2      LYS  32 156.120  19.439   7.793
  938   2HE   LYS  32           HE1      LYS  32 156.012  18.640   9.361
  939   1HZ   LYS  32           HZ3      LYS  32 158.706  19.254   8.663
  940   2HZ   LYS  32           HZ2      LYS  32 157.737  20.650   8.675
  941   3HZ   LYS  32           HZ1      LYS  32 157.835  19.666  10.058
  942    H    LYS  33           HN       LYS  33 155.691  14.542   4.042
  943    HA   LYS  33           HA       LYS  33 153.990  16.757   3.379
  944   1HB   LYS  33           HB2      LYS  33 155.070  14.498   1.664
  945   2HB   LYS  33           HB1      LYS  33 154.262  15.930   1.023
  946   1HG   LYS  33           HG2      LYS  33 155.967  17.366   2.072
  947   2HG   LYS  33           HG1      LYS  33 156.784  15.937   2.711
  948   1HD   LYS  33           HD2      LYS  33 157.139  15.110   0.407
  949   2HD   LYS  33           HD1      LYS  33 156.332  16.542  -0.229
  950   1HE   LYS  33           HE2      LYS  33 159.017  16.318   1.104
  951   2HE   LYS  33           HE1      LYS  33 158.578  17.173  -0.374
  952   1HZ   LYS  33           HZ2      LYS  33 157.211  18.662   1.114
  953   2HZ   LYS  33           HZ1      LYS  33 158.034  17.962   2.425
  954   3HZ   LYS  33           HZ3      LYS  33 158.898  18.818   1.242
  955    H    LEU  34           HN       LEU  34 153.506  13.229   3.066
  956    HA   LEU  34           HA       LEU  34 150.841  13.411   2.036
  957   1HB   LEU  34           HB2      LEU  34 152.263  11.222   3.573
  958   2HB   LEU  34           HB1      LEU  34 150.669  11.024   2.861
  959    HG   LEU  34           HG       LEU  34 153.033  11.944   1.219
  960   1HD1  LEU  34          HD12      LEU  34 153.593   9.769   2.244
  961   2HD1  LEU  34          HD11      LEU  34 152.072   9.099   1.656
  962   3HD1  LEU  34          HD13      LEU  34 153.316   9.599   0.510
  963   1HD2  LEU  34          HD22      LEU  34 150.281  10.812   0.612
  964   2HD2  LEU  34          HD21      LEU  34 150.994  12.315   0.037
  965   3HD2  LEU  34          HD23      LEU  34 151.574  10.775  -0.582
  966    H    GLU  35           HN       GLU  35 152.127  13.212   5.322
  967    HA   GLU  35           HA       GLU  35 149.635  12.945   6.690
  968   1HB   GLU  35           HB2      GLU  35 151.818  12.677   7.818
  969   2HB   GLU  35           HB1      GLU  35 152.135  14.399   7.611
  970   1HG   GLU  35           HG2      GLU  35 150.240  14.976   9.014
  971   2HG   GLU  35           HG1      GLU  35 149.753  13.283   9.117
  972    H    GLU  36           HN       GLU  36 151.371  15.839   5.595
  973    HA   GLU  36           HA       GLU  36 149.518  17.729   6.727
  974   1HB   GLU  36           HB2      GLU  36 151.463  17.921   4.409
  975   2HB   GLU  36           HB1      GLU  36 150.527  19.293   5.002
  976   1HG   GLU  36           HG2      GLU  36 152.357  17.625   6.751
  977   2HG   GLU  36           HG1      GLU  36 152.849  19.132   5.975
  978    H    ARG  37           HN       ARG  37 149.422  15.641   3.999
  979    HA   ARG  37           HA       ARG  37 147.333  17.221   2.621
  980   1HB   ARG  37           HB2      ARG  37 148.701  14.609   1.977
  981   2HB   ARG  37           HB1      ARG  37 147.372  15.255   1.013
  982   1HG   ARG  37           HG2      ARG  37 148.659  17.332   0.655
  983   2HG   ARG  37           HG1      ARG  37 149.996  16.664   1.588
  984   1HD   ARG  37           HD2      ARG  37 150.133  14.773  -0.014
  985   2HD   ARG  37           HD1      ARG  37 148.849  15.502  -0.972
  986    HE   ARG  37           HE       ARG  37 151.661  16.162  -1.036
  987   1HH1  ARG  37          HH21      ARG  37 148.543  17.644  -1.106
  988   2HH1  ARG  37          HH22      ARG  37 149.136  19.141  -1.744
  989   1HH2  ARG  37          HH11      ARG  37 152.433  18.092  -1.872
  990   2HH2  ARG  37          HH12      ARG  37 151.331  19.393  -2.178
  991    H    GLY  38           HN       GLY  38 147.250  15.185   5.254
  992   1HA   GLY  38           HA2      GLY  38 145.085  14.700   6.256
  993   2HA   GLY  38           HA1      GLY  38 144.401  14.489   4.653
  994    H    PHE  39           HN       PHE  39 147.405  12.927   4.765
  995    HA   PHE  39           HA       PHE  39 146.045  10.297   5.254
  996   1HB   PHE  39           HB2      PHE  39 148.636  10.963   3.840
  997   2HB   PHE  39           HB1      PHE  39 147.974   9.343   4.022
  998    HD1  PHE  39           HD1      PHE  39 147.627  12.586   2.339
  999    HD2  PHE  39           HD2      PHE  39 145.976   8.655   2.783
 1000    HE1  PHE  39           HE1      PHE  39 146.246  12.944   0.312
 1001    HE2  PHE  39           HE2      PHE  39 144.588   9.006   0.758
 1002    HZ   PHE  39           HZ       PHE  39 144.721  11.151  -0.481
 1003    H    ASP  40           HN       ASP  40 146.299  10.947   7.620
 1004    HA   ASP  40           HA       ASP  40 149.021  10.988   8.685
 1005   1HB   ASP  40           HB2      ASP  40 147.902  11.113  10.881
 1006   2HB   ASP  40           HB1      ASP  40 147.248  12.301   9.753
 1007    H    LYS  41           HN       LYS  41 146.905   8.461   7.780
 1008    HA   LYS  41           HA       LYS  41 148.589   6.547   9.346
 1009   1HB   LYS  41           HB2      LYS  41 145.569   6.420   9.126
 1010   2HB   LYS  41           HB1      LYS  41 146.597   5.197   9.880
 1011   1HG   LYS  41           HG2      LYS  41 147.446   6.905  11.465
 1012   2HG   LYS  41           HG1      LYS  41 146.382   8.103  10.731
 1013   1HD   LYS  41           HD2      LYS  41 144.419   6.743  11.359
 1014   2HD   LYS  41           HD1      LYS  41 145.495   5.558  12.103
 1015   1HE   LYS  41           HE2      LYS  41 144.626   7.051  13.829
 1016   2HE   LYS  41           HE1      LYS  41 146.356   7.325  13.624
 1017   1HZ   LYS  41           HZ3      LYS  41 144.761   8.930  11.871
 1018   2HZ   LYS  41           HZ2      LYS  41 144.421   9.228  13.507
 1019   3HZ   LYS  41           HZ1      LYS  41 146.007   9.392  12.923
 1020    H    ALA  42           HN       ALA  42 148.659   4.411   8.444
 1021    HA   ALA  42           HA       ALA  42 149.052   4.418   5.628
 1022   1HB   ALA  42           HB1      ALA  42 148.837   2.148   7.609
 1023   2HB   ALA  42           HB3      ALA  42 149.310   1.928   5.924
 1024   3HB   ALA  42           HB2      ALA  42 150.307   2.909   6.999
 1025    H    TYR  43           HN       TYR  43 146.337   2.952   7.497
 1026    HA   TYR  43           HA       TYR  43 145.156   1.693   5.250
 1027   1HB   TYR  43           HB2      TYR  43 143.064   1.601   6.490
 1028   2HB   TYR  43           HB1      TYR  43 144.420   1.192   7.531
 1029    HD1  TYR  43           HD1      TYR  43 142.205   4.053   6.542
 1030    HD2  TYR  43           HD2      TYR  43 144.734   2.334   9.558
 1031    HE1  TYR  43           HE1      TYR  43 141.485   5.791   8.137
 1032    HE2  TYR  43           HE2      TYR  43 144.006   4.078  11.155
 1033    HH   TYR  43           HH       TYR  43 141.494   5.719  11.071
 1034    H    VAL  44           HN       VAL  44 145.281   5.080   5.956
 1035    HA   VAL  44           HA       VAL  44 142.936   5.734   4.312
 1036    HB   VAL  44           HB       VAL  44 145.232   7.526   5.193
 1037   1HG1  VAL  44          HG11      VAL  44 143.733   8.301   3.270
 1038   2HG1  VAL  44          HG13      VAL  44 142.402   8.284   4.424
 1039   3HG1  VAL  44          HG12      VAL  44 143.774   9.362   4.676
 1040   1HG2  VAL  44          HG23      VAL  44 142.519   7.032   6.457
 1041   2HG2  VAL  44          HG22      VAL  44 144.068   6.500   7.113
 1042   3HG2  VAL  44          HG21      VAL  44 143.700   8.221   7.003
 1043    H    VAL  45           HN       VAL  45 146.368   5.400   3.976
 1044    HA   VAL  45           HA       VAL  45 146.512   6.390   1.223
 1045    HB   VAL  45           HB       VAL  45 148.459   4.754   2.885
 1046   1HG1  VAL  45          HG13      VAL  45 148.700   5.960   0.117
 1047   2HG1  VAL  45          HG12      VAL  45 150.097   5.485   1.082
 1048   3HG1  VAL  45          HG11      VAL  45 148.921   4.272   0.578
 1049   1HG2  VAL  45          HG21      VAL  45 148.190   7.690   2.208
 1050   2HG2  VAL  45          HG23      VAL  45 148.306   6.944   3.800
 1051   3HG2  VAL  45          HG22      VAL  45 149.720   7.000   2.749
 1052    H    LEU  46           HN       LEU  46 146.149   3.298   2.862
 1053    HA   LEU  46           HA       LEU  46 146.473   1.570   0.612
 1054   1HB   LEU  46           HB2      LEU  46 146.279   0.765   2.970
 1055   2HB   LEU  46           HB1      LEU  46 144.597   1.278   2.986
 1056    HG   LEU  46           HG       LEU  46 144.218  -0.272   0.998
 1057   1HD1  LEU  46          HD11      LEU  46 147.064  -0.973   1.661
 1058   2HD1  LEU  46          HD13      LEU  46 145.991  -2.178   0.952
 1059   3HD1  LEU  46          HD12      LEU  46 146.328  -0.683   0.085
 1060   1HD2  LEU  46          HD23      LEU  46 143.926  -0.813   3.612
 1061   2HD2  LEU  46          HD22      LEU  46 143.638  -2.024   2.370
 1062   3HD2  LEU  46          HD21      LEU  46 145.164  -2.008   3.237
 1063    H    GLY  47           HN       GLY  47 143.772   3.416   1.889
 1064   1HA   GLY  47           HA2      GLY  47 141.698   2.435   0.221
 1065   2HA   GLY  47           HA1      GLY  47 141.728   4.051   0.928
 1066    H    GLN  48           HN       GLN  48 144.071   5.060  -0.346
 1067    HA   GLN  48           HA       GLN  48 143.002   5.929  -2.847
 1068   1HB   GLN  48           HB2      GLN  48 144.796   7.104  -1.534
 1069   2HB   GLN  48           HB1      GLN  48 145.922   5.838  -2.019
 1070   1HG   GLN  48           HG2      GLN  48 146.197   7.697  -3.540
 1071   2HG   GLN  48           HG1      GLN  48 145.399   6.395  -4.422
 1072   1HE2  GLN  48          HE22      GLN  48 142.778   9.278  -3.140
 1073   2HE2  GLN  48          HE21      GLN  48 143.849   8.565  -2.033
 1074    H    PHE  49           HN       PHE  49 145.429   3.436  -2.073
 1075    HA   PHE  49           HA       PHE  49 146.023   2.639  -4.742
 1076   1HB   PHE  49           HB2      PHE  49 147.335   1.949  -2.759
 1077   2HB   PHE  49           HB1      PHE  49 145.975   0.979  -2.200
 1078    HD1  PHE  49           HD1      PHE  49 148.023   1.469  -5.310
 1079    HD2  PHE  49           HD2      PHE  49 146.011  -1.305  -2.716
 1080    HE1  PHE  49           HE1      PHE  49 148.845  -0.418  -6.690
 1081    HE2  PHE  49           HE2      PHE  49 146.831  -3.191  -4.102
 1082    HZ   PHE  49           HZ       PHE  49 148.248  -2.748  -6.088
 1083    H    LEU  50           HN       LEU  50 143.512   1.611  -2.485
 1084    HA   LEU  50           HA       LEU  50 142.442  -0.461  -4.202
 1085   1HB   LEU  50           HB2      LEU  50 141.168   1.106  -1.936
 1086   2HB   LEU  50           HB1      LEU  50 140.417  -0.286  -2.714
 1087    HG   LEU  50           HG       LEU  50 143.153  -0.357  -1.398
 1088   1HD1  LEU  50          HD11      LEU  50 140.417  -1.084  -0.320
 1089   2HD1  LEU  50          HD13      LEU  50 141.919  -1.663   0.403
 1090   3HD1  LEU  50          HD12      LEU  50 141.571   0.066   0.356
 1091   1HD2  LEU  50          HD22      LEU  50 141.377  -2.394  -2.732
 1092   2HD2  LEU  50          HD21      LEU  50 143.125  -2.196  -2.836
 1093   3HD2  LEU  50          HD23      LEU  50 142.405  -2.911  -1.398
 1094    H    VAL  51           HN       VAL  51 141.700   2.977  -3.768
 1095    HA   VAL  51           HA       VAL  51 139.413   3.036  -5.495
 1096    HB   VAL  51           HB       VAL  51 141.347   5.198  -4.631
 1097   1HG1  VAL  51          HG12      VAL  51 138.820   5.348  -6.287
 1098   2HG1  VAL  51          HG11      VAL  51 139.432   6.731  -5.380
 1099   3HG1  VAL  51          HG13      VAL  51 140.406   6.018  -6.666
 1100   1HG2  VAL  51          HG23      VAL  51 139.826   4.032  -2.946
 1101   2HG2  VAL  51          HG22      VAL  51 139.637   5.781  -3.056
 1102   3HG2  VAL  51          HG21      VAL  51 138.467   4.717  -3.834
 1103    H    LEU  52           HN       LEU  52 142.851   3.118  -6.191
 1104    HA   LEU  52           HA       LEU  52 142.384   4.068  -8.960
 1105   1HB   LEU  52           HB2      LEU  52 144.926   3.183  -7.569
 1106   2HB   LEU  52           HB1      LEU  52 144.845   3.875  -9.187
 1107    HG   LEU  52           HG       LEU  52 143.873   5.263  -6.669
 1108   1HD1  LEU  52          HD11      LEU  52 146.444   5.466  -8.247
 1109   2HD1  LEU  52          HD13      LEU  52 145.898   6.747  -7.164
 1110   3HD1  LEU  52          HD12      LEU  52 146.252   5.141  -6.525
 1111   1HD2  LEU  52          HD21      LEU  52 143.909   5.979  -9.596
 1112   2HD2  LEU  52          HD23      LEU  52 142.664   6.288  -8.384
 1113   3HD2  LEU  52          HD22      LEU  52 144.129   7.263  -8.407
 1114    H    LYS  53           HN       LYS  53 141.555   1.290  -7.769
 1115    HA   LYS  53           HA       LYS  53 141.465  -0.924  -8.546
 1116   1HB   LYS  53           HB2      LYS  53 141.833   0.621 -11.117
 1117   2HB   LYS  53           HB1      LYS  53 141.470  -1.102 -11.073
 1118   1HG   LYS  53           HG2      LYS  53 139.434  -0.608  -9.723
 1119   2HG   LYS  53           HG1      LYS  53 139.764   1.114  -9.886
 1120   1HD   LYS  53           HD2      LYS  53 139.646  -0.506 -12.414
 1121   2HD   LYS  53           HD1      LYS  53 138.125  -0.196 -11.584
 1122   1HE   LYS  53           HE2      LYS  53 138.864   1.514 -13.365
 1123   2HE   LYS  53           HE1      LYS  53 138.339   2.147 -11.806
 1124   1HZ   LYS  53           HZ1      LYS  53 140.674   2.237 -11.129
 1125   2HZ   LYS  53           HZ3      LYS  53 141.145   1.704 -12.668
 1126   3HZ   LYS  53           HZ2      LYS  53 140.372   3.206 -12.491
 1127    H    LYS  54           HN       LYS  54 144.113   0.015  -7.712
 1128    HA   LYS  54           HA       LYS  54 146.318  -0.758  -7.688
 1129   1HB   LYS  54           HB2      LYS  54 145.176  -3.041  -9.332
 1130   2HB   LYS  54           HB1      LYS  54 146.697  -3.048  -8.449
 1131   1HG   LYS  54           HG2      LYS  54 145.486  -2.716  -6.333
 1132   2HG   LYS  54           HG1      LYS  54 143.956  -2.698  -7.207
 1133   1HD   LYS  54           HD2      LYS  54 144.404  -4.997  -8.018
 1134   2HD   LYS  54           HD1      LYS  54 145.909  -5.015  -7.098
 1135   1HE   LYS  54           HE2      LYS  54 144.721  -4.816  -5.007
 1136   2HE   LYS  54           HE1      LYS  54 143.194  -4.538  -5.844
 1137   1HZ   LYS  54           HZ1      LYS  54 143.758  -6.820  -6.925
 1138   2HZ   LYS  54           HZ3      LYS  54 144.723  -7.027  -5.546
 1139   3HZ   LYS  54           HZ2      LYS  54 143.053  -6.758  -5.380
 1140    H    ASP  55           HN       ASP  55 145.204   0.820 -10.164
 1141    HA   ASP  55           HA       ASP  55 146.812  -0.105 -12.387
 1142   1HB   ASP  55           HB2      ASP  55 144.868   1.422 -12.657
 1143   2HB   ASP  55           HB1      ASP  55 145.770   2.681 -11.824
 1144    H    GLU  56           HN       GLU  56 149.001  -0.106 -12.381
 1145    HA   GLU  56           HA       GLU  56 150.594   1.165 -10.397
 1146   1HB   GLU  56           HB2      GLU  56 151.250  -0.868 -11.622
 1147   2HB   GLU  56           HB1      GLU  56 151.420   0.081 -13.098
 1148   1HG   GLU  56           HG2      GLU  56 153.188   1.427 -12.061
 1149   2HG   GLU  56           HG1      GLU  56 152.987   0.552 -10.543
 1150    H    ASP  57           HN       ASP  57 149.944   2.199 -13.768
 1151    HA   ASP  57           HA       ASP  57 151.868   4.354 -13.675
 1152   1HB   ASP  57           HB2      ASP  57 149.480   3.846 -15.462
 1153   2HB   ASP  57           HB1      ASP  57 150.576   5.210 -15.683
 1154    H    LEU  58           HN       LEU  58 148.414   4.188 -13.006
 1155    HA   LEU  58           HA       LEU  58 148.148   7.062 -12.614
 1156   1HB   LEU  58           HB2      LEU  58 146.419   4.842 -11.488
 1157   2HB   LEU  58           HB1      LEU  58 145.999   6.547 -11.523
 1158    HG   LEU  58           HG       LEU  58 146.509   4.822 -13.967
 1159   1HD1  LEU  58          HD13      LEU  58 144.394   4.311 -12.750
 1160   2HD1  LEU  58          HD12      LEU  58 143.933   6.006 -12.884
 1161   3HD1  LEU  58          HD11      LEU  58 144.096   5.020 -14.336
 1162   1HD2  LEU  58          HD22      LEU  58 145.928   7.756 -13.558
 1163   2HD2  LEU  58          HD21      LEU  58 147.077   6.995 -14.658
 1164   3HD2  LEU  58          HD23      LEU  58 145.353   6.952 -15.017
 1165    H    PHE  59           HN       PHE  59 148.813   4.329 -10.466
 1166    HA   PHE  59           HA       PHE  59 148.741   5.844  -8.021
 1167   1HB   PHE  59           HB2      PHE  59 148.657   3.406  -7.972
 1168   2HB   PHE  59           HB1      PHE  59 150.241   3.306  -8.738
 1169    HD1  PHE  59           HD1      PHE  59 148.463   4.487  -5.679
 1170    HD2  PHE  59           HD2      PHE  59 152.239   3.462  -7.457
 1171    HE1  PHE  59           HE1      PHE  59 149.547   4.605  -3.450
 1172    HE2  PHE  59           HE2      PHE  59 153.322   3.583  -5.230
 1173    HZ   PHE  59           HZ       PHE  59 151.976   4.154  -3.225
 1174    H    ARG  60           HN       ARG  60 151.449   4.883 -10.153
 1175    HA   ARG  60           HA       ARG  60 153.502   6.175  -8.674
 1176   1HB   ARG  60           HB2      ARG  60 153.255   5.588 -11.634
 1177   2HB   ARG  60           HB1      ARG  60 154.722   6.222 -10.894
 1178   1HG   ARG  60           HG2      ARG  60 154.871   4.266  -9.436
 1179   2HG   ARG  60           HG1      ARG  60 153.361   3.638 -10.079
 1180   1HD   ARG  60           HD2      ARG  60 155.276   2.545 -11.169
 1181   2HD   ARG  60           HD1      ARG  60 154.381   3.518 -12.334
 1182    HE   ARG  60           HE       ARG  60 156.349   5.232 -11.377
 1183   1HH1  ARG  60          HH21      ARG  60 156.202   2.095 -12.799
 1184   2HH1  ARG  60          HH22      ARG  60 157.758   2.215 -13.550
 1185   1HH2  ARG  60          HH11      ARG  60 158.385   5.407 -12.350
 1186   2HH2  ARG  60          HH12      ARG  60 158.995   4.089 -13.295
 1187    H    GLU  61           HN       GLU  61 151.551   7.427 -11.415
 1188    HA   GLU  61           HA       GLU  61 152.824   9.985 -11.476
 1189   1HB   GLU  61           HB2      GLU  61 151.338   9.039 -13.278
 1190   2HB   GLU  61           HB1      GLU  61 149.957   9.339 -12.222
 1191   1HG   GLU  61           HG2      GLU  61 150.170  11.213 -13.746
 1192   2HG   GLU  61           HG1      GLU  61 150.631  11.758 -12.135
 1193    H    TRP  62           HN       TRP  62 150.081   8.715  -9.628
 1194    HA   TRP  62           HA       TRP  62 149.287  11.256  -8.534
 1195   1HB   TRP  62           HB2      TRP  62 147.689   9.484  -8.425
 1196   2HB   TRP  62           HB1      TRP  62 148.839   8.401  -7.639
 1197    HD1  TRP  62           HD1      TRP  62 146.587  11.405  -6.945
 1198    HE1  TRP  62           HE1      TRP  62 146.358  11.706  -4.395
 1199    HE3  TRP  62           HE3      TRP  62 150.001   7.961  -5.351
 1200    HZ2  TRP  62           HZ2      TRP  62 147.502  10.629  -1.982
 1201    HZ3  TRP  62           HZ3      TRP  62 150.399   7.610  -2.934
 1202    HH2  TRP  62           HH2      TRP  62 149.161   8.940  -1.251
 1203    H    LEU  63           HN       LEU  63 151.469   8.708  -7.317
 1204    HA   LEU  63           HA       LEU  63 151.937  10.026  -4.802
 1205   1HB   LEU  63           HB2      LEU  63 152.348   7.631  -5.086
 1206   2HB   LEU  63           HB1      LEU  63 153.594   7.967  -6.285
 1207    HG   LEU  63           HG       LEU  63 154.931   9.141  -4.572
 1208   1HD1  LEU  63          HD12      LEU  63 152.522   8.531  -2.871
 1209   2HD1  LEU  63          HD11      LEU  63 154.110   8.689  -2.126
 1210   3HD1  LEU  63          HD13      LEU  63 153.417  10.041  -3.019
 1211   1HD2  LEU  63          HD23      LEU  63 153.992   6.340  -3.922
 1212   2HD2  LEU  63          HD22      LEU  63 155.422   6.813  -4.843
 1213   3HD2  LEU  63          HD21      LEU  63 155.357   7.103  -3.103
 1214    H    LYS  64           HN       LYS  64 153.801   9.936  -7.830
 1215    HA   LYS  64           HA       LYS  64 155.960  11.554  -6.895
 1216   1HB   LYS  64           HB2      LYS  64 156.025  10.223  -9.001
 1217   2HB   LYS  64           HB1      LYS  64 154.911  11.384  -9.729
 1218   1HG   LYS  64           HG2      LYS  64 156.514  13.193  -9.400
 1219   2HG   LYS  64           HG1      LYS  64 157.613  12.103  -8.554
 1220   1HD   LYS  64           HD2      LYS  64 157.865  10.748 -10.575
 1221   2HD   LYS  64           HD1      LYS  64 156.724  11.783 -11.433
 1222   1HE   LYS  64           HE2      LYS  64 158.229  13.708 -11.137
 1223   2HE   LYS  64           HE1      LYS  64 159.363  12.694 -10.245
 1224   1HZ   LYS  64           HZ2      LYS  64 159.510  11.271 -12.245
 1225   2HZ   LYS  64           HZ1      LYS  64 158.558  12.398 -13.086
 1226   3HZ   LYS  64           HZ3      LYS  64 160.085  12.848 -12.499
 1227    H    ASP  65           HN       ASP  65 153.027  12.486  -8.694
 1228    HA   ASP  65           HA       ASP  65 153.649  15.303  -8.639
 1229   1HB   ASP  65           HB2      ASP  65 151.056  13.802  -9.085
 1230   2HB   ASP  65           HB1      ASP  65 151.196  15.556  -9.220
 1231    H    THR  66           HN       THR  66 152.148  13.111  -6.377
 1232    HA   THR  66           HA       THR  66 150.870  15.221  -4.833
 1233    HB   THR  66           HB       THR  66 151.375  12.289  -4.267
 1234    HG1  THR  66           HG1      THR  66 148.898  13.558  -4.611
 1235   1HG2  THR  66          HG22      THR  66 150.078  14.453  -2.621
 1236   2HG2  THR  66          HG21      THR  66 149.555  12.775  -2.474
 1237   3HG2  THR  66          HG23      THR  66 151.225  13.215  -2.110
 1238    H    CYS  67           HN       CYS  67 153.977  13.453  -4.605
 1239    HA   CYS  67           HA       CYS  67 154.707  15.328  -2.369
 1240   1HB   CYS  67           HB2      CYS  67 155.952  13.468  -1.325
 1241   2HB   CYS  67           HB1      CYS  67 154.224  13.128  -1.425
 1242    HG   CYS  67           HG       CYS  67 156.166  11.980  -3.588
 1243    H    GLY  68           HN       GLY  68 155.781  13.514  -5.195
 1244   1HA   GLY  68           HA2      GLY  68 157.541  14.438  -6.618
 1245   2HA   GLY  68           HA1      GLY  68 158.298  15.135  -5.185
 1246    H    ALA  69           HN       ALA  69 157.079  11.967  -4.705
 1247    HA   ALA  69           HA       ALA  69 159.552  10.839  -3.981
 1248   1HB   ALA  69           HB2      ALA  69 157.309   9.835  -3.487
 1249   2HB   ALA  69           HB1      ALA  69 157.199   9.342  -5.177
 1250   3HB   ALA  69           HB3      ALA  69 158.458   8.668  -4.140
 1251    H    ASN  70           HN       ASN  70 160.964   9.337  -5.147
 1252    HA   ASN  70           HA       ASN  70 161.176  10.062  -8.009
 1253   1HB   ASN  70           HB2      ASN  70 163.024   8.458  -6.218
 1254   2HB   ASN  70           HB1      ASN  70 163.385   8.992  -7.861
 1255   1HD2  ASN  70          HD22      ASN  70 162.885  12.511  -6.305
 1256   2HD2  ASN  70          HD21      ASN  70 161.760  11.568  -7.157
 1257    H    ALA  71           HN       ALA  71 161.975   8.179  -9.439
 1258    HA   ALA  71           HA       ALA  71 159.881   6.292  -9.739
 1259   1HB   ALA  71           HB3      ALA  71 161.512   7.042 -11.518
 1260   2HB   ALA  71           HB2      ALA  71 162.709   5.983 -10.772
 1261   3HB   ALA  71           HB1      ALA  71 161.238   5.300 -11.464
 1262    H    LYS  72           HN       LYS  72 163.001   6.014  -8.043
 1263    HA   LYS  72           HA       LYS  72 162.783   3.154  -7.678
 1264   1HB   LYS  72           HB2      LYS  72 164.366   5.276  -6.199
 1265   2HB   LYS  72           HB1      LYS  72 164.517   3.549  -5.879
 1266   1HG   LYS  72           HG2      LYS  72 165.158   3.164  -8.231
 1267   2HG   LYS  72           HG1      LYS  72 165.013   4.893  -8.552
 1268   1HD   LYS  72           HD2      LYS  72 166.766   5.357  -6.879
 1269   2HD   LYS  72           HD1      LYS  72 166.917   3.630  -6.558
 1270   1HE   LYS  72           HE2      LYS  72 167.343   4.878  -9.285
 1271   2HE   LYS  72           HE1      LYS  72 168.648   4.523  -8.155
 1272   1HZ   LYS  72           HZ1      LYS  72 167.371   2.193  -8.183
 1273   2HZ   LYS  72           HZ3      LYS  72 167.044   2.717  -9.763
 1274   3HZ   LYS  72           HZ2      LYS  72 168.651   2.569  -9.234
 1275    H    GLN  73           HN       GLN  73 161.884   5.952  -5.695
 1276    HA   GLN  73           HA       GLN  73 161.073   4.445  -3.397
 1277   1HB   GLN  73           HB2      GLN  73 160.345   7.214  -4.377
 1278   2HB   GLN  73           HB1      GLN  73 159.805   6.566  -2.828
 1279   1HG   GLN  73           HG2      GLN  73 162.139   6.232  -2.136
 1280   2HG   GLN  73           HG1      GLN  73 162.701   6.834  -3.696
 1281   1HE2  GLN  73          HE22      GLN  73 162.273   9.527  -0.893
 1282   2HE2  GLN  73          HE21      GLN  73 162.707   7.899  -0.691
 1283    H    SER  74           HN       SER  74 159.298   5.575  -6.258
 1284    HA   SER  74           HA       SER  74 156.715   4.835  -5.268
 1285   1HB   SER  74           HB2      SER  74 155.997   5.064  -7.592
 1286   2HB   SER  74           HB1      SER  74 157.067   6.390  -7.158
 1287    HG   SER  74           HG       SER  74 157.344   4.619  -9.111
 1288    H    ARG  75           HN       ARG  75 159.174   3.034  -7.147
 1289    HA   ARG  75           HA       ARG  75 157.530   0.794  -7.763
 1290   1HB   ARG  75           HB2      ARG  75 160.512   1.005  -7.283
 1291   2HB   ARG  75           HB1      ARG  75 159.726  -0.471  -7.844
 1292   1HG   ARG  75           HG2      ARG  75 158.888   0.674  -9.823
 1293   2HG   ARG  75           HG1      ARG  75 159.537   2.209  -9.250
 1294   1HD   ARG  75           HD2      ARG  75 161.825   1.217  -9.293
 1295   2HD   ARG  75           HD1      ARG  75 161.141  -0.258  -9.975
 1296    HE   ARG  75           HE       ARG  75 160.277   1.704 -11.714
 1297   1HH1  ARG  75          HH21      ARG  75 163.284   0.747 -10.336
 1298   2HH1  ARG  75          HH22      ARG  75 164.225   1.240 -11.703
 1299   1HH2  ARG  75          HH11      ARG  75 161.486   2.357 -13.516
 1300   2HH2  ARG  75          HH12      ARG  75 163.206   2.152 -13.506
 1301    H    ASP  76           HN       ASP  76 159.416   1.567  -4.838
 1302    HA   ASP  76           HA       ASP  76 159.033  -0.979  -3.592
 1303   1HB   ASP  76           HB2      ASP  76 159.590   1.775  -2.470
 1304   2HB   ASP  76           HB1      ASP  76 159.558   0.316  -1.478
 1305    H    CYS  77           HN       CYS  77 157.085   2.027  -3.466
 1306    HA   CYS  77           HA       CYS  77 155.291   1.026  -1.447
 1307   1HB   CYS  77           HB2      CYS  77 155.060   3.227  -3.507
 1308   2HB   CYS  77           HB1      CYS  77 153.773   2.867  -2.357
 1309    HG   CYS  77           HG       CYS  77 156.645   3.663  -1.395
 1310    H    PHE  78           HN       PHE  78 155.193   0.967  -5.032
 1311    HA   PHE  78           HA       PHE  78 152.529   0.012  -5.252
 1312   1HB   PHE  78           HB2      PHE  78 153.807   0.779  -7.195
 1313   2HB   PHE  78           HB1      PHE  78 154.916  -0.582  -7.023
 1314    HD1  PHE  78           HD1      PHE  78 151.508   0.445  -7.978
 1315    HD2  PHE  78           HD2      PHE  78 154.233  -2.852  -7.585
 1316    HE1  PHE  78           HE1      PHE  78 149.985  -0.974  -9.326
 1317    HE2  PHE  78           HE2      PHE  78 152.710  -4.270  -8.931
 1318    HZ   PHE  78           HZ       PHE  78 150.586  -3.333  -9.801
 1319    H    GLY  79           HN       GLY  79 155.504  -1.974  -5.451
 1320   1HA   GLY  79           HA2      GLY  79 154.162  -4.468  -5.284
 1321   2HA   GLY  79           HA1      GLY  79 155.858  -4.217  -4.873
 1322    H    CYS  80           HN       CYS  80 155.202  -2.245  -2.770
 1323    HA   CYS  80           HA       CYS  80 154.910  -4.118  -0.582
 1324   1HB   CYS  80           HB2      CYS  80 156.194  -2.014  -0.375
 1325   2HB   CYS  80           HB1      CYS  80 154.703  -1.093  -0.562
 1326    HG   CYS  80           HG       CYS  80 155.644  -2.273   2.018
 1327    H    LEU  81           HN       LEU  81 152.721  -1.562  -1.878
 1328    HA   LEU  81           HA       LEU  81 150.570  -2.338  -0.104
 1329   1HB   LEU  81           HB2      LEU  81 150.518  -0.775  -2.702
 1330   2HB   LEU  81           HB1      LEU  81 149.184  -0.884  -1.557
 1331    HG   LEU  81           HG       LEU  81 151.934   0.185  -0.853
 1332   1HD1  LEU  81          HD13      LEU  81 149.393   1.610  -1.681
 1333   2HD1  LEU  81          HD12      LEU  81 150.736   2.416  -0.871
 1334   3HD1  LEU  81          HD11      LEU  81 150.972   1.694  -2.461
 1335   1HD2  LEU  81          HD21      LEU  81 149.297  -0.051   0.604
 1336   2HD2  LEU  81          HD23      LEU  81 150.917  -0.456   1.174
 1337   3HD2  LEU  81          HD22      LEU  81 150.432   1.229   1.032
 1338    H    ARG  82           HN       ARG  82 151.406  -3.128  -3.481
 1339    HA   ARG  82           HA       ARG  82 149.003  -4.554  -4.066
 1340   1HB   ARG  82           HB2      ARG  82 150.602  -3.856  -5.813
 1341   2HB   ARG  82           HB1      ARG  82 151.780  -5.012  -5.190
 1342   1HG   ARG  82           HG2      ARG  82 150.254  -6.867  -5.679
 1343   2HG   ARG  82           HG1      ARG  82 149.026  -5.738  -6.243
 1344   1HD   ARG  82           HD2      ARG  82 150.660  -4.935  -7.960
 1345   2HD   ARG  82           HD1      ARG  82 151.764  -6.213  -7.472
 1346    HE   ARG  82           HE       ARG  82 149.526  -6.452  -9.263
 1347   1HH1  ARG  82          HH21      ARG  82 151.033  -8.122  -6.638
 1348   2HH1  ARG  82          HH22      ARG  82 150.258  -9.626  -6.998
 1349   1HH2  ARG  82          HH11      ARG  82 148.540  -8.399  -9.741
 1350   2HH2  ARG  82          HH12      ARG  82 148.856  -9.785  -8.753
 1351    H    GLU  83           HN       GLU  83 152.072  -5.649  -2.650
 1352    HA   GLU  83           HA       GLU  83 151.314  -8.429  -2.596
 1353   1HB   GLU  83           HB2      GLU  83 153.407  -6.869  -1.070
 1354   2HB   GLU  83           HB1      GLU  83 153.200  -8.614  -0.916
 1355   1HG   GLU  83           HG2      GLU  83 153.678  -8.955  -3.249
 1356   2HG   GLU  83           HG1      GLU  83 153.639  -7.223  -3.572
 1357    H    TRP  84           HN       TRP  84 150.995  -5.783  -0.220
 1358    HA   TRP  84           HA       TRP  84 150.133  -7.420   1.957
 1359   1HB   TRP  84           HB2      TRP  84 150.800  -5.032   2.198
 1360   2HB   TRP  84           HB1      TRP  84 149.343  -4.559   1.321
 1361    HD1  TRP  84           HD1      TRP  84 150.534  -5.958   4.644
 1362    HE1  TRP  84           HE1      TRP  84 148.596  -5.907   6.332
 1363    HE3  TRP  84           HE3      TRP  84 146.711  -4.603   1.542
 1364    HZ2  TRP  84           HZ2      TRP  84 145.781  -5.362   6.366
 1365    HZ3  TRP  84           HZ3      TRP  84 144.414  -4.326   2.427
 1366    HH2  TRP  84           HH2      TRP  84 143.944  -4.703   4.832
 1367    H    CYS  85           HN       CYS  85 148.334  -5.713  -0.598
 1368    HA   CYS  85           HA       CYS  85 145.734  -6.408   0.302
 1369   1HB   CYS  85           HB2      CYS  85 146.796  -5.883  -2.486
 1370   2HB   CYS  85           HB1      CYS  85 145.083  -6.096  -2.131
 1371    HG   CYS  85           HG       CYS  85 145.547  -4.017  -0.337
 1372    H    ASP  86           HN       ASP  86 147.992  -8.136  -1.809
 1373    HA   ASP  86           HA       ASP  86 146.279 -10.249  -2.606
 1374   1HB   ASP  86           HB2      ASP  86 149.266 -10.167  -2.119
 1375   2HB   ASP  86           HB1      ASP  86 148.443 -11.568  -2.808
 1376    H    ALA  87           HN       ALA  87 147.945  -9.658   0.422
 1377    HA   ALA  87           HA       ALA  87 147.280 -12.382   1.409
 1378   1HB   ALA  87           HB3      ALA  87 148.827 -10.092   2.647
 1379   2HB   ALA  87           HB2      ALA  87 148.532 -11.633   3.448
 1380   3HB   ALA  87           HB1      ALA  87 149.493 -11.579   1.969
 1381    H    PHE  88           HN       PHE  88 146.382  -8.995   1.960
 1382    HA   PHE  88           HA       PHE  88 144.414  -9.892   4.038
 1383   1HB   PHE  88           HB2      PHE  88 145.634  -7.183   3.499
 1384   2HB   PHE  88           HB1      PHE  88 144.425  -7.512   4.737
 1385    HD1  PHE  88           HD2      PHE  88 144.954  -9.166   6.574
 1386    HD2  PHE  88           HD1      PHE  88 147.935  -7.708   3.850
 1387    HE1  PHE  88           HE2      PHE  88 146.737  -9.892   8.135
 1388    HE2  PHE  88           HE1      PHE  88 149.719  -8.430   5.412
 1389    HZ   PHE  88           HZ       PHE  88 149.118  -9.517   7.557
 1390    H    LEU  89           HN       LEU  89 144.413  -8.751   0.770
 1391    HA   LEU  89           HA       LEU  89 141.745  -7.476   1.109
 1392   1HB   LEU  89           HB2      LEU  89 143.531  -6.467  -0.387
 1393   2HB   LEU  89           HB1      LEU  89 143.309  -7.846  -1.455
 1394    HG   LEU  89           HG       LEU  89 140.843  -7.255  -1.546
 1395   1HD1  LEU  89          HD12      LEU  89 141.888  -4.903   0.032
 1396   2HD1  LEU  89          HD11      LEU  89 140.534  -4.678  -1.072
 1397   3HD1  LEU  89          HD13      LEU  89 140.401  -5.820   0.260
 1398   1HD2  LEU  89          HD22      LEU  89 142.887  -5.256  -2.563
 1399   2HD2  LEU  89          HD21      LEU  89 142.364  -6.728  -3.384
 1400   3HD2  LEU  89          HD23      LEU  89 141.233  -5.392  -3.162
   
  No H/Q in entry =        1400
  Start of MODEL   16
    1   1H    MET   1           HT3      MET   1 115.048  -6.612  11.113
    2   2H    MET   1           HT2      MET   1 114.160  -5.445  11.971
    3   3H    MET   1           HT1      MET   1 115.495  -4.978  11.029
    4    HA   MET   1           HA       MET   1 116.498  -4.973  13.050
    5   1HB   MET   1           HB2      MET   1 114.327  -5.688  14.147
    6   2HB   MET   1           HB1      MET   1 114.825  -7.358  13.878
    7   1HG   MET   1           HG2      MET   1 116.910  -6.923  15.157
    8   2HG   MET   1           HG1      MET   1 116.357  -5.278  15.464
    9   1HE   MET   1           HE1      MET   1 115.772  -8.896  15.607
   10   2HE   MET   1           HE3      MET   1 114.875  -9.239  17.091
   11   3HE   MET   1           HE2      MET   1 114.018  -8.739  15.636
   12    H    THR   2           HN       THR   2 115.747  -8.045  11.458
   13    HA   THR   2           HA       THR   2 118.381  -9.169  12.211
   14    HB   THR   2           HB       THR   2 116.277 -10.361  10.383
   15    HG1  THR   2           HG1      THR   2 116.069  -9.800  12.934
   16   1HG2  THR   2          HG22      THR   2 118.608 -11.318  10.380
   17   2HG2  THR   2          HG21      THR   2 118.399 -11.681  12.093
   18   3HG2  THR   2          HG23      THR   2 117.363 -12.455  10.895
   19    H    THR   3           HN       THR   3 120.128  -9.157  10.842
   20    HA   THR   3           HA       THR   3 119.980  -7.590   8.397
   21    HB   THR   3           HB       THR   3 122.375  -8.145   8.171
   22    HG1  THR   3           HG1      THR   3 121.633 -10.044  10.082
   23   1HG2  THR   3          HG21      THR   3 121.670  -6.348   9.726
   24   2HG2  THR   3          HG23      THR   3 121.590  -7.530  11.033
   25   3HG2  THR   3          HG22      THR   3 123.138  -7.153  10.278
   26    H    SER   4           HN       SER   4 120.531  -8.436   6.249
   27    HA   SER   4           HA       SER   4 119.212 -10.995   5.735
   28   1HB   SER   4           HB2      SER   4 119.638 -10.480   3.371
   29   2HB   SER   4           HB1      SER   4 118.969  -9.070   4.187
   30    HG   SER   4           HG       SER   4 120.913  -8.778   2.810
   31    H    GLN   5           HN       GLN   5 120.359 -12.580   4.241
   32    HA   GLN   5           HA       GLN   5 122.644 -13.637   5.556
   33   1HB   GLN   5           HB2      GLN   5 121.456 -14.207   2.834
   34   2HB   GLN   5           HB1      GLN   5 122.796 -15.132   3.517
   35   1HG   GLN   5           HG2      GLN   5 121.442 -15.768   5.437
   36   2HG   GLN   5           HG1      GLN   5 120.118 -14.743   4.883
   37   1HE2  GLN   5          HE22      GLN   5 119.529 -18.298   3.761
   38   2HE2  GLN   5          HE21      GLN   5 119.829 -17.594   5.277
   39    H    LYS   6           HN       LYS   6 122.406 -11.274   2.979
   40    HA   LYS   6           HA       LYS   6 124.995 -11.609   1.847
   41   1HB   LYS   6           HB2      LYS   6 123.326  -9.102   2.189
   42   2HB   LYS   6           HB1      LYS   6 124.756  -9.218   1.168
   43   1HG   LYS   6           HG2      LYS   6 122.331 -11.003   0.837
   44   2HG   LYS   6           HG1      LYS   6 122.548  -9.495  -0.046
   45   1HD   LYS   6           HD2      LYS   6 124.819 -10.471  -0.799
   46   2HD   LYS   6           HD1      LYS   6 124.203 -12.020  -0.225
   47   1HE   LYS   6           HE2      LYS   6 122.167 -11.648  -1.672
   48   2HE   LYS   6           HE1      LYS   6 123.003 -10.261  -2.372
   49   1HZ   LYS   6           HZ1      LYS   6 124.346 -12.876  -2.260
   50   2HZ   LYS   6           HZ3      LYS   6 123.210 -12.569  -3.482
   51   3HZ   LYS   6           HZ2      LYS   6 124.589 -11.587  -3.340
   52    H    HIS   7           HN       HIS   7 123.860  -9.818   4.688
   53    HA   HIS   7           HA       HIS   7 126.281  -8.437   5.216
   54   1HB   HIS   7           HB2      HIS   7 124.254  -7.845   6.407
   55   2HB   HIS   7           HB1      HIS   7 124.138  -9.459   7.104
   56    HD2  HIS   7           HD2      HIS   7 125.995  -9.980   9.223
   57    HE1  HIS   7           HE1      HIS   7 127.339  -5.993   9.569
   58    HE2  HIS   7           HE2      HIS   7 127.369  -8.285  10.650
   59    H    ARG   8           HN       ARG   8 125.189 -11.588   6.569
   60    HA   ARG   8           HA       ARG   8 127.696 -12.058   7.885
   61   1HB   ARG   8           HB2      ARG   8 125.409 -13.893   7.158
   62   2HB   ARG   8           HB1      ARG   8 126.829 -14.428   8.059
   63   1HG   ARG   8           HG2      ARG   8 126.380 -12.621   9.737
   64   2HG   ARG   8           HG1      ARG   8 124.888 -12.248   8.875
   65   1HD   ARG   8           HD2      ARG   8 124.084 -14.545   9.257
   66   2HD   ARG   8           HD1      ARG   8 125.582 -14.934  10.100
   67    HE   ARG   8           HE       ARG   8 124.583 -12.718  11.454
   68   1HH1  ARG   8          HH21      ARG   8 123.437 -15.835  10.529
   69   2HH1  ARG   8          HH22      ARG   8 122.390 -16.003  11.900
   70   1HH2  ARG   8          HH11      ARG   8 123.227 -12.920  13.248
   71   2HH2  ARG   8          HH12      ARG   8 122.272 -14.351  13.440
   72    H    ASP   9           HN       ASP   9 126.430 -12.852   4.691
   73    HA   ASP   9           HA       ASP   9 128.439 -14.771   3.990
   74   1HB   ASP   9           HB2      ASP   9 126.838 -12.850   2.296
   75   2HB   ASP   9           HB1      ASP   9 127.883 -14.096   1.626
   76    H    PHE  10           HN       PHE  10 128.227 -11.266   3.710
   77    HA   PHE  10           HA       PHE  10 130.652 -10.917   2.238
   78   1HB   PHE  10           HB2      PHE  10 128.773  -9.193   2.807
   79   2HB   PHE  10           HB1      PHE  10 129.712  -8.890   4.269
   80    HD1  PHE  10           HD1      PHE  10 129.847  -8.907   0.557
   81    HD2  PHE  10           HD2      PHE  10 131.753  -7.637   4.190
   82    HE1  PHE  10           HE1      PHE  10 131.400  -7.486  -0.756
   83    HE2  PHE  10           HE2      PHE  10 133.306  -6.213   2.878
   84    HZ   PHE  10           HZ       PHE  10 133.129  -6.139   0.404
   85    H    VAL  11           HN       VAL  11 130.098 -10.840   5.784
   86    HA   VAL  11           HA       VAL  11 133.031 -10.725   6.220
   87    HB   VAL  11           HB       VAL  11 132.441 -10.447   8.597
   88   1HG1  VAL  11          HG12      VAL  11 132.310  -8.575   6.706
   89   2HG1  VAL  11          HG11      VAL  11 130.599  -8.584   7.115
   90   3HG1  VAL  11          HG13      VAL  11 131.803  -8.225   8.346
   91   1HG2  VAL  11          HG21      VAL  11 129.649 -10.888   7.532
   92   2HG2  VAL  11          HG23      VAL  11 130.457 -11.758   8.835
   93   3HG2  VAL  11          HG22      VAL  11 129.948 -10.086   9.071
   94    H    ALA  12           HN       ALA  12 131.129 -13.199   5.450
   95    HA   ALA  12           HA       ALA  12 132.213 -15.084   7.515
   96   1HB   ALA  12           HB2      ALA  12 130.114 -15.420   5.374
   97   2HB   ALA  12           HB1      ALA  12 130.752 -16.767   6.306
   98   3HB   ALA  12           HB3      ALA  12 129.880 -15.468   7.118
   99    H    GLU  13           HN       GLU  13 132.622 -13.983   4.277
  100    HA   GLU  13           HA       GLU  13 134.916 -15.799   3.940
  101   1HB   GLU  13           HB2      GLU  13 134.212 -16.695   1.822
  102   2HB   GLU  13           HB1      GLU  13 132.861 -16.931   2.927
  103   1HG   GLU  13           HG2      GLU  13 131.997 -14.656   2.043
  104   2HG   GLU  13           HG1      GLU  13 133.153 -14.878   0.732
  105    HA   PRO  14           HA       PRO  14 136.941 -12.203   2.292
  106   1HB   PRO  14           HB2      PRO  14 137.346 -13.849  -0.197
  107   2HB   PRO  14           HB1      PRO  14 138.512 -12.840   0.685
  108   1HG   PRO  14           HG2      PRO  14 138.487 -15.505   0.943
  109   2HG   PRO  14           HG1      PRO  14 138.878 -14.438   2.303
  110   1HD   PRO  14           HD2      PRO  14 136.444 -16.080   1.867
  111   2HD   PRO  14           HD1      PRO  14 137.102 -15.423   3.380
  112    H    MET  15           HN       MET  15 136.618 -10.530   0.612
  113    HA   MET  15           HA       MET  15 133.864 -10.596  -0.465
  114   1HB   MET  15           HB2      MET  15 134.538  -8.184  -1.153
  115   2HB   MET  15           HB1      MET  15 134.359  -8.534   0.565
  116   1HG   MET  15           HG2      MET  15 136.693  -8.618   0.918
  117   2HG   MET  15           HG1      MET  15 137.035  -8.814  -0.801
  118   1HE   MET  15           HE2      MET  15 135.358  -6.833   1.806
  119   2HE   MET  15           HE1      MET  15 136.865  -5.956   2.056
  120   3HE   MET  15           HE3      MET  15 135.462  -5.131   1.363
  121    H    GLY  16           HN       GLY  16 137.178 -10.794  -1.588
  122   1HA   GLY  16           HA2      GLY  16 138.067 -11.124  -3.726
  123   2HA   GLY  16           HA1      GLY  16 136.546 -11.945  -4.072
  124    H    GLU  17           HN       GLU  17 136.127 -11.143  -6.102
  125    HA   GLU  17           HA       GLU  17 136.132  -8.182  -6.510
  126   1HB   GLU  17           HB2      GLU  17 136.128 -10.527  -8.428
  127   2HB   GLU  17           HB1      GLU  17 135.962  -8.846  -8.941
  128   1HG   GLU  17           HG2      GLU  17 138.120  -8.289  -7.940
  129   2HG   GLU  17           HG1      GLU  17 138.281  -9.930  -7.315
  130    H    LYS  18           HN       LYS  18 133.987  -9.620  -5.067
  131    HA   LYS  18           HA       LYS  18 131.705 -10.023  -6.719
  132   1HB   LYS  18           HB2      LYS  18 131.943  -9.153  -3.829
  133   2HB   LYS  18           HB1      LYS  18 130.387  -9.455  -4.598
  134   1HG   LYS  18           HG2      LYS  18 131.046 -11.750  -5.119
  135   2HG   LYS  18           HG1      LYS  18 132.655 -11.463  -4.455
  136   1HD   LYS  18           HD2      LYS  18 131.734 -11.109  -2.235
  137   2HD   LYS  18           HD1      LYS  18 130.088 -11.217  -2.861
  138   1HE   LYS  18           HE2      LYS  18 132.134 -13.452  -2.988
  139   2HE   LYS  18           HE1      LYS  18 130.834 -13.345  -1.802
  140   1HZ   LYS  18           HZ3      LYS  18 129.622 -12.985  -4.237
  141   2HZ   LYS  18           HZ2      LYS  18 130.739 -14.239  -4.500
  142   3HZ   LYS  18           HZ1      LYS  18 129.569 -14.383  -3.278
  143    HA   PRO  19           HA       PRO  19 130.817  -5.911  -8.095
  144   1HB   PRO  19           HB2      PRO  19 128.053  -5.990  -8.289
  145   2HB   PRO  19           HB1      PRO  19 129.155  -6.734  -9.464
  146   1HG   PRO  19           HG2      PRO  19 127.663  -7.999  -7.211
  147   2HG   PRO  19           HG1      PRO  19 127.957  -8.607  -8.850
  148   1HD   PRO  19           HD2      PRO  19 129.387  -9.485  -6.709
  149   2HD   PRO  19           HD1      PRO  19 130.097  -9.364  -8.333
  150    H    VAL  20           HN       VAL  20 129.960  -3.865  -7.442
  151    HA   VAL  20           HA       VAL  20 130.041  -3.296  -4.700
  152    HB   VAL  20           HB       VAL  20 130.288  -1.559  -6.396
  153   1HG1  VAL  20          HG12      VAL  20 128.555  -2.546  -7.945
  154   2HG1  VAL  20          HG11      VAL  20 127.313  -1.863  -6.895
  155   3HG1  VAL  20          HG13      VAL  20 128.434  -0.798  -7.743
  156   1HG2  VAL  20          HG22      VAL  20 129.320  -1.084  -4.044
  157   2HG2  VAL  20          HG21      VAL  20 129.117   0.168  -5.269
  158   3HG2  VAL  20          HG23      VAL  20 127.769  -0.895  -4.860
  159    H    GLY  21           HN       GLY  21 127.231  -4.028  -6.720
  160   1HA   GLY  21           HA2      GLY  21 125.226  -3.458  -4.770
  161   2HA   GLY  21           HA1      GLY  21 125.011  -4.531  -6.152
  162    H    SER  22           HN       SER  22 127.637  -5.773  -4.630
  163    HA   SER  22           HA       SER  22 126.049  -7.915  -3.417
  164   1HB   SER  22           HB2      SER  22 129.048  -7.458  -3.481
  165   2HB   SER  22           HB1      SER  22 128.254  -8.932  -2.933
  166    HG   SER  22           HG       SER  22 127.515  -7.964  -5.426
  167    H    LEU  23           HN       LEU  23 127.491  -4.969  -2.406
  168    HA   LEU  23           HA       LEU  23 128.071  -5.602   0.325
  169   1HB   LEU  23           HB2      LEU  23 127.199  -2.982  -0.929
  170   2HB   LEU  23           HB1      LEU  23 127.874  -3.145   0.690
  171    HG   LEU  23           HG       LEU  23 129.300  -4.019  -1.841
  172   1HD1  LEU  23          HD13      LEU  23 128.905  -1.550  -1.723
  173   2HD1  LEU  23          HD12      LEU  23 129.746  -1.524  -0.173
  174   3HD1  LEU  23          HD11      LEU  23 130.613  -1.980  -1.640
  175   1HD2  LEU  23          HD23      LEU  23 130.009  -3.951   1.093
  176   2HD2  LEU  23          HD22      LEU  23 130.311  -5.216  -0.095
  177   3HD2  LEU  23          HD21      LEU  23 131.282  -3.750  -0.109
  178    H    ALA  24           HN       ALA  24 126.743  -5.849   2.054
  179    HA   ALA  24           HA       ALA  24 123.927  -6.185   1.707
  180   1HB   ALA  24           HB3      ALA  24 125.707  -5.843   4.121
  181   2HB   ALA  24           HB2      ALA  24 123.957  -5.986   4.297
  182   3HB   ALA  24           HB1      ALA  24 124.882  -7.297   3.564
  183    H    GLY  25           HN       GLY  25 122.238  -4.752   1.927
  184   1HA   GLY  25           HA2      GLY  25 121.196  -2.723   2.745
  185   2HA   GLY  25           HA1      GLY  25 122.793  -1.998   2.935
  186    H    ILE  26           HN       ILE  26 123.437  -3.215   0.155
  187    HA   ILE  26           HA       ILE  26 122.305  -0.928  -1.406
  188    HB   ILE  26           HB       ILE  26 124.526  -2.835  -2.189
  189   1HG1  ILE  26          HG12      ILE  26 125.216  -1.712  -0.150
  190   2HG1  ILE  26          HG11      ILE  26 126.050  -0.956  -1.505
  191   1HG2  ILE  26          HG21      ILE  26 123.448  -1.589  -4.028
  192   2HG2  ILE  26          HG23      ILE  26 123.753  -0.074  -3.176
  193   3HG2  ILE  26          HG22      ILE  26 125.105  -1.039  -3.770
  194   1HD1  ILE  26          HD12      ILE  26 124.063   0.728  -1.505
  195   2HD1  ILE  26          HD11      ILE  26 123.740   0.110   0.114
  196   3HD1  ILE  26          HD13      ILE  26 125.284   0.881  -0.244
  197    H    GLY  27           HN       GLY  27 120.546  -1.423  -2.703
  198   1HA   GLY  27           HA2      GLY  27 120.027  -4.262  -3.350
  199   2HA   GLY  27           HA1      GLY  27 118.910  -2.919  -3.588
  200    H    GLU  28           HN       GLU  28 119.032  -4.513  -5.681
  201    HA   GLU  28           HA       GLU  28 121.125  -4.207  -7.554
  202   1HB   GLU  28           HB2      GLU  28 118.165  -4.667  -7.958
  203   2HB   GLU  28           HB1      GLU  28 119.332  -4.710  -9.280
  204   1HG   GLU  28           HG2      GLU  28 120.591  -6.483  -8.114
  205   2HG   GLU  28           HG1      GLU  28 119.422  -6.445  -6.794
  206    H    VAL  29           HN       VAL  29 118.265  -2.114  -7.055
  207    HA   VAL  29           HA       VAL  29 118.816  -0.451  -9.342
  208    HB   VAL  29           HB       VAL  29 117.253   0.064  -6.797
  209   1HG1  VAL  29          HG11      VAL  29 117.711   1.802  -9.228
  210   2HG1  VAL  29          HG13      VAL  29 116.273   1.979  -8.220
  211   3HG1  VAL  29          HG12      VAL  29 117.874   2.239  -7.528
  212   1HG2  VAL  29          HG23      VAL  29 116.393  -1.653  -8.402
  213   2HG2  VAL  29          HG22      VAL  29 115.320  -0.262  -8.249
  214   3HG2  VAL  29          HG21      VAL  29 116.367  -0.415  -9.659
  215    H    LEU  30           HN       LEU  30 119.666  -0.169  -5.909
  216    HA   LEU  30           HA       LEU  30 121.030   2.345  -6.180
  217   1HB   LEU  30           HB2      LEU  30 121.338   0.139  -4.120
  218   2HB   LEU  30           HB1      LEU  30 122.029   1.754  -3.969
  219    HG   LEU  30           HG       LEU  30 119.068   1.198  -4.328
  220   1HD1  LEU  30          HD11      LEU  30 119.998   0.327  -2.171
  221   2HD1  LEU  30          HD13      LEU  30 120.548   1.960  -1.796
  222   3HD1  LEU  30          HD12      LEU  30 118.823   1.624  -1.954
  223   1HD2  LEU  30          HD22      LEU  30 120.733   3.682  -3.951
  224   2HD2  LEU  30          HD21      LEU  30 119.353   3.414  -5.015
  225   3HD2  LEU  30          HD23      LEU  30 119.101   3.641  -3.288
  226    H    GLY  31           HN       GLY  31 122.081  -1.026  -6.422
  227   1HA   GLY  31           HA2      GLY  31 124.883  -0.549  -6.527
  228   2HA   GLY  31           HA1      GLY  31 124.071  -1.927  -7.272
  229    H    LYS  32           HN       LYS  32 122.405  -0.479  -9.084
  230    HA   LYS  32           HA       LYS  32 124.210  -0.122 -11.274
  231   1HB   LYS  32           HB2      LYS  32 121.324   0.708 -10.896
  232   2HB   LYS  32           HB1      LYS  32 122.186   0.894 -12.418
  233   1HG   LYS  32           HG2      LYS  32 122.077  -1.781 -11.024
  234   2HG   LYS  32           HG1      LYS  32 120.756  -1.254 -12.064
  235   1HD   LYS  32           HD2      LYS  32 122.478  -0.869 -13.891
  236   2HD   LYS  32           HD1      LYS  32 123.655  -1.671 -12.853
  237   1HE   LYS  32           HE2      LYS  32 121.056  -2.879 -13.834
  238   2HE   LYS  32           HE1      LYS  32 122.668  -3.271 -14.434
  239   1HZ   LYS  32           HZ3      LYS  32 123.124  -3.730 -11.929
  240   2HZ   LYS  32           HZ2      LYS  32 121.438  -3.921 -11.850
  241   3HZ   LYS  32           HZ1      LYS  32 122.358  -4.904 -12.885
  242    H    LYS  33           HN       LYS  33 122.676   2.241  -9.090
  243    HA   LYS  33           HA       LYS  33 123.522   4.546 -10.576
  244   1HB   LYS  33           HB2      LYS  33 122.830   4.161  -7.652
  245   2HB   LYS  33           HB1      LYS  33 123.175   5.738  -8.364
  246   1HG   LYS  33           HG2      LYS  33 121.344   5.410  -9.987
  247   2HG   LYS  33           HG1      LYS  33 120.995   3.834  -9.275
  248   1HD   LYS  33           HD2      LYS  33 120.505   4.917  -7.112
  249   2HD   LYS  33           HD1      LYS  33 120.850   6.494  -7.822
  250   1HE   LYS  33           HE2      LYS  33 118.410   6.005  -7.771
  251   2HE   LYS  33           HE1      LYS  33 119.013   6.213  -9.416
  252   1HZ   LYS  33           HZ2      LYS  33 118.978   3.524  -8.235
  253   2HZ   LYS  33           HZ1      LYS  33 117.523   4.188  -8.809
  254   3HZ   LYS  33           HZ3      LYS  33 118.837   3.990  -9.863
  255    H    LEU  34           HN       LEU  34 125.022   2.810  -7.831
  256    HA   LEU  34           HA       LEU  34 127.286   4.554  -7.597
  257   1HB   LEU  34           HB2      LEU  34 126.987   1.613  -6.922
  258   2HB   LEU  34           HB1      LEU  34 128.372   2.595  -6.464
  259    HG   LEU  34           HG       LEU  34 125.518   3.253  -5.689
  260   1HD1  LEU  34          HD12      LEU  34 126.400   1.087  -4.721
  261   2HD1  LEU  34          HD11      LEU  34 127.681   2.027  -3.956
  262   3HD1  LEU  34          HD13      LEU  34 125.997   2.313  -3.521
  263   1HD2  LEU  34          HD22      LEU  34 128.226   4.450  -5.090
  264   2HD2  LEU  34          HD21      LEU  34 126.712   5.259  -5.487
  265   3HD2  LEU  34          HD23      LEU  34 126.945   4.568  -3.886
  266    H    GLU  35           HN       GLU  35 126.671   1.675  -9.539
  267    HA   GLU  35           HA       GLU  35 129.309   1.352 -10.580
  268   1HB   GLU  35           HB2      GLU  35 127.543  -0.345 -10.877
  269   2HB   GLU  35           HB1      GLU  35 126.671   0.748 -11.951
  270   1HG   GLU  35           HG2      GLU  35 128.583   0.748 -13.515
  271   2HG   GLU  35           HG1      GLU  35 129.467  -0.330 -12.434
  272    H    GLU  36           HN       GLU  36 126.606   3.341 -11.761
  273    HA   GLU  36           HA       GLU  36 127.957   4.284 -14.115
  274   1HB   GLU  36           HB2      GLU  36 125.491   4.483 -13.728
  275   2HB   GLU  36           HB1      GLU  36 125.816   5.696 -12.490
  276   1HG   GLU  36           HG2      GLU  36 126.914   7.130 -14.160
  277   2HG   GLU  36           HG1      GLU  36 126.637   5.910 -15.404
  278    H    ARG  37           HN       ARG  37 128.273   4.997 -10.773
  279    HA   ARG  37           HA       ARG  37 129.551   7.623 -11.254
  280   1HB   ARG  37           HB2      ARG  37 128.982   6.035  -8.745
  281   2HB   ARG  37           HB1      ARG  37 129.851   7.571  -8.738
  282   1HG   ARG  37           HG2      ARG  37 127.919   8.625  -9.889
  283   2HG   ARG  37           HG1      ARG  37 127.044   7.101  -9.789
  284   1HD   ARG  37           HD2      ARG  37 127.504   7.227  -7.249
  285   2HD   ARG  37           HD1      ARG  37 127.907   8.918  -7.532
  286    HE   ARG  37           HE       ARG  37 125.274   7.824  -7.308
  287   1HH1  ARG  37          HH21      ARG  37 127.078   9.998  -9.300
  288   2HH1  ARG  37          HH22      ARG  37 125.668  10.725  -9.989
  289   1HH2  ARG  37          HH11      ARG  37 123.447   8.783  -8.181
  290   2HH2  ARG  37          HH12      ARG  37 123.619  10.048  -9.352
  291    H    GLY  38           HN       GLY  38 130.598   4.520 -11.623
  292   1HA   GLY  38           HA2      GLY  38 132.909   4.114 -12.248
  293   2HA   GLY  38           HA1      GLY  38 133.424   5.367 -11.128
  294    H    PHE  39           HN       PHE  39 131.110   3.438  -9.589
  295    HA   PHE  39           HA       PHE  39 133.291   1.909  -8.207
  296   1HB   PHE  39           HB2      PHE  39 130.445   2.518  -7.377
  297   2HB   PHE  39           HB1      PHE  39 131.587   1.578  -6.423
  298    HD1  PHE  39           HD2      PHE  39 133.535   2.651  -5.380
  299    HD2  PHE  39           HD1      PHE  39 130.673   4.913  -7.627
  300    HE1  PHE  39           HE2      PHE  39 134.465   4.752  -4.443
  301    HE2  PHE  39           HE1      PHE  39 131.593   7.018  -6.696
  302    HZ   PHE  39           HZ       PHE  39 133.494   6.939  -5.099
  303    H    ASP  40           HN       ASP  40 133.222   0.479 -10.208
  304    HA   ASP  40           HA       ASP  40 130.835  -1.178 -10.555
  305   1HB   ASP  40           HB2      ASP  40 132.189  -2.343 -12.255
  306   2HB   ASP  40           HB1      ASP  40 132.257  -0.595 -12.482
  307    H    LYS  41           HN       LYS  41 133.559  -1.259  -8.477
  308    HA   LYS  41           HA       LYS  41 132.991  -4.136  -7.826
  309   1HB   LYS  41           HB2      LYS  41 135.676  -2.723  -7.743
  310   2HB   LYS  41           HB1      LYS  41 135.382  -4.399  -7.289
  311   1HG   LYS  41           HG2      LYS  41 134.652  -3.399 -10.042
  312   2HG   LYS  41           HG1      LYS  41 136.299  -3.906  -9.676
  313   1HD   LYS  41           HD2      LYS  41 135.473  -6.118  -8.973
  314   2HD   LYS  41           HD1      LYS  41 133.819  -5.623  -9.323
  315   1HE   LYS  41           HE2      LYS  41 134.845  -6.934 -11.181
  316   2HE   LYS  41           HE1      LYS  41 134.352  -5.314 -11.674
  317   1HZ   LYS  41           HZ2      LYS  41 137.085  -5.758 -10.687
  318   2HZ   LYS  41           HZ1      LYS  41 136.696  -6.196 -12.282
  319   3HZ   LYS  41           HZ3      LYS  41 136.509  -4.587 -11.775
  320    H    ALA  42           HN       ALA  42 133.088  -4.673  -5.627
  321    HA   ALA  42           HA       ALA  42 132.222  -2.652  -3.801
  322   1HB   ALA  42           HB1      ALA  42 131.711  -5.101  -3.628
  323   2HB   ALA  42           HB3      ALA  42 133.377  -5.365  -3.116
  324   3HB   ALA  42           HB2      ALA  42 132.293  -4.392  -2.123
  325    H    TYR  43           HN       TYR  43 135.421  -4.175  -4.247
  326    HA   TYR  43           HA       TYR  43 136.615  -3.089  -1.927
  327   1HB   TYR  43           HB2      TYR  43 138.759  -3.558  -2.906
  328   2HB   TYR  43           HB1      TYR  43 137.651  -4.847  -3.363
  329    HD1  TYR  43           HD1      TYR  43 139.195  -1.678  -4.549
  330    HD2  TYR  43           HD2      TYR  43 137.216  -5.325  -5.641
  331    HE1  TYR  43           HE1      TYR  43 139.692  -1.233  -6.934
  332    HE2  TYR  43           HE2      TYR  43 137.714  -4.882  -8.032
  333    HH   TYR  43           HH       TYR  43 139.067  -3.623  -9.423
  334    H    VAL  44           HN       VAL  44 135.657  -1.397  -4.794
  335    HA   VAL  44           HA       VAL  44 137.532   0.835  -4.355
  336    HB   VAL  44           HB       VAL  44 134.998   0.715  -6.041
  337   1HG1  VAL  44          HG11      VAL  44 135.827   3.030  -5.342
  338   2HG1  VAL  44          HG13      VAL  44 137.302   2.670  -6.231
  339   3HG1  VAL  44          HG12      VAL  44 135.762   2.745  -7.078
  340   1HG2  VAL  44          HG22      VAL  44 137.924   0.417  -6.796
  341   2HG2  VAL  44          HG21      VAL  44 136.719  -0.869  -6.802
  342   3HG2  VAL  44          HG23      VAL  44 136.577   0.473  -7.935
  343    H    VAL  45           HN       VAL  45 134.320  -0.125  -3.507
  344    HA   VAL  45           HA       VAL  45 133.554   2.426  -2.275
  345    HB   VAL  45           HB       VAL  45 132.323  -0.337  -2.016
  346   1HG1  VAL  45          HG13      VAL  45 131.377   2.413  -1.163
  347   2HG1  VAL  45          HG12      VAL  45 130.318   1.006  -1.258
  348   3HG1  VAL  45          HG11      VAL  45 131.671   1.017  -0.127
  349   1HG2  VAL  45          HG22      VAL  45 131.833   2.010  -3.856
  350   2HG2  VAL  45          HG21      VAL  45 132.089   0.318  -4.282
  351   3HG2  VAL  45          HG23      VAL  45 130.572   0.820  -3.534
  352    H    LEU  46           HN       LEU  46 134.903  -0.663  -1.277
  353    HA   LEU  46           HA       LEU  46 134.768  -0.302   1.555
  354   1HB   LEU  46           HB2      LEU  46 135.430  -2.442   0.426
  355   2HB   LEU  46           HB1      LEU  46 136.920  -1.672  -0.104
  356    HG   LEU  46           HG       LEU  46 137.378  -1.216   2.389
  357   1HD1  LEU  46          HD11      LEU  46 135.088  -3.173   2.590
  358   2HD1  LEU  46          HD13      LEU  46 136.281  -2.980   3.873
  359   3HD1  LEU  46          HD12      LEU  46 135.266  -1.620   3.404
  360   1HD2  LEU  46          HD22      LEU  46 137.430  -3.917   1.068
  361   2HD2  LEU  46          HD21      LEU  46 138.764  -2.814   1.387
  362   3HD2  LEU  46          HD23      LEU  46 138.038  -3.723   2.712
  363    H    GLY  47           HN       GLY  47 136.977   0.758  -0.946
  364   1HA   GLY  47           HA2      GLY  47 139.034   1.870   0.681
  365   2HA   GLY  47           HA1      GLY  47 138.669   2.387  -0.964
  366    H    GLN  48           HN       GLN  48 135.989   3.327  -0.545
  367    HA   GLN  48           HA       GLN  48 136.497   5.974   0.398
  368   1HB   GLN  48           HB2      GLN  48 134.611   5.266  -1.131
  369   2HB   GLN  48           HB1      GLN  48 133.801   4.587   0.282
  370   1HG   GLN  48           HG2      GLN  48 132.928   6.816  -0.072
  371   2HG   GLN  48           HG1      GLN  48 133.948   6.856   1.366
  372   1HE2  GLN  48          HE22      GLN  48 135.761   9.526  -0.042
  373   2HE2  GLN  48          HE21      GLN  48 134.937   8.898   1.304
  374    H    PHE  49           HN       PHE  49 135.093   3.132   1.974
  375    HA   PHE  49           HA       PHE  49 134.327   4.357   4.435
  376   1HB   PHE  49           HB2      PHE  49 133.659   2.071   3.750
  377   2HB   PHE  49           HB1      PHE  49 135.330   1.542   3.886
  378    HD1  PHE  49           HD1      PHE  49 132.777   3.371   5.953
  379    HD2  PHE  49           HD2      PHE  49 135.920   0.441   5.859
  380    HE1  PHE  49           HE1      PHE  49 132.389   2.874   8.351
  381    HE2  PHE  49           HE2      PHE  49 135.534  -0.052   8.252
  382    HZ   PHE  49           HZ       PHE  49 133.768   1.163   9.502
  383    H    LEU  50           HN       LEU  50 137.339   2.978   3.275
  384    HA   LEU  50           HA       LEU  50 138.812   3.331   5.750
  385   1HB   LEU  50           HB2      LEU  50 139.798   3.151   2.887
  386   2HB   LEU  50           HB1      LEU  50 140.835   3.069   4.309
  387    HG   LEU  50           HG       LEU  50 138.554   1.155   3.715
  388   1HD1  LEU  50          HD11      LEU  50 140.635   1.077   2.199
  389   2HD1  LEU  50          HD13      LEU  50 141.515   0.549   3.633
  390   3HD1  LEU  50          HD12      LEU  50 140.185  -0.425   3.008
  391   1HD2  LEU  50          HD23      LEU  50 140.502   1.474   5.993
  392   2HD2  LEU  50          HD22      LEU  50 138.793   1.042   6.036
  393   3HD2  LEU  50          HD21      LEU  50 139.986  -0.152   5.541
  394    H    VAL  51           HN       VAL  51 138.345   5.342   2.872
  395    HA   VAL  51           HA       VAL  51 140.189   7.408   3.605
  396    HB   VAL  51           HB       VAL  51 137.736   7.436   1.826
  397   1HG1  VAL  51          HG12      VAL  51 139.803   9.571   2.401
  398   2HG1  VAL  51          HG11      VAL  51 138.863   9.552   0.908
  399   3HG1  VAL  51          HG13      VAL  51 138.046   9.716   2.463
  400   1HG2  VAL  51          HG23      VAL  51 139.687   6.012   1.162
  401   2HG2  VAL  51          HG22      VAL  51 139.379   7.330   0.031
  402   3HG2  VAL  51          HG21      VAL  51 140.703   7.453   1.190
  403    H    LEU  52           HN       LEU  52 136.831   6.820   4.520
  404    HA   LEU  52           HA       LEU  52 136.581   9.500   5.736
  405   1HB   LEU  52           HB2      LEU  52 134.717   7.110   5.765
  406   2HB   LEU  52           HB1      LEU  52 134.322   8.719   6.369
  407    HG   LEU  52           HG       LEU  52 135.163   8.126   3.514
  408   1HD1  LEU  52          HD12      LEU  52 132.454   8.397   4.817
  409   2HD1  LEU  52          HD11      LEU  52 132.686   8.693   3.095
  410   3HD1  LEU  52          HD13      LEU  52 133.041   7.104   3.772
  411   1HD2  LEU  52          HD23      LEU  52 134.344  10.612   5.017
  412   2HD2  LEU  52          HD22      LEU  52 135.638  10.398   3.839
  413   3HD2  LEU  52          HD21      LEU  52 133.966  10.477   3.299
  414    H    LYS  53           HN       LYS  53 138.419   7.108   6.714
  415    HA   LYS  53           HA       LYS  53 139.099   6.276   8.805
  416   1HB   LYS  53           HB2      LYS  53 137.920   8.945   9.647
  417   2HB   LYS  53           HB1      LYS  53 139.047   7.975  10.598
  418   1HG   LYS  53           HG2      LYS  53 140.730   8.159   8.801
  419   2HG   LYS  53           HG1      LYS  53 139.607   9.133   7.850
  420   1HD   LYS  53           HD2      LYS  53 139.562  10.833   9.641
  421   2HD   LYS  53           HD1      LYS  53 140.691   9.861  10.584
  422   1HE   LYS  53           HE2      LYS  53 142.426  10.134   8.948
  423   2HE   LYS  53           HE1      LYS  53 141.304  10.845   7.789
  424   1HZ   LYS  53           HZ3      LYS  53 141.054  12.389  10.030
  425   2HZ   LYS  53           HZ2      LYS  53 142.723  12.087   9.929
  426   3HZ   LYS  53           HZ1      LYS  53 141.904  12.796   8.621
  427    H    LYS  54           HN       LYS  54 136.440   5.476   7.950
  428    HA   LYS  54           HA       LYS  54 134.565   4.365   8.782
  429   1HB   LYS  54           HB2      LYS  54 136.018   4.530  11.443
  430   2HB   LYS  54           HB1      LYS  54 134.732   3.409  11.006
  431   1HG   LYS  54           HG2      LYS  54 136.161   2.438   9.252
  432   2HG   LYS  54           HG1      LYS  54 137.451   3.559   9.675
  433   1HD   LYS  54           HD2      LYS  54 137.435   2.615  11.997
  434   2HD   LYS  54           HD1      LYS  54 136.267   1.410  11.452
  435   1HE   LYS  54           HE2      LYS  54 138.481   0.425  11.331
  436   2HE   LYS  54           HE1      LYS  54 137.912   0.708   9.686
  437   1HZ   LYS  54           HZ1      LYS  54 139.318   2.933  10.859
  438   2HZ   LYS  54           HZ3      LYS  54 140.272   1.546  10.655
  439   3HZ   LYS  54           HZ2      LYS  54 139.478   2.233   9.320
  440    H    ASP  55           HN       ASP  55 134.859   7.463   9.038
  441    HA   ASP  55           HA       ASP  55 133.317   8.175  11.380
  442   1HB   ASP  55           HB2      ASP  55 133.771   9.576   8.733
  443   2HB   ASP  55           HB1      ASP  55 132.855  10.300  10.057
  444    H    GLU  56           HN       GLU  56 131.304   7.350  11.680
  445    HA   GLU  56           HA       GLU  56 129.688   6.234   9.617
  446   1HB   GLU  56           HB2      GLU  56 129.569   5.644  12.041
  447   2HB   GLU  56           HB1      GLU  56 128.771   7.189  12.335
  448   1HG   GLU  56           HG2      GLU  56 126.963   6.560  10.778
  449   2HG   GLU  56           HG1      GLU  56 127.758   5.016  10.478
  450    H    ASP  57           HN       ASP  57 129.505   9.461  11.145
  451    HA   ASP  57           HA       ASP  57 127.012  10.164   9.873
  452   1HB   ASP  57           HB2      ASP  57 129.251  11.853  11.019
  453   2HB   ASP  57           HB1      ASP  57 127.745  12.534  10.406
  454    H    LEU  58           HN       LEU  58 130.382  10.618   8.991
  455    HA   LEU  58           HA       LEU  58 129.777  12.166   6.604
  456   1HB   LEU  58           HB2      LEU  58 132.252  10.542   7.271
  457   2HB   LEU  58           HB1      LEU  58 132.125  11.695   5.946
  458    HG   LEU  58           HG       LEU  58 131.760  12.378   8.881
  459   1HD1  LEU  58          HD12      LEU  58 134.086  12.711   6.971
  460   2HD1  LEU  58          HD11      LEU  58 133.940  13.641   8.463
  461   3HD1  LEU  58          HD13      LEU  58 134.075  11.884   8.527
  462   1HD2  LEU  58          HD23      LEU  58 131.553  13.941   6.310
  463   2HD2  LEU  58          HD22      LEU  58 130.538  14.023   7.751
  464   3HD2  LEU  58          HD21      LEU  58 132.138  14.756   7.762
  465    H    PHE  59           HN       PHE  59 130.292   8.725   7.246
  466    HA   PHE  59           HA       PHE  59 130.215   7.894   4.499
  467   1HB   PHE  59           HB2      PHE  59 131.068   6.425   6.266
  468   2HB   PHE  59           HB1      PHE  59 129.474   6.375   7.015
  469    HD1  PHE  59           HD1      PHE  59 131.363   5.486   3.927
  470    HD2  PHE  59           HD2      PHE  59 127.784   4.895   6.227
  471    HE1  PHE  59           HE1      PHE  59 130.731   3.592   2.454
  472    HE2  PHE  59           HE2      PHE  59 127.150   3.003   4.754
  473    HZ   PHE  59           HZ       PHE  59 128.624   2.352   2.868
  474    H    ARG  60           HN       ARG  60 127.637   8.113   6.979
  475    HA   ARG  60           HA       ARG  60 125.560   7.076   5.349
  476   1HB   ARG  60           HB2      ARG  60 125.465   9.068   7.621
  477   2HB   ARG  60           HB1      ARG  60 124.021   8.406   6.855
  478   1HG   ARG  60           HG2      ARG  60 124.774   6.121   7.418
  479   2HG   ARG  60           HG1      ARG  60 126.201   6.783   8.201
  480   1HD   ARG  60           HD2      ARG  60 123.316   7.239   9.005
  481   2HD   ARG  60           HD1      ARG  60 124.531   6.329   9.904
  482    HE   ARG  60           HE       ARG  60 125.652   8.848   9.668
  483   1HH1  ARG  60          HH21      ARG  60 122.660   7.522  10.752
  484   2HH1  ARG  60          HH22      ARG  60 122.366   8.777  11.908
  485   1HH2  ARG  60          HH11      ARG  60 125.281  10.504  11.172
  486   2HH2  ARG  60          HH12      ARG  60 123.849  10.466  12.144
  487    H    GLU  61           HN       GLU  61 126.568  10.512   5.765
  488    HA   GLU  61           HA       GLU  61 124.530  11.525   4.021
  489   1HB   GLU  61           HB2      GLU  61 125.814  12.969   5.572
  490   2HB   GLU  61           HB1      GLU  61 127.276  12.668   4.634
  491   1HG   GLU  61           HG2      GLU  61 126.265  14.829   4.011
  492   2HG   GLU  61           HG1      GLU  61 126.222  13.708   2.652
  493    H    TRP  62           HN       TRP  62 127.795  10.278   3.445
  494    HA   TRP  62           HA       TRP  62 128.022  11.087   0.726
  495   1HB   TRP  62           HB2      TRP  62 129.979  10.296   1.871
  496   2HB   TRP  62           HB1      TRP  62 129.210   8.752   2.239
  497    HD1  TRP  62           HD1      TRP  62 130.654  10.744  -0.720
  498    HE1  TRP  62           HE1      TRP  62 131.179   9.092  -2.633
  499    HE3  TRP  62           HE3      TRP  62 128.687   6.459   1.244
  500    HZ2  TRP  62           HZ2      TRP  62 130.813   6.312  -3.246
  501    HZ3  TRP  62           HZ3      TRP  62 128.792   4.331  -0.017
  502    HH2  TRP  62           HH2      TRP  62 129.851   4.252  -2.256
  503    H    LEU  63           HN       LEU  63 126.844   7.987   2.070
  504    HA   LEU  63           HA       LEU  63 126.271   6.870  -0.511
  505   1HB   LEU  63           HB2      LEU  63 126.583   5.480   1.496
  506   2HB   LEU  63           HB1      LEU  63 125.132   6.173   2.211
  507    HG   LEU  63           HG       LEU  63 123.785   5.252   0.351
  508   1HD1  LEU  63          HD11      LEU  63 126.504   4.379  -0.609
  509   2HD1  LEU  63          HD13      LEU  63 125.082   3.418  -1.021
  510   3HD1  LEU  63          HD12      LEU  63 125.180   5.102  -1.525
  511   1HD2  LEU  63          HD23      LEU  63 125.564   3.303   1.837
  512   2HD2  LEU  63          HD22      LEU  63 123.983   3.901   2.343
  513   3HD2  LEU  63          HD21      LEU  63 124.114   2.824   0.953
  514    H    LYS  64           HN       LYS  64 124.160   8.367   1.924
  515    HA   LYS  64           HA       LYS  64 121.750   8.135   0.379
  516   1HB   LYS  64           HB2      LYS  64 121.723   8.627   2.804
  517   2HB   LYS  64           HB1      LYS  64 122.430  10.211   2.483
  518   1HG   LYS  64           HG2      LYS  64 120.475  10.838   1.132
  519   2HG   LYS  64           HG1      LYS  64 119.774   9.240   1.378
  520   1HD   LYS  64           HD2      LYS  64 119.699   9.646   3.806
  521   2HD   LYS  64           HD1      LYS  64 120.400  11.246   3.561
  522   1HE   LYS  64           HE2      LYS  64 117.978  11.462   3.765
  523   2HE   LYS  64           HE1      LYS  64 118.455  11.831   2.108
  524   1HZ   LYS  64           HZ3      LYS  64 117.979   9.054   2.427
  525   2HZ   LYS  64           HZ2      LYS  64 116.621   9.946   2.926
  526   3HZ   LYS  64           HZ1      LYS  64 117.246  10.149   1.359
  527    H    ASP  65           HN       ASP  65 124.045  10.820   0.739
  528    HA   ASP  65           HA       ASP  65 122.680  12.568  -1.093
  529   1HB   ASP  65           HB2      ASP  65 124.413  13.255   0.626
  530   2HB   ASP  65           HB1      ASP  65 125.640  12.575  -0.443
  531    H    THR  66           HN       THR  66 124.982   9.962  -1.496
  532    HA   THR  66           HA       THR  66 125.704  10.702  -4.208
  533    HB   THR  66           HB       THR  66 126.145   8.197  -2.572
  534    HG1  THR  66           HG1      THR  66 127.257  10.255  -2.146
  535   1HG2  THR  66          HG23      THR  66 126.950   8.876  -5.401
  536   2HG2  THR  66          HG22      THR  66 127.842   7.702  -4.431
  537   3HG2  THR  66          HG21      THR  66 126.144   7.421  -4.818
  538    H    CYS  67           HN       CYS  67 123.334   8.383  -2.808
  539    HA   CYS  67           HA       CYS  67 122.321   7.980  -5.616
  540   1HB   CYS  67           HB2      CYS  67 121.816   5.652  -5.009
  541   2HB   CYS  67           HB1      CYS  67 123.540   5.994  -4.860
  542    HG   CYS  67           HG       CYS  67 123.300   5.203  -2.527
  543    H    GLY  68           HN       GLY  68 121.497   8.475  -2.249
  544   1HA   GLY  68           HA2      GLY  68 119.367   9.524  -1.668
  545   2HA   GLY  68           HA1      GLY  68 118.626   8.734  -3.060
  546    H    ALA  69           HN       ALA  69 120.784   6.720  -1.336
  547    HA   ALA  69           HA       ALA  69 118.877   4.748  -0.710
  548   1HB   ALA  69           HB2      ALA  69 121.317   4.344  -0.673
  549   2HB   ALA  69           HB1      ALA  69 121.461   5.358   0.763
  550   3HB   ALA  69           HB3      ALA  69 120.570   3.838   0.842
  551    H    ASN  70           HN       ASN  70 117.894   4.159   1.378
  552    HA   ASN  70           HA       ASN  70 117.082   6.557   2.894
  553   1HB   ASN  70           HB2      ASN  70 115.456   4.755   2.179
  554   2HB   ASN  70           HB1      ASN  70 116.250   3.677   3.326
  555   1HD2  ASN  70          HD22      ASN  70 114.072   6.839   4.812
  556   2HD2  ASN  70          HD21      ASN  70 114.722   6.948   3.247
  557    H    ALA  71           HN       ALA  71 116.984   6.279   5.349
  558    HA   ALA  71           HA       ALA  71 119.615   5.974   6.379
  559   1HB   ALA  71           HB1      ALA  71 117.659   7.286   7.384
  560   2HB   ALA  71           HB3      ALA  71 117.099   5.746   8.035
  561   3HB   ALA  71           HB2      ALA  71 118.667   6.391   8.521
  562    H    LYS  72           HN       LYS  72 116.998   3.624   6.037
  563    HA   LYS  72           HA       LYS  72 118.084   1.730   7.919
  564   1HB   LYS  72           HB2      LYS  72 116.213   1.415   5.557
  565   2HB   LYS  72           HB1      LYS  72 116.616   0.094   6.652
  566   1HG   LYS  72           HG2      LYS  72 115.762   1.408   8.557
  567   2HG   LYS  72           HG1      LYS  72 115.354   2.731   7.464
  568   1HD   LYS  72           HD2      LYS  72 113.816   1.240   6.234
  569   2HD   LYS  72           HD1      LYS  72 114.222  -0.080   7.332
  570   1HE   LYS  72           HE2      LYS  72 113.296   1.125   9.220
  571   2HE   LYS  72           HE1      LYS  72 113.042   2.562   8.229
  572   1HZ   LYS  72           HZ1      LYS  72 111.628   1.023   6.787
  573   2HZ   LYS  72           HZ3      LYS  72 111.626  -0.025   8.121
  574   3HZ   LYS  72           HZ2      LYS  72 110.978   1.539   8.270
  575    H    GLN  73           HN       GLN  73 118.438   2.101   4.394
  576    HA   GLN  73           HA       GLN  73 120.006  -0.273   4.052
  577   1HB   GLN  73           HB2      GLN  73 119.633   2.221   2.391
  578   2HB   GLN  73           HB1      GLN  73 120.753   0.953   1.896
  579   1HG   GLN  73           HG2      GLN  73 118.670   0.474   0.815
  580   2HG   GLN  73           HG1      GLN  73 118.816  -0.689   2.130
  581   1HE2  GLN  73          HE22      GLN  73 115.996   0.546   3.873
  582   2HE2  GLN  73          HE21      GLN  73 117.287  -0.556   3.867
  583    H    SER  74           HN       SER  74 120.921   3.094   4.778
  584    HA   SER  74           HA       SER  74 123.714   2.698   4.365
  585   1HB   SER  74           HB2      SER  74 122.472   4.910   4.602
  586   2HB   SER  74           HB1      SER  74 122.470   4.619   6.340
  587    HG   SER  74           HG       SER  74 124.767   4.442   6.194
  588    H    ARG  75           HN       ARG  75 121.644   2.258   7.257
  589    HA   ARG  75           HA       ARG  75 123.762   1.847   9.110
  590   1HB   ARG  75           HB2      ARG  75 120.947   0.727   9.017
  591   2HB   ARG  75           HB1      ARG  75 122.038   0.494  10.384
  592   1HG   ARG  75           HG2      ARG  75 122.240   2.938  10.649
  593   2HG   ARG  75           HG1      ARG  75 121.148   3.177   9.285
  594   1HD   ARG  75           HD2      ARG  75 119.397   1.886  10.523
  595   2HD   ARG  75           HD1      ARG  75 120.485   1.815  11.910
  596    HE   ARG  75           HE       ARG  75 120.335   4.518  11.342
  597   1HH1  ARG  75          HH21      ARG  75 118.095   1.954  11.886
  598   2HH1  ARG  75          HH22      ARG  75 116.886   2.979  12.587
  599   1HH2  ARG  75          HH11      ARG  75 118.769   5.872  12.250
  600   2HH2  ARG  75          HH12      ARG  75 117.268   5.197  12.792
  601    H    ASP  76           HN       ASP  76 122.141  -0.427   6.888
  602    HA   ASP  76           HA       ASP  76 123.476  -2.755   7.889
  603   1HB   ASP  76           HB2      ASP  76 122.190  -2.141   5.222
  604   2HB   ASP  76           HB1      ASP  76 122.826  -3.731   5.645
  605    H    CYS  77           HN       CYS  77 124.352  -0.431   5.314
  606    HA   CYS  77           HA       CYS  77 126.595  -1.976   4.375
  607   1HB   CYS  77           HB2      CYS  77 125.915   0.972   4.205
  608   2HB   CYS  77           HB1      CYS  77 127.326   0.260   3.422
  609    HG   CYS  77           HG       CYS  77 124.533   0.134   2.339
  610    H    PHE  78           HN       PHE  78 126.227   0.594   6.828
  611    HA   PHE  78           HA       PHE  78 128.996   0.973   7.342
  612   1HB   PHE  78           HB2      PHE  78 127.269   2.464   8.240
  613   2HB   PHE  78           HB1      PHE  78 126.640   1.158   9.243
  614    HD1  PHE  78           HD1      PHE  78 129.405   3.543   8.761
  615    HD2  PHE  78           HD2      PHE  78 127.857   0.365  11.200
  616    HE1  PHE  78           HE1      PHE  78 131.034   4.115  10.542
  617    HE2  PHE  78           HE2      PHE  78 129.486   0.934  12.980
  618    HZ   PHE  78           HZ       PHE  78 131.074   2.811  12.652
  619    H    GLY  79           HN       GLY  79 126.713  -0.999   9.273
  620   1HA   GLY  79           HA2      GLY  79 128.712  -2.283  10.822
  621   2HA   GLY  79           HA1      GLY  79 127.083  -2.905  10.574
  622    H    CYS  80           HN       CYS  80 127.392  -3.094   7.648
  623    HA   CYS  80           HA       CYS  80 128.527  -5.759   7.564
  624   1HB   CYS  80           HB2      CYS  80 126.700  -4.980   6.048
  625   2HB   CYS  80           HB1      CYS  80 127.868  -3.937   5.234
  626    HG   CYS  80           HG       CYS  80 129.186  -6.096   4.503
  627    H    LEU  81           HN       LEU  81 129.650  -2.612   6.212
  628    HA   LEU  81           HA       LEU  81 132.140  -3.751   5.286
  629   1HB   LEU  81           HB2      LEU  81 131.357  -0.884   5.902
  630   2HB   LEU  81           HB1      LEU  81 132.842  -1.361   5.083
  631    HG   LEU  81           HG       LEU  81 130.049  -2.016   4.094
  632   1HD1  LEU  81          HD11      LEU  81 131.997   0.175   3.339
  633   2HD1  LEU  81          HD13      LEU  81 130.633  -0.295   2.325
  634   3HD1  LEU  81          HD12      LEU  81 130.348   0.362   3.936
  635   1HD2  LEU  81          HD22      LEU  81 132.837  -2.579   3.097
  636   2HD2  LEU  81          HD21      LEU  81 131.416  -3.623   3.091
  637   3HD2  LEU  81          HD23      LEU  81 131.552  -2.314   1.920
  638    H    ARG  82           HN       ARG  82 131.126  -2.040   8.243
  639    HA   ARG  82           HA       ARG  82 133.726  -1.798   9.389
  640   1HB   ARG  82           HB2      ARG  82 131.774  -0.577  10.266
  641   2HB   ARG  82           HB1      ARG  82 131.058  -2.099  10.797
  642   1HG   ARG  82           HG2      ARG  82 132.959  -2.493  12.306
  643   2HG   ARG  82           HG1      ARG  82 133.728  -1.010  11.743
  644   1HD   ARG  82           HD2      ARG  82 131.819   0.297  12.594
  645   2HD   ARG  82           HD1      ARG  82 131.051  -1.189  13.153
  646    HE   ARG  82           HE       ARG  82 133.536  -1.245  14.368
  647   1HH1  ARG  82          HH21      ARG  82 130.942   1.010  14.108
  648   2HH1  ARG  82          HH22      ARG  82 131.223   1.713  15.666
  649   1HH2  ARG  82          HH11      ARG  82 133.917  -0.344  16.399
  650   2HH2  ARG  82          HH12      ARG  82 132.908   0.946  16.964
  651    H    GLU  83           HN       GLU  83 131.322  -4.422   9.596
  652    HA   GLU  83           HA       GLU  83 132.831  -5.961  11.483
  653   1HB   GLU  83           HB2      GLU  83 130.633  -6.653   9.528
  654   2HB   GLU  83           HB1      GLU  83 131.358  -7.863  10.593
  655   1HG   GLU  83           HG2      GLU  83 130.194  -5.257  11.601
  656   2HG   GLU  83           HG1      GLU  83 129.260  -6.749  11.493
  657    H    TRP  84           HN       TRP  84 132.823  -5.861   7.918
  658    HA   TRP  84           HA       TRP  84 134.458  -8.166   7.506
  659   1HB   TRP  84           HB2      TRP  84 133.292  -6.748   5.702
  660   2HB   TRP  84           HB1      TRP  84 134.628  -5.612   5.878
  661    HD1  TRP  84           HD1      TRP  84 133.810  -9.115   4.623
  662    HE1  TRP  84           HE1      TRP  84 135.810  -9.995   3.240
  663    HE3  TRP  84           HE3      TRP  84 137.236  -5.436   5.549
  664    HZ2  TRP  84           HZ2      TRP  84 138.482  -9.254   2.621
  665    HZ3  TRP  84           HZ3      TRP  84 139.501  -5.552   4.549
  666    HH2  TRP  84           HH2      TRP  84 140.128  -7.454   3.088
  667    H    CYS  85           HN       CYS  85 135.256  -4.759   8.136
  668    HA   CYS  85           HA       CYS  85 138.100  -5.031   8.012
  669   1HB   CYS  85           HB2      CYS  85 136.254  -3.125   9.463
  670   2HB   CYS  85           HB1      CYS  85 138.003  -2.997   9.615
  671    HG   CYS  85           HG       CYS  85 136.530  -2.756   6.862
  672    H    ASP  86           HN       ASP  86 135.775  -5.440  10.647
  673    HA   ASP  86           HA       ASP  86 137.626  -5.877  12.761
  674   1HB   ASP  86           HB2      ASP  86 134.811  -6.900  12.318
  675   2HB   ASP  86           HB1      ASP  86 135.707  -7.151  13.816
  676    H    ALA  87           HN       ALA  87 136.222  -8.128  10.390
  677    HA   ALA  87           HA       ALA  87 137.604 -10.415  11.620
  678   1HB   ALA  87           HB1      ALA  87 135.304 -10.468  10.455
  679   2HB   ALA  87           HB3      ALA  87 136.209 -10.422   8.940
  680   3HB   ALA  87           HB2      ALA  87 136.436 -11.762  10.064
  681    H    PHE  88           HN       PHE  88 137.926  -8.444   8.678
  682    HA   PHE  88           HA       PHE  88 140.396  -9.978   7.973
  683   1HB   PHE  88           HB2      PHE  88 138.684  -8.056   6.381
  684   2HB   PHE  88           HB1      PHE  88 140.166  -8.799   5.779
  685    HD1  PHE  88           HD2      PHE  88 140.319 -11.290   5.568
  686    HD2  PHE  88           HD1      PHE  88 136.627  -9.302   6.512
  687    HE1  PHE  88           HE2      PHE  88 139.060 -13.339   4.961
  688    HE2  PHE  88           HE1      PHE  88 135.365 -11.359   5.906
  689    HZ   PHE  88           HZ       PHE  88 136.588 -13.371   5.128
  690    H    LEU  89           HN       LEU  89 139.735  -6.609   7.096
  691    HA   LEU  89           HA       LEU  89 142.416  -5.882   8.071
  692   1HB   LEU  89           HB2      LEU  89 141.789  -4.981   5.923
  693   2HB   LEU  89           HB1      LEU  89 140.271  -4.357   6.563
  694    HG   LEU  89           HG       LEU  89 141.454  -2.724   7.927
  695   1HD1  LEU  89          HD12      LEU  89 143.894  -4.241   6.991
  696   2HD1  LEU  89          HD11      LEU  89 144.010  -2.583   7.585
  697   3HD1  LEU  89          HD13      LEU  89 143.411  -3.859   8.643
  698   1HD2  LEU  89          HD21      LEU  89 141.089  -2.339   5.412
  699   2HD2  LEU  89          HD23      LEU  89 142.293  -1.314   6.198
  700   3HD2  LEU  89          HD22      LEU  89 142.806  -2.693   5.222
  701   1H    MET   1           HT3      MET   1 168.252  -3.198  -4.777
  702   2H    MET   1           HT2      MET   1 168.815  -2.755  -6.317
  703   3H    MET   1           HT1      MET   1 167.302  -2.204  -5.772
  704    HA   MET   1           HA       MET   1 166.586  -3.901  -7.073
  705   1HB   MET   1           HB2      MET   1 168.984  -4.470  -7.681
  706   2HB   MET   1           HB1      MET   1 169.011  -5.531  -6.272
  707   1HG   MET   1           HG2      MET   1 167.056  -6.762  -7.184
  708   2HG   MET   1           HG1      MET   1 167.091  -5.727  -8.610
  709   1HE   MET   1           HE1      MET   1 168.809  -8.012  -6.315
  710   2HE   MET   1           HE3      MET   1 169.925  -8.997  -7.271
  711   3HE   MET   1           HE2      MET   1 170.414  -7.403  -6.704
  712    H    THR   2           HN       THR   2 168.093  -4.596  -3.945
  713    HA   THR   2           HA       THR   2 166.052  -6.648  -3.325
  714    HB   THR   2           HB       THR   2 168.201  -5.526  -1.507
  715    HG1  THR   2           HG1      THR   2 168.511  -6.854  -3.743
  716   1HG2  THR   2          HG22      THR   2 166.311  -6.861  -0.512
  717   2HG2  THR   2          HG21      THR   2 166.813  -8.217  -1.522
  718   3HG2  THR   2          HG23      THR   2 167.902  -7.588  -0.285
  719    H    THR   3           HN       THR   3 164.244  -6.225  -2.109
  720    HA   THR   3           HA       THR   3 163.610  -3.465  -1.455
  721    HB   THR   3           HB       THR   3 161.505  -4.402  -0.567
  722    HG1  THR   3           HG1      THR   3 163.022  -6.740  -0.734
  723   1HG2  THR   3          HG21      THR   3 161.775  -4.084  -3.011
  724   2HG2  THR   3          HG23      THR   3 162.373  -5.738  -3.145
  725   3HG2  THR   3          HG22      THR   3 160.710  -5.441  -2.640
  726    H    SER   4           HN       SER   4 163.114  -2.703   0.739
  727    HA   SER   4           HA       SER   4 165.111  -3.625   2.667
  728   1HB   SER   4           HB2      SER   4 164.285  -1.782   4.061
  729   2HB   SER   4           HB1      SER   4 164.545  -1.218   2.413
  730    HG   SER   4           HG       SER   4 162.472  -0.673   3.493
  731    H    GLN   5           HN       GLN   5 164.367  -3.982   4.986
  732    HA   GLN   5           HA       GLN   5 162.702  -6.281   5.102
  733   1HB   GLN   5           HB2      GLN   5 163.687  -4.410   7.265
  734   2HB   GLN   5           HB1      GLN   5 162.801  -5.898   7.603
  735   1HG   GLN   5           HG2      GLN   5 164.499  -7.226   6.475
  736   2HG   GLN   5           HG1      GLN   5 165.354  -5.767   5.974
  737   1HE2  GLN   5          HE22      GLN   5 166.911  -7.141   9.126
  738   2HE2  GLN   5          HE21      GLN   5 166.578  -7.820   7.606
  739    H    LYS   6           HN       LYS   6 161.882  -2.880   5.292
  740    HA   LYS   6           HA       LYS   6 159.420  -3.105   6.700
  741   1HB   LYS   6           HB2      LYS   6 160.233  -1.188   4.498
  742   2HB   LYS   6           HB1      LYS   6 158.809  -0.995   5.514
  743   1HG   LYS   6           HG2      LYS   6 161.621  -1.200   6.621
  744   2HG   LYS   6           HG1      LYS   6 160.838   0.334   6.250
  745   1HD   LYS   6           HD2      LYS   6 158.923  -0.478   7.786
  746   2HD   LYS   6           HD1      LYS   6 160.062  -1.701   8.348
  747   1HE   LYS   6           HE2      LYS   6 161.694   0.162   8.831
  748   2HE   LYS   6           HE1      LYS   6 160.387   1.300   8.503
  749   1HZ   LYS   6           HZ1      LYS   6 159.969  -0.903  10.407
  750   2HZ   LYS   6           HZ3      LYS   6 160.800   0.488  10.906
  751   3HZ   LYS   6           HZ2      LYS   6 159.205   0.613  10.333
  752    H    HIS   7           HN       HIS   7 160.242  -3.547   3.280
  753    HA   HIS   7           HA       HIS   7 157.583  -3.742   2.309
  754   1HB   HIS   7           HB2      HIS   7 159.440  -3.561   0.761
  755   2HB   HIS   7           HB1      HIS   7 160.139  -5.066   1.352
  756    HD2  HIS   7           HD2      HIS   7 158.793  -7.436   0.465
  757    HE1  HIS   7           HE1      HIS   7 156.307  -5.465  -2.321
  758    HE2  HIS   7           HE2      HIS   7 157.126  -7.726  -1.518
  759    H    ARG   8           HN       ARG   8 159.766  -6.413   3.339
  760    HA   ARG   8           HA       ARG   8 157.706  -8.394   3.086
  761   1HB   ARG   8           HB2      ARG   8 160.359  -8.399   4.531
  762   2HB   ARG   8           HB1      ARG   8 159.295  -9.805   4.459
  763   1HG   ARG   8           HG2      ARG   8 159.335  -9.640   1.958
  764   2HG   ARG   8           HG1      ARG   8 160.525  -8.346   2.104
  765   1HD   ARG   8           HD2      ARG   8 162.053  -9.873   3.289
  766   2HD   ARG   8           HD1      ARG   8 160.862 -11.166   3.167
  767    HE   ARG   8           HE       ARG   8 161.256 -10.341   0.539
  768   1HH1  ARG   8          HH21      ARG   8 163.219 -11.403   3.167
  769   2HH1  ARG   8          HH22      ARG   8 164.411 -12.142   2.151
  770   1HH2  ARG   8          HH11      ARG   8 162.794 -11.303  -0.801
  771   2HH2  ARG   8          HH12      ARG   8 164.170 -12.086  -0.097
  772    H    ASP   9           HN       ASP   9 158.787  -6.323   5.733
  773    HA   ASP   9           HA       ASP   9 157.426  -7.712   7.837
  774   1HB   ASP   9           HB2      ASP   9 158.131  -4.793   7.503
  775   2HB   ASP   9           HB1      ASP   9 157.469  -5.467   8.985
  776    H    PHE  10           HN       PHE  10 156.488  -5.150   5.617
  777    HA   PHE  10           HA       PHE  10 153.920  -4.644   6.765
  778   1HB   PHE  10           HB2      PHE  10 155.208  -3.338   4.902
  779   2HB   PHE  10           HB1      PHE  10 154.388  -4.435   3.791
  780    HD1  PHE  10           HD1      PHE  10 153.850  -1.923   6.476
  781    HD2  PHE  10           HD2      PHE  10 152.064  -4.176   3.286
  782    HE1  PHE  10           HE1      PHE  10 151.787  -0.559   6.669
  783    HE2  PHE  10           HE2      PHE  10 150.001  -2.810   3.476
  784    HZ   PHE  10           HZ       PHE  10 149.862  -1.002   5.169
  785    H    VAL  11           HN       VAL  11 154.824  -6.879   4.107
  786    HA   VAL  11           HA       VAL  11 152.076  -7.996   4.142
  787    HB   VAL  11           HB       VAL  11 152.808  -9.277   2.166
  788   1HG1  VAL  11          HG12      VAL  11 152.119  -6.705   2.216
  789   2HG1  VAL  11          HG11      VAL  11 153.781  -6.466   1.688
  790   3HG1  VAL  11          HG13      VAL  11 152.678  -7.450   0.732
  791   1HG2  VAL  11          HG21      VAL  11 155.455  -7.979   2.828
  792   2HG2  VAL  11          HG23      VAL  11 155.119  -9.696   2.610
  793   3HG2  VAL  11          HG22      VAL  11 155.095  -8.606   1.223
  794    H    ALA  12           HN       ALA  12 154.551  -8.504   6.111
  795    HA   ALA  12           HA       ALA  12 154.377 -11.498   6.078
  796   1HB   ALA  12           HB2      ALA  12 156.211  -9.600   7.537
  797   2HB   ALA  12           HB1      ALA  12 156.149 -11.323   7.881
  798   3HB   ALA  12           HB3      ALA  12 156.648 -10.760   6.288
  799    H    GLU  13           HN       GLU  13 153.278  -8.661   7.698
  800    HA   GLU  13           HA       GLU  13 151.652 -10.320   9.515
  801   1HB   GLU  13           HB2      GLU  13 152.359  -9.231  11.539
  802   2HB   GLU  13           HB1      GLU  13 153.831  -9.738  10.717
  803   1HG   GLU  13           HG2      GLU  13 153.821  -7.369   9.667
  804   2HG   GLU  13           HG1      GLU  13 152.657  -6.964  10.926
  805    HA   PRO  14           HA       PRO  14 148.415  -7.441   8.526
  806   1HB   PRO  14           HB2      PRO  14 148.276  -6.926  11.489
  807   2HB   PRO  14           HB1      PRO  14 146.956  -7.229  10.339
  808   1HG   PRO  14           HG2      PRO  14 147.856  -9.147  11.974
  809   2HG   PRO  14           HG1      PRO  14 147.305  -9.506  10.327
  810   1HD   PRO  14           HD2      PRO  14 150.068  -9.537  11.412
  811   2HD   PRO  14           HD1      PRO  14 149.413 -10.354   9.977
  812    H    MET  15           HN       MET  15 147.994  -5.084   8.537
  813    HA   MET  15           HA       MET  15 150.488  -3.547   8.951
  814   1HB   MET  15           HB2      MET  15 149.012  -1.696   7.884
  815   2HB   MET  15           HB1      MET  15 149.486  -3.059   6.871
  816   1HG   MET  15           HG2      MET  15 147.354  -4.065   7.015
  817   2HG   MET  15           HG1      MET  15 146.900  -3.109   8.426
  818   1HE   MET  15           HE2      MET  15 148.145  -3.104   4.965
  819   2HE   MET  15           HE1      MET  15 146.476  -3.156   4.405
  820   3HE   MET  15           HE3      MET  15 147.458  -1.712   4.130
  821    H    GLY  16           HN       GLY  16 147.315  -3.917  10.365
  822   1HA   GLY  16           HA2      GLY  16 146.327  -2.922  12.246
  823   2HA   GLY  16           HA1      GLY  16 147.979  -2.758  12.839
  824    H    GLU  17           HN       GLU  17 147.880  -0.701  13.679
  825    HA   GLU  17           HA       GLU  17 146.899   1.518  11.938
  826   1HB   GLU  17           HB2      GLU  17 147.428   1.311  14.914
  827   2HB   GLU  17           HB1      GLU  17 146.995   2.817  14.103
  828   1HG   GLU  17           HG2      GLU  17 144.899   1.842  13.321
  829   2HG   GLU  17           HG1      GLU  17 145.337   0.281  14.015
  830    H    LYS  18           HN       LYS  18 149.548   0.232  11.584
  831    HA   LYS  18           HA       LYS  18 151.628   1.809  12.712
  832   1HB   LYS  18           HB2      LYS  18 151.452   0.310  10.087
  833   2HB   LYS  18           HB1      LYS  18 152.928   1.118  10.615
  834   1HG   LYS  18           HG2      LYS  18 152.978  -0.227  12.655
  835   2HG   LYS  18           HG1      LYS  18 151.448  -0.988  12.218
  836   1HD   LYS  18           HD2      LYS  18 152.453  -2.007  10.255
  837   2HD   LYS  18           HD1      LYS  18 153.965  -1.144  10.537
  838   1HE   LYS  18           HE2      LYS  18 152.736  -3.146  12.457
  839   2HE   LYS  18           HE1      LYS  18 154.057  -3.501  11.343
  840   1HZ   LYS  18           HZ3      LYS  18 154.819  -1.217  12.655
  841   2HZ   LYS  18           HZ2      LYS  18 154.131  -2.189  13.868
  842   3HZ   LYS  18           HZ1      LYS  18 155.413  -2.782  12.923
  843    HA   PRO  19           HA       PRO  19 151.001   5.726  10.745
  844   1HB   PRO  19           HB2      PRO  19 153.605   6.650  10.537
  845   2HB   PRO  19           HB1      PRO  19 152.670   6.639  12.046
  846   1HG   PRO  19           HG2      PRO  19 154.734   4.707  11.087
  847   2HG   PRO  19           HG1      PRO  19 154.465   5.353  12.715
  848   1HD   PRO  19           HD2      PRO  19 153.641   2.862  11.999
  849   2HD   PRO  19           HD1      PRO  19 152.748   3.848  13.178
  850    H    VAL  20           HN       VAL  20 151.230   6.876   8.753
  851    HA   VAL  20           HA       VAL  20 151.286   5.329   6.417
  852    HB   VAL  20           HB       VAL  20 150.308   7.566   6.476
  853   1HG1  VAL  20          HG12      VAL  20 152.078   8.519   8.002
  854   2HG1  VAL  20          HG11      VAL  20 153.148   8.620   6.604
  855   3HG1  VAL  20          HG13      VAL  20 151.658   9.562   6.644
  856   1HG2  VAL  20          HG22      VAL  20 151.334   6.546   4.328
  857   2HG2  VAL  20          HG21      VAL  20 150.987   8.276   4.316
  858   3HG2  VAL  20          HG23      VAL  20 152.640   7.709   4.554
  859    H    GLY  21           HN       GLY  21 153.926   7.106   7.952
  860   1HA   GLY  21           HA2      GLY  21 155.862   6.742   5.884
  861   2HA   GLY  21           HA1      GLY  21 156.243   7.064   7.576
  862    H    SER  22           HN       SER  22 154.341   4.386   7.707
  863    HA   SER  22           HA       SER  22 156.659   2.634   8.085
  864   1HB   SER  22           HB2      SER  22 153.683   2.062   8.252
  865   2HB   SER  22           HB1      SER  22 154.962   0.960   8.755
  866    HG   SER  22           HG       SER  22 155.062   3.542   9.767
  867    H    LEU  23           HN       LEU  23 154.478   3.427   5.556
  868    HA   LEU  23           HA       LEU  23 154.441   0.949   4.122
  869   1HB   LEU  23           HB2      LEU  23 154.286   3.799   3.095
  870   2HB   LEU  23           HB1      LEU  23 153.885   2.367   2.151
  871    HG   LEU  23           HG       LEU  23 152.536   3.110   4.764
  872   1HD1  LEU  23          HD13      LEU  23 152.137   4.766   2.931
  873   2HD1  LEU  23          HD12      LEU  23 151.509   3.456   1.932
  874   3HD1  LEU  23          HD11      LEU  23 150.674   3.909   3.418
  875   1HD2  LEU  23          HD23      LEU  23 152.178   0.910   2.726
  876   2HD2  LEU  23          HD22      LEU  23 152.159   0.811   4.487
  877   3HD2  LEU  23          HD21      LEU  23 150.779   1.487   3.630
  878    H    ALA  24           HN       ALA  24 155.971  -0.007   2.867
  879    HA   ALA  24           HA       ALA  24 158.684   0.876   2.932
  880   1HB   ALA  24           HB3      ALA  24 157.175  -1.113   1.235
  881   2HB   ALA  24           HB2      ALA  24 158.886  -0.797   0.954
  882   3HB   ALA  24           HB1      ALA  24 158.349  -1.428   2.510
  883    H    GLY  25           HN       GLY  25 159.836   2.183   1.563
  884   1HA   GLY  25           HA2      GLY  25 160.275   3.259  -0.572
  885   2HA   GLY  25           HA1      GLY  25 158.565   3.117  -0.975
  886    H    ILE  26           HN       ILE  26 158.027   4.045   1.937
  887    HA   ILE  26           HA       ILE  26 158.188   6.966   1.317
  888    HB   ILE  26           HB       ILE  26 156.614   5.578   3.505
  889   1HG1  ILE  26          HG12      ILE  26 155.838   4.697   1.382
  890   2HG1  ILE  26          HG11      ILE  26 154.658   5.875   1.952
  891   1HG2  ILE  26          HG21      ILE  26 157.020   7.995   3.812
  892   2HG2  ILE  26          HG23      ILE  26 156.349   8.308   2.211
  893   3HG2  ILE  26          HG22      ILE  26 155.317   7.670   3.491
  894   1HD1  ILE  26          HD12      ILE  26 155.994   7.585   0.511
  895   2HD1  ILE  26          HD11      ILE  26 156.678   6.160  -0.269
  896   3HD1  ILE  26          HD13      ILE  26 154.940   6.442  -0.316
  897    H    GLY  27           HN       GLY  27 159.854   8.076   2.330
  898   1HA   GLY  27           HA2      GLY  27 161.169   6.817   4.662
  899   2HA   GLY  27           HA1      GLY  27 161.766   8.203   3.752
  900    H    GLU  28           HN       GLU  28 161.916   8.565   6.355
  901    HA   GLU  28           HA       GLU  28 159.636   9.421   7.785
  902   1HB   GLU  28           HB2      GLU  28 162.523  10.297   7.959
  903   2HB   GLU  28           HB1      GLU  28 161.290  10.829   9.102
  904   1HG   GLU  28           HG2      GLU  28 160.800   8.476   9.669
  905   2HG   GLU  28           HG1      GLU  28 162.037   7.945   8.529
  906    H    VAL  29           HN       VAL  29 161.723  11.320   5.580
  907    HA   VAL  29           HA       VAL  29 160.417  13.822   6.157
  908    HB   VAL  29           HB       VAL  29 162.011  12.880   3.757
  909   1HG1  VAL  29          HG11      VAL  29 160.756  15.561   4.374
  910   2HG1  VAL  29          HG13      VAL  29 162.164  15.418   3.321
  911   3HG1  VAL  29          HG12      VAL  29 160.652  14.624   2.885
  912   1HG2  VAL  29          HG23      VAL  29 163.192  13.123   5.950
  913   2HG2  VAL  29          HG22      VAL  29 163.773  14.262   4.735
  914   3HG2  VAL  29          HG21      VAL  29 162.678  14.809   6.005
  915    H    LEU  30           HN       LEU  30 159.925  11.383   3.630
  916    HA   LEU  30           HA       LEU  30 157.806  12.798   2.302
  917   1HB   LEU  30           HB2      LEU  30 158.448   9.834   2.386
  918   2HB   LEU  30           HB1      LEU  30 157.302  10.579   1.273
  919    HG   LEU  30           HG       LEU  30 160.226  11.365   1.482
  920   1HD1  LEU  30          HD11      LEU  30 159.873   9.019   0.674
  921   2HD1  LEU  30          HD13      LEU  30 158.878   9.662  -0.633
  922   3HD1  LEU  30          HD12      LEU  30 160.590  10.076  -0.542
  923   1HD2  LEU  30          HD22      LEU  30 157.911  12.227  -0.246
  924   2HD2  LEU  30          HD21      LEU  30 159.179  13.204   0.494
  925   3HD2  LEU  30          HD23      LEU  30 159.534  12.235  -0.933
  926    H    GLY  31           HN       GLY  31 157.860  10.434   4.938
  927   1HA   GLY  31           HA2      GLY  31 155.060   9.965   5.093
  928   2HA   GLY  31           HA1      GLY  31 156.177   9.826   6.452
  929    H    LYS  32           HN       LYS  32 157.078  12.535   6.512
  930    HA   LYS  32           HA       LYS  32 155.016  13.730   8.094
  931   1HB   LYS  32           HB2      LYS  32 157.512  14.893   6.832
  932   2HB   LYS  32           HB1      LYS  32 156.470  15.805   7.919
  933   1HG   LYS  32           HG2      LYS  32 157.581  13.121   8.739
  934   2HG   LYS  32           HG1      LYS  32 158.540  14.586   8.928
  935   1HD   LYS  32           HD2      LYS  32 156.591  15.577  10.220
  936   2HD   LYS  32           HD1      LYS  32 155.854  13.976  10.201
  937   1HE   LYS  32           HE2      LYS  32 158.575  14.652  11.349
  938   2HE   LYS  32           HE1      LYS  32 157.116  14.318  12.282
  939   1HZ   LYS  32           HZ3      LYS  32 157.115  12.148  10.877
  940   2HZ   LYS  32           HZ2      LYS  32 158.772  12.482  10.698
  941   3HZ   LYS  32           HZ1      LYS  32 158.107  12.272  12.247
  942    H    LYS  33           HN       LYS  33 155.967  14.250   4.698
  943    HA   LYS  33           HA       LYS  33 154.262  16.520   4.295
  944   1HB   LYS  33           HB2      LYS  33 155.369  14.456   2.374
  945   2HB   LYS  33           HB1      LYS  33 154.460  15.874   1.850
  946   1HG   LYS  33           HG2      LYS  33 156.103  17.342   2.966
  947   2HG   LYS  33           HG1      LYS  33 157.014  15.924   3.488
  948   1HD   LYS  33           HD2      LYS  33 157.378  15.286   1.131
  949   2HD   LYS  33           HD1      LYS  33 156.470  16.704   0.607
  950   1HE   LYS  33           HE2      LYS  33 158.927  17.097   0.551
  951   2HE   LYS  33           HE1      LYS  33 158.106  18.182   1.672
  952   1HZ   LYS  33           HZ2      LYS  33 159.125  15.615   2.665
  953   2HZ   LYS  33           HZ1      LYS  33 160.224  16.884   2.404
  954   3HZ   LYS  33           HZ3      LYS  33 158.934  17.091   3.484
  955    H    LEU  34           HN       LEU  34 153.714  13.026   3.742
  956    HA   LEU  34           HA       LEU  34 151.055  13.320   2.711
  957   1HB   LEU  34           HB2      LEU  34 152.347  11.016   4.198
  958   2HB   LEU  34           HB1      LEU  34 150.783  10.923   3.401
  959    HG   LEU  34           HG       LEU  34 153.346  11.689   1.981
  960   1HD1  LEU  34          HD12      LEU  34 153.320   9.332   2.902
  961   2HD1  LEU  34          HD11      LEU  34 151.898   9.027   1.903
  962   3HD1  LEU  34          HD13      LEU  34 153.440   9.427   1.146
  963   1HD2  LEU  34          HD22      LEU  34 150.483  11.231   1.130
  964   2HD2  LEU  34          HD21      LEU  34 151.605  12.498   0.637
  965   3HD2  LEU  34          HD23      LEU  34 151.787  10.866   0.003
  966    H    GLU  35           HN       GLU  35 152.327  12.964   5.981
  967    HA   GLU  35           HA       GLU  35 149.829  12.663   7.326
  968   1HB   GLU  35           HB2      GLU  35 151.997  12.293   8.444
  969   2HB   GLU  35           HB1      GLU  35 152.349  14.019   8.339
  970   1HG   GLU  35           HG2      GLU  35 150.371  14.514   9.733
  971   2HG   GLU  35           HG1      GLU  35 150.003  12.791   9.825
  972    H    GLU  36           HN       GLU  36 151.604  15.609   6.417
  973    HA   GLU  36           HA       GLU  36 149.763  17.440   7.649
  974   1HB   GLU  36           HB2      GLU  36 152.065  18.055   6.880
  975   2HB   GLU  36           HB1      GLU  36 151.516  17.896   5.212
  976   1HG   GLU  36           HG2      GLU  36 149.838  19.656   5.579
  977   2HG   GLU  36           HG1      GLU  36 150.342  19.800   7.262
  978    H    ARG  37           HN       ARG  37 149.626  15.506   4.817
  979    HA   ARG  37           HA       ARG  37 147.529  17.165   3.548
  980   1HB   ARG  37           HB2      ARG  37 148.855  14.565   2.762
  981   2HB   ARG  37           HB1      ARG  37 147.550  15.306   1.831
  982   1HG   ARG  37           HG2      ARG  37 148.903  17.380   1.652
  983   2HG   ARG  37           HG1      ARG  37 150.222  16.578   2.497
  984   1HD   ARG  37           HD2      ARG  37 150.037  14.766   0.663
  985   2HD   ARG  37           HD1      ARG  37 149.088  15.947  -0.234
  986    HE   ARG  37           HE       ARG  37 151.940  15.877  -0.027
  987   1HH1  ARG  37          HH21      ARG  37 149.326  18.129   0.166
  988   2HH1  ARG  37          HH22      ARG  37 150.343  19.511  -0.044
  989   1HH2  ARG  37          HH11      ARG  37 153.256  17.665  -0.327
  990   2HH2  ARG  37          HH12      ARG  37 152.558  19.251  -0.333
  991    H    GLY  38           HN       GLY  38 147.476  15.075   6.100
  992   1HA   GLY  38           HA2      GLY  38 145.363  14.524   7.145
  993   2HA   GLY  38           HA1      GLY  38 144.612  14.419   5.561
  994    H    PHE  39           HN       PHE  39 147.583  12.799   5.459
  995    HA   PHE  39           HA       PHE  39 146.174  10.176   5.831
  996   1HB   PHE  39           HB2      PHE  39 148.752  10.869   4.405
  997   2HB   PHE  39           HB1      PHE  39 148.082   9.246   4.533
  998    HD1  PHE  39           HD2      PHE  39 146.025   8.637   3.336
  999    HD2  PHE  39           HD1      PHE  39 147.746  12.545   2.977
 1000    HE1  PHE  39           HE2      PHE  39 144.588   9.084   1.363
 1001    HE2  PHE  39           HE1      PHE  39 146.318  13.000   1.004
 1002    HZ   PHE  39           HZ       PHE  39 144.733  11.267   0.194
 1003    H    ASP  40           HN       ASP  40 146.460  10.631   8.223
 1004    HA   ASP  40           HA       ASP  40 149.199  10.521   9.263
 1005   1HB   ASP  40           HB2      ASP  40 148.100  10.524  11.472
 1006   2HB   ASP  40           HB1      ASP  40 147.456  11.804  10.444
 1007    H    LYS  41           HN       LYS  41 146.904   8.204   8.223
 1008    HA   LYS  41           HA       LYS  41 148.420   6.041   9.652
 1009   1HB   LYS  41           HB2      LYS  41 145.452   6.089   9.016
 1010   2HB   LYS  41           HB1      LYS  41 146.315   4.769   9.797
 1011   1HG   LYS  41           HG2      LYS  41 146.369   7.550  10.970
 1012   2HG   LYS  41           HG1      LYS  41 145.022   6.463  11.296
 1013   1HD   LYS  41           HD2      LYS  41 146.586   4.777  12.190
 1014   2HD   LYS  41           HD1      LYS  41 147.944   5.849  11.861
 1015   1HE   LYS  41           HE2      LYS  41 147.183   5.960  14.235
 1016   2HE   LYS  41           HE1      LYS  41 147.076   7.512  13.406
 1017   1HZ   LYS  41           HZ2      LYS  41 144.756   5.708  13.393
 1018   2HZ   LYS  41           HZ1      LYS  41 145.078   6.634  14.782
 1019   3HZ   LYS  41           HZ3      LYS  41 144.805   7.403  13.295
 1020    H    ALA  42           HN       ALA  42 148.741   4.139   8.470
 1021    HA   ALA  42           HA       ALA  42 149.130   4.466   5.656
 1022   1HB   ALA  42           HB1      ALA  42 150.409   2.898   7.135
 1023   2HB   ALA  42           HB3      ALA  42 148.982   1.864   7.192
 1024   3HB   ALA  42           HB2      ALA  42 149.805   2.144   5.659
 1025    H    TYR  43           HN       TYR  43 146.543   2.809   7.481
 1026    HA   TYR  43           HA       TYR  43 145.348   1.549   5.252
 1027   1HB   TYR  43           HB2      TYR  43 143.365   1.263   6.581
 1028   2HB   TYR  43           HB1      TYR  43 144.766   1.072   7.629
 1029    HD1  TYR  43           HD1      TYR  43 142.164   3.493   6.529
 1030    HD2  TYR  43           HD2      TYR  43 145.064   2.468   9.520
 1031    HE1  TYR  43           HE1      TYR  43 141.266   5.276   8.003
 1032    HE2  TYR  43           HE2      TYR  43 144.176   4.254  10.998
 1033    HH   TYR  43           HH       TYR  43 142.356   5.631  11.324
 1034    H    VAL  44           HN       VAL  44 145.367   4.933   6.011
 1035    HA   VAL  44           HA       VAL  44 142.955   5.517   4.426
 1036    HB   VAL  44           HB       VAL  44 145.183   7.381   5.345
 1037   1HG1  VAL  44          HG11      VAL  44 143.749   8.164   3.383
 1038   2HG1  VAL  44          HG13      VAL  44 142.366   8.078   4.471
 1039   3HG1  VAL  44          HG12      VAL  44 143.689   9.191   4.811
 1040   1HG2  VAL  44          HG22      VAL  44 142.441   6.815   6.519
 1041   2HG2  VAL  44          HG21      VAL  44 143.984   6.341   7.225
 1042   3HG2  VAL  44          HG23      VAL  44 143.565   8.046   7.097
 1043    H    VAL  45           HN       VAL  45 146.375   5.270   4.019
 1044    HA   VAL  45           HA       VAL  45 146.433   6.334   1.279
 1045    HB   VAL  45           HB       VAL  45 148.503   4.721   2.810
 1046   1HG1  VAL  45          HG13      VAL  45 148.614   6.222   0.180
 1047   2HG1  VAL  45          HG12      VAL  45 150.048   5.684   1.056
 1048   3HG1  VAL  45          HG11      VAL  45 148.895   4.500   0.437
 1049   1HG2  VAL  45          HG22      VAL  45 148.006   7.680   2.441
 1050   2HG2  VAL  45          HG21      VAL  45 148.257   6.788   3.942
 1051   3HG2  VAL  45          HG23      VAL  45 149.608   7.063   2.843
 1052    H    LEU  46           HN       LEU  46 146.257   3.211   2.881
 1053    HA   LEU  46           HA       LEU  46 146.596   1.532   0.594
 1054   1HB   LEU  46           HB2      LEU  46 146.519   0.705   2.961
 1055   2HB   LEU  46           HB1      LEU  46 144.812   1.125   3.024
 1056    HG   LEU  46           HG       LEU  46 144.518  -0.438   1.000
 1057   1HD1  LEU  46          HD11      LEU  46 147.320  -1.163   1.859
 1058   2HD1  LEU  46          HD13      LEU  46 146.280  -2.285   0.987
 1059   3HD1  LEU  46          HD12      LEU  46 146.747  -0.760   0.242
 1060   1HD2  LEU  46          HD22      LEU  46 145.182  -1.313   3.799
 1061   2HD2  LEU  46          HD21      LEU  46 143.611  -1.213   3.013
 1062   3HD2  LEU  46          HD23      LEU  46 144.729  -2.505   2.580
 1063    H    GLY  47           HN       GLY  47 143.883   3.283   1.970
 1064   1HA   GLY  47           HA2      GLY  47 141.791   2.256   0.337
 1065   2HA   GLY  47           HA1      GLY  47 141.780   3.844   1.100
 1066    H    GLN  48           HN       GLN  48 144.041   4.992  -0.217
 1067    HA   GLN  48           HA       GLN  48 142.840   5.918  -2.633
 1068   1HB   GLN  48           HB2      GLN  48 144.665   7.086  -1.331
 1069   2HB   GLN  48           HB1      GLN  48 145.804   5.912  -1.988
 1070   1HG   GLN  48           HG2      GLN  48 145.880   7.883  -3.390
 1071   2HG   GLN  48           HG1      GLN  48 145.071   6.604  -4.297
 1072   1HE2  GLN  48          HE22      GLN  48 142.355   8.775  -4.858
 1073   2HE2  GLN  48          HE21      GLN  48 143.485   7.688  -5.510
 1074    H    PHE  49           HN       PHE  49 145.244   3.397  -2.017
 1075    HA   PHE  49           HA       PHE  49 145.858   2.732  -4.724
 1076   1HB   PHE  49           HB2      PHE  49 147.131   1.909  -2.764
 1077   2HB   PHE  49           HB1      PHE  49 145.742   0.959  -2.258
 1078    HD1  PHE  49           HD1      PHE  49 147.794   1.513  -5.359
 1079    HD2  PHE  49           HD2      PHE  49 145.767  -1.305  -2.825
 1080    HE1  PHE  49           HE1      PHE  49 148.592  -0.352  -6.787
 1081    HE2  PHE  49           HE2      PHE  49 146.561  -3.164  -4.252
 1082    HZ   PHE  49           HZ       PHE  49 147.976  -2.689  -6.235
 1083    H    LEU  50           HN       LEU  50 143.319   1.709  -2.515
 1084    HA   LEU  50           HA       LEU  50 142.110  -0.217  -4.315
 1085   1HB   LEU  50           HB2      LEU  50 140.910   1.342  -2.005
 1086   2HB   LEU  50           HB1      LEU  50 140.125  -0.013  -2.813
 1087    HG   LEU  50           HG       LEU  50 142.811  -0.156  -1.406
 1088   1HD1  LEU  50          HD11      LEU  50 140.705   0.201   0.030
 1089   2HD1  LEU  50          HD13      LEU  50 140.207  -1.404  -0.505
 1090   3HD1  LEU  50          HD12      LEU  50 141.698  -1.204   0.418
 1091   1HD2  LEU  50          HD23      LEU  50 141.140  -2.119  -2.969
 1092   2HD2  LEU  50          HD22      LEU  50 142.891  -1.908  -2.950
 1093   3HD2  LEU  50          HD21      LEU  50 142.091  -2.712  -1.607
 1094    H    VAL  51           HN       VAL  51 141.570   3.229  -3.689
 1095    HA   VAL  51           HA       VAL  51 139.278   3.522  -5.369
 1096    HB   VAL  51           HB       VAL  51 141.371   5.517  -4.476
 1097   1HG1  VAL  51          HG12      VAL  51 138.810   5.885  -6.046
 1098   2HG1  VAL  51          HG11      VAL  51 139.530   7.192  -5.106
 1099   3HG1  VAL  51          HG13      VAL  51 140.424   6.473  -6.446
 1100   1HG2  VAL  51          HG23      VAL  51 139.911   4.446  -2.741
 1101   2HG2  VAL  51          HG22      VAL  51 139.654   6.184  -2.882
 1102   3HG2  VAL  51          HG21      VAL  51 138.500   5.060  -3.602
 1103    H    LEU  52           HN       LEU  52 142.719   3.518  -6.103
 1104    HA   LEU  52           HA       LEU  52 142.249   4.515  -8.846
 1105   1HB   LEU  52           HB2      LEU  52 144.768   3.504  -7.502
 1106   2HB   LEU  52           HB1      LEU  52 144.695   4.261  -9.092
 1107    HG   LEU  52           HG       LEU  52 143.767   5.586  -6.526
 1108   1HD1  LEU  52          HD12      LEU  52 146.376   5.692  -8.039
 1109   2HD1  LEU  52          HD11      LEU  52 145.869   7.006  -6.977
 1110   3HD1  LEU  52          HD13      LEU  52 146.119   5.389  -6.321
 1111   1HD2  LEU  52          HD23      LEU  52 143.913   6.428  -9.421
 1112   2HD2  LEU  52          HD22      LEU  52 142.630   6.708  -8.243
 1113   3HD2  LEU  52          HD21      LEU  52 144.118   7.643  -8.159
 1114    H    LYS  53           HN       LYS  53 141.379   1.720  -7.656
 1115    HA   LYS  53           HA       LYS  53 141.257  -0.480  -8.474
 1116   1HB   LYS  53           HB2      LYS  53 141.608   1.045 -11.073
 1117   2HB   LYS  53           HB1      LYS  53 140.967  -0.592 -10.923
 1118   1HG   LYS  53           HG2      LYS  53 139.119   0.257  -9.524
 1119   2HG   LYS  53           HG1      LYS  53 139.756   1.894  -9.674
 1120   1HD   LYS  53           HD2      LYS  53 139.461   1.787 -12.124
 1121   2HD   LYS  53           HD1      LYS  53 138.816   0.152 -11.970
 1122   1HE   LYS  53           HE2      LYS  53 136.910   0.926 -10.734
 1123   2HE   LYS  53           HE1      LYS  53 137.608   2.535 -10.551
 1124   1HZ   LYS  53           HZ3      LYS  53 137.605   2.084 -13.246
 1125   2HZ   LYS  53           HZ2      LYS  53 136.117   1.449 -12.726
 1126   3HZ   LYS  53           HZ1      LYS  53 136.517   3.066 -12.392
 1127    H    LYS  54           HN       LYS  54 143.905   0.394  -7.696
 1128    HA   LYS  54           HA       LYS  54 146.119  -0.336  -7.799
 1129   1HB   LYS  54           HB2      LYS  54 145.010  -2.510  -9.602
 1130   2HB   LYS  54           HB1      LYS  54 146.524  -2.551  -8.705
 1131   1HG   LYS  54           HG2      LYS  54 145.283  -2.408  -6.581
 1132   2HG   LYS  54           HG1      LYS  54 143.762  -2.362  -7.470
 1133   1HD   LYS  54           HD2      LYS  54 144.344  -4.579  -8.480
 1134   2HD   LYS  54           HD1      LYS  54 145.768  -4.634  -7.439
 1135   1HE   LYS  54           HE2      LYS  54 143.992  -5.879  -6.355
 1136   2HE   LYS  54           HE1      LYS  54 144.248  -4.384  -5.454
 1137   1HZ   LYS  54           HZ1      LYS  54 142.341  -4.172  -7.608
 1138   2HZ   LYS  54           HZ3      LYS  54 141.867  -5.229  -6.370
 1139   3HZ   LYS  54           HZ2      LYS  54 142.241  -3.611  -6.008
 1140    H    ASP  55           HN       ASP  55 144.880   1.417 -10.073
 1141    HA   ASP  55           HA       ASP  55 146.380   0.746 -12.452
 1142   1HB   ASP  55           HB2      ASP  55 145.205   3.351 -11.445
 1143   2HB   ASP  55           HB1      ASP  55 145.989   3.197 -13.018
 1144    H    GLU  56           HN       GLU  56 148.580   0.613 -12.391
 1145    HA   GLU  56           HA       GLU  56 150.211   1.799 -10.380
 1146   1HB   GLU  56           HB2      GLU  56 150.790  -0.224 -11.724
 1147   2HB   GLU  56           HB1      GLU  56 151.081   0.829 -13.109
 1148   1HG   GLU  56           HG2      GLU  56 152.807   2.046 -11.830
 1149   2HG   GLU  56           HG1      GLU  56 152.517   0.996 -10.442
 1150    H    ASP  57           HN       ASP  57 149.545   2.911 -13.718
 1151    HA   ASP  57           HA       ASP  57 151.513   5.016 -13.645
 1152   1HB   ASP  57           HB2      ASP  57 148.997   4.647 -15.294
 1153   2HB   ASP  57           HB1      ASP  57 150.130   5.976 -15.544
 1154    H    LEU  58           HN       LEU  58 148.102   4.889 -12.840
 1155    HA   LEU  58           HA       LEU  58 147.899   7.740 -12.281
 1156   1HB   LEU  58           HB2      LEU  58 146.161   5.462 -11.287
 1157   2HB   LEU  58           HB1      LEU  58 145.766   7.171 -11.150
 1158    HG   LEU  58           HG       LEU  58 146.223   5.701 -13.765
 1159   1HD1  LEU  58          HD12      LEU  58 143.714   6.533 -12.290
 1160   2HD1  LEU  58          HD11      LEU  58 143.723   6.152 -14.012
 1161   3HD1  LEU  58          HD13      LEU  58 144.163   4.917 -12.834
 1162   1HD2  LEU  58          HD23      LEU  58 145.632   8.566 -13.032
 1163   2HD2  LEU  58          HD22      LEU  58 146.723   7.934 -14.265
 1164   3HD2  LEU  58          HD21      LEU  58 144.984   7.918 -14.540
 1165    H    PHE  59           HN       PHE  59 148.593   4.884 -10.314
 1166    HA   PHE  59           HA       PHE  59 148.607   6.259  -7.790
 1167   1HB   PHE  59           HB2      PHE  59 148.472   3.815  -7.922
 1168   2HB   PHE  59           HB1      PHE  59 150.074   3.751  -8.655
 1169    HD1  PHE  59           HD1      PHE  59 148.226   4.725  -5.567
 1170    HD2  PHE  59           HD2      PHE  59 152.045   3.837  -7.323
 1171    HE1  PHE  59           HE1      PHE  59 149.256   4.693  -3.311
 1172    HE2  PHE  59           HE2      PHE  59 153.075   3.809  -5.066
 1173    HZ   PHE  59           HZ       PHE  59 151.681   4.237  -3.061
 1174    H    ARG  60           HN       ARG  60 151.245   5.479 -10.087
 1175    HA   ARG  60           HA       ARG  60 153.343   6.557  -8.510
 1176   1HB   ARG  60           HB2      ARG  60 153.058   6.324 -11.511
 1177   2HB   ARG  60           HB1      ARG  60 154.541   6.859 -10.723
 1178   1HG   ARG  60           HG2      ARG  60 154.625   4.742  -9.452
 1179   2HG   ARG  60           HG1      ARG  60 153.159   4.199 -10.255
 1180   1HD   ARG  60           HD2      ARG  60 155.819   4.825 -11.563
 1181   2HD   ARG  60           HD1      ARG  60 155.069   3.237 -11.405
 1182    HE   ARG  60           HE       ARG  60 153.185   4.711 -12.797
 1183   1HH1  ARG  60          HH21      ARG  60 156.543   3.999 -13.100
 1184   2HH1  ARG  60          HH22      ARG  60 156.551   4.113 -14.828
 1185   1HH2  ARG  60          HH11      ARG  60 153.175   4.871 -15.058
 1186   2HH2  ARG  60          HH12      ARG  60 154.644   4.605 -15.936
 1187    H    GLU  61           HN       GLU  61 151.365   8.216 -11.027
 1188    HA   GLU  61           HA       GLU  61 152.750  10.710 -10.761
 1189   1HB   GLU  61           HB2      GLU  61 151.257  10.188 -12.668
 1190   2HB   GLU  61           HB1      GLU  61 149.871  10.197 -11.580
 1191   1HG   GLU  61           HG2      GLU  61 150.067  12.350 -12.768
 1192   2HG   GLU  61           HG1      GLU  61 150.308  12.570 -11.037
 1193    H    TRP  62           HN       TRP  62 150.016   9.288  -9.021
 1194    HA   TRP  62           HA       TRP  62 149.225  11.628  -7.601
 1195   1HB   TRP  62           HB2      TRP  62 147.766   9.724  -7.593
 1196   2HB   TRP  62           HB1      TRP  62 149.021   8.690  -6.911
 1197    HD1  TRP  62           HD1      TRP  62 146.694  11.598  -5.953
 1198    HE1  TRP  62           HE1      TRP  62 146.497  11.672  -3.382
 1199    HE3  TRP  62           HE3      TRP  62 150.134   8.035  -4.703
 1200    HZ2  TRP  62           HZ2      TRP  62 147.664  10.391  -1.089
 1201    HZ3  TRP  62           HZ3      TRP  62 150.568   7.481  -2.329
 1202    HH2  TRP  62           HH2      TRP  62 149.339   8.653  -0.523
 1203    H    LEU  63           HN       LEU  63 151.481   9.029  -6.614
 1204    HA   LEU  63           HA       LEU  63 152.075  10.252  -4.085
 1205   1HB   LEU  63           HB2      LEU  63 152.452   7.859  -4.520
 1206   2HB   LEU  63           HB1      LEU  63 153.680   8.263  -5.716
 1207    HG   LEU  63           HG       LEU  63 155.028   9.356  -3.952
 1208   1HD1  LEU  63          HD11      LEU  63 152.638   8.615  -2.275
 1209   2HD1  LEU  63          HD13      LEU  63 154.234   8.704  -1.529
 1210   3HD1  LEU  63          HD12      LEU  63 153.549  10.125  -2.307
 1211   1HD2  LEU  63          HD23      LEU  63 154.143   6.508  -3.424
 1212   2HD2  LEU  63          HD22      LEU  63 155.500   7.034  -4.419
 1213   3HD2  LEU  63          HD21      LEU  63 155.556   7.246  -2.670
 1214    H    LYS  64           HN       LYS  64 153.876  10.191  -7.154
 1215    HA   LYS  64           HA       LYS  64 156.031  11.844  -6.240
 1216   1HB   LYS  64           HB2      LYS  64 156.177  10.499  -8.310
 1217   2HB   LYS  64           HB1      LYS  64 154.970  11.541  -9.064
 1218   1HG   LYS  64           HG2      LYS  64 156.456  13.484  -8.817
 1219   2HG   LYS  64           HG1      LYS  64 157.652  12.481  -8.001
 1220   1HD   LYS  64           HD2      LYS  64 157.870  11.092 -10.023
 1221   2HD   LYS  64           HD1      LYS  64 156.672  12.096 -10.840
 1222   1HE   LYS  64           HE2      LYS  64 158.906  12.836 -11.487
 1223   2HE   LYS  64           HE1      LYS  64 158.150  14.078 -10.489
 1224   1HZ   LYS  64           HZ3      LYS  64 159.519  12.184  -8.882
 1225   2HZ   LYS  64           HZ2      LYS  64 160.570  12.839 -10.045
 1226   3HZ   LYS  64           HZ1      LYS  64 159.735  13.863  -8.977
 1227    H    ASP  65           HN       ASP  65 153.058  12.659  -8.003
 1228    HA   ASP  65           HA       ASP  65 153.577  15.486  -8.086
 1229   1HB   ASP  65           HB2      ASP  65 151.929  14.221  -9.539
 1230   2HB   ASP  65           HB1      ASP  65 150.866  14.135  -8.136
 1231    H    THR  66           HN       THR  66 152.193  13.353  -5.683
 1232    HA   THR  66           HA       THR  66 150.969  15.490  -4.148
 1233    HB   THR  66           HB       THR  66 151.536  12.582  -3.537
 1234    HG1  THR  66           HG1      THR  66 149.882  13.304  -5.088
 1235   1HG2  THR  66          HG23      THR  66 150.245  14.739  -1.864
 1236   2HG2  THR  66          HG22      THR  66 149.886  13.029  -1.624
 1237   3HG2  THR  66          HG21      THR  66 151.531  13.626  -1.403
 1238    H    CYS  67           HN       CYS  67 154.096  13.724  -3.905
 1239    HA   CYS  67           HA       CYS  67 154.859  15.708  -1.771
 1240   1HB   CYS  67           HB2      CYS  67 156.145  13.919  -0.687
 1241   2HB   CYS  67           HB1      CYS  67 154.432  13.512  -0.774
 1242    HG   CYS  67           HG       CYS  67 155.180  11.456  -1.931
 1243    H    GLY  68           HN       GLY  68 155.872  13.948  -4.636
 1244   1HA   GLY  68           HA2      GLY  68 157.602  14.896  -6.073
 1245   2HA   GLY  68           HA1      GLY  68 158.391  15.566  -4.645
 1246    H    ALA  69           HN       ALA  69 157.190  12.391  -4.202
 1247    HA   ALA  69           HA       ALA  69 159.686  11.251  -3.564
 1248   1HB   ALA  69           HB2      ALA  69 157.525  10.215  -2.961
 1249   2HB   ALA  69           HB1      ALA  69 157.229   9.844  -4.659
 1250   3HB   ALA  69           HB3      ALA  69 158.562   9.065  -3.806
 1251    H    ASN  70           HN       ASN  70 161.030   9.721  -4.792
 1252    HA   ASN  70           HA       ASN  70 161.212  10.497  -7.636
 1253   1HB   ASN  70           HB2      ASN  70 163.234  10.306  -6.127
 1254   2HB   ASN  70           HB1      ASN  70 162.960   8.564  -6.093
 1255   1HD2  ASN  70          HD22      ASN  70 164.173  10.274  -9.634
 1256   2HD2  ASN  70          HD21      ASN  70 163.348  11.229  -8.500
 1257    H    ALA  71           HN       ALA  71 161.673   8.647  -9.212
 1258    HA   ALA  71           HA       ALA  71 159.409   6.933  -9.357
 1259   1HB   ALA  71           HB1      ALA  71 160.946   7.695 -11.256
 1260   2HB   ALA  71           HB3      ALA  71 162.039   6.408 -10.747
 1261   3HB   ALA  71           HB2      ALA  71 160.414   6.013 -11.307
 1262    H    LYS  72           HN       LYS  72 162.574   6.433  -7.876
 1263    HA   LYS  72           HA       LYS  72 162.373   3.556  -7.770
 1264   1HB   LYS  72           HB2      LYS  72 163.968   5.553  -6.141
 1265   2HB   LYS  72           HB1      LYS  72 164.132   3.806  -5.961
 1266   1HG   LYS  72           HG2      LYS  72 164.732   3.610  -8.345
 1267   2HG   LYS  72           HG1      LYS  72 164.573   5.358  -8.530
 1268   1HD   LYS  72           HD2      LYS  72 166.355   5.699  -6.853
 1269   2HD   LYS  72           HD1      LYS  72 166.518   3.952  -6.674
 1270   1HE   LYS  72           HE2      LYS  72 167.221   3.719  -8.983
 1271   2HE   LYS  72           HE1      LYS  72 166.892   5.423  -9.297
 1272   1HZ   LYS  72           HZ1      LYS  72 168.548   5.842  -7.416
 1273   2HZ   LYS  72           HZ3      LYS  72 169.034   4.234  -7.651
 1274   3HZ   LYS  72           HZ2      LYS  72 169.165   5.354  -8.922
 1275    H    GLN  73           HN       GLN  73 161.519   6.127  -5.455
 1276    HA   GLN  73           HA       GLN  73 160.759   4.329  -3.357
 1277   1HB   GLN  73           HB2      GLN  73 160.129   7.224  -3.935
 1278   2HB   GLN  73           HB1      GLN  73 159.424   6.395  -2.549
 1279   1HG   GLN  73           HG2      GLN  73 161.417   7.464  -1.756
 1280   2HG   GLN  73           HG1      GLN  73 161.798   5.749  -1.877
 1281   1HE2  GLN  73          HE22      GLN  73 164.256   6.213  -4.377
 1282   2HE2  GLN  73          HE21      GLN  73 163.392   5.101  -3.428
 1283    H    SER  74           HN       SER  74 158.918   5.751  -6.049
 1284    HA   SER  74           HA       SER  74 156.362   4.929  -5.083
 1285   1HB   SER  74           HB2      SER  74 156.854   6.597  -6.945
 1286   2HB   SER  74           HB1      SER  74 157.147   5.206  -7.987
 1287    HG   SER  74           HG       SER  74 155.025   4.488  -7.427
 1288    H    ARG  75           HN       ARG  75 158.783   3.276  -7.139
 1289    HA   ARG  75           HA       ARG  75 157.133   1.080  -7.880
 1290   1HB   ARG  75           HB2      ARG  75 160.127   1.270  -7.456
 1291   2HB   ARG  75           HB1      ARG  75 159.331  -0.161  -8.111
 1292   1HG   ARG  75           HG2      ARG  75 158.391   1.194  -9.944
 1293   2HG   ARG  75           HG1      ARG  75 159.186   2.627  -9.295
 1294   1HD   ARG  75           HD2      ARG  75 161.386   1.460  -9.549
 1295   2HD   ARG  75           HD1      ARG  75 160.543   0.124 -10.332
 1296    HE   ARG  75           HE       ARG  75 159.756   2.331 -11.801
 1297   1HH1  ARG  75          HH21      ARG  75 162.743   0.961 -10.758
 1298   2HH1  ARG  75          HH22      ARG  75 163.634   1.519 -12.135
 1299   1HH2  ARG  75          HH11      ARG  75 160.902   3.068 -13.606
 1300   2HH2  ARG  75          HH12      ARG  75 162.591   2.712 -13.747
 1301    H    ASP  76           HN       ASP  76 159.117   1.621  -4.966
 1302    HA   ASP  76           HA       ASP  76 158.719  -1.009  -3.900
 1303   1HB   ASP  76           HB2      ASP  76 159.434   1.628  -2.598
 1304   2HB   ASP  76           HB1      ASP  76 159.389   0.097  -1.722
 1305    H    CYS  77           HN       CYS  77 156.868   2.030  -3.517
 1306    HA   CYS  77           HA       CYS  77 155.139   0.981  -1.467
 1307   1HB   CYS  77           HB2      CYS  77 154.820   3.239  -3.464
 1308   2HB   CYS  77           HB1      CYS  77 153.631   2.882  -2.210
 1309    HG   CYS  77           HG       CYS  77 156.182   4.396  -1.757
 1310    H    PHE  78           HN       PHE  78 154.948   1.084  -5.033
 1311    HA   PHE  78           HA       PHE  78 152.280   0.132  -5.260
 1312   1HB   PHE  78           HB2      PHE  78 153.535   1.016  -7.172
 1313   2HB   PHE  78           HB1      PHE  78 154.655  -0.344  -7.085
 1314    HD1  PHE  78           HD1      PHE  78 151.239   0.714  -7.972
 1315    HD2  PHE  78           HD2      PHE  78 153.981  -2.587  -7.766
 1316    HE1  PHE  78           HE1      PHE  78 149.723  -0.636  -9.399
 1317    HE2  PHE  78           HE2      PHE  78 152.465  -3.936  -9.191
 1318    HZ   PHE  78           HZ       PHE  78 150.337  -2.960 -10.008
 1319    H    GLY  79           HN       GLY  79 155.277  -1.799  -5.611
 1320   1HA   GLY  79           HA2      GLY  79 153.972  -4.318  -5.555
 1321   2HA   GLY  79           HA1      GLY  79 155.676  -4.060  -5.188
 1322    H    CYS  80           HN       CYS  80 155.110  -2.255  -2.922
 1323    HA   CYS  80           HA       CYS  80 154.885  -4.292  -0.876
 1324   1HB   CYS  80           HB2      CYS  80 156.181  -2.176  -0.592
 1325   2HB   CYS  80           HB1      CYS  80 154.658  -1.288  -0.554
 1326    HG   CYS  80           HG       CYS  80 154.020  -2.600   1.637
 1327    H    LEU  81           HN       LEU  81 152.675  -1.641  -1.896
 1328    HA   LEU  81           HA       LEU  81 150.581  -2.503  -0.098
 1329   1HB   LEU  81           HB2      LEU  81 150.484  -0.814  -2.617
 1330   2HB   LEU  81           HB1      LEU  81 149.144  -1.008  -1.490
 1331    HG   LEU  81           HG       LEU  81 151.871   0.094  -0.744
 1332   1HD1  LEU  81          HD11      LEU  81 149.251   1.455  -1.419
 1333   2HD1  LEU  81          HD13      LEU  81 150.567   2.266  -0.570
 1334   3HD1  LEU  81          HD12      LEU  81 150.811   1.672  -2.212
 1335   1HD2  LEU  81          HD22      LEU  81 149.314  -0.436   0.765
 1336   2HD2  LEU  81          HD21      LEU  81 150.984  -0.684   1.274
 1337   3HD2  LEU  81          HD23      LEU  81 150.307   0.942   1.235
 1338    H    ARG  82           HN       ARG  82 151.336  -3.118  -3.522
 1339    HA   ARG  82           HA       ARG  82 148.941  -4.541  -4.137
 1340   1HB   ARG  82           HB2      ARG  82 150.490  -3.751  -5.881
 1341   2HB   ARG  82           HB1      ARG  82 151.707  -4.899  -5.321
 1342   1HG   ARG  82           HG2      ARG  82 150.211  -6.778  -5.854
 1343   2HG   ARG  82           HG1      ARG  82 148.954  -5.649  -6.358
 1344   1HD   ARG  82           HD2      ARG  82 150.435  -4.800  -8.138
 1345   2HD   ARG  82           HD1      ARG  82 151.692  -5.930  -7.629
 1346    HE   ARG  82           HE       ARG  82 149.506  -7.559  -8.100
 1347   1HH1  ARG  82          HH21      ARG  82 151.205  -5.112  -9.832
 1348   2HH1  ARG  82          HH22      ARG  82 150.895  -5.811 -11.386
 1349   1HH2  ARG  82          HH11      ARG  82 149.092  -8.487 -10.116
 1350   2HH2  ARG  82          HH12      ARG  82 149.698  -7.723 -11.547
 1351    H    GLU  83           HN       GLU  83 152.055  -5.667  -2.823
 1352    HA   GLU  83           HA       GLU  83 151.344  -8.445  -2.908
 1353   1HB   GLU  83           HB2      GLU  83 153.412  -6.878  -1.358
 1354   2HB   GLU  83           HB1      GLU  83 153.238  -8.628  -1.188
 1355   1HG   GLU  83           HG2      GLU  83 153.602  -7.260  -3.863
 1356   2HG   GLU  83           HG1      GLU  83 154.953  -7.870  -2.905
 1357    H    TRP  84           HN       TRP  84 150.909  -5.917  -0.431
 1358    HA   TRP  84           HA       TRP  84 150.057  -7.641   1.679
 1359   1HB   TRP  84           HB2      TRP  84 150.503  -5.111   1.826
 1360   2HB   TRP  84           HB1      TRP  84 148.905  -4.892   1.116
 1361    HD1  TRP  84           HD1      TRP  84 150.646  -6.072   4.293
 1362    HE1  TRP  84           HE1      TRP  84 148.880  -6.304   6.173
 1363    HE3  TRP  84           HE3      TRP  84 146.356  -5.343   1.607
 1364    HZ2  TRP  84           HZ2      TRP  84 146.063  -6.207   6.493
 1365    HZ3  TRP  84           HZ3      TRP  84 144.147  -5.421   2.730
 1366    HH2  TRP  84           HH2      TRP  84 143.995  -5.852   5.168
 1367    H    CYS  85           HN       CYS  85 148.302  -6.089  -0.988
 1368    HA   CYS  85           HA       CYS  85 145.692  -7.042  -0.302
 1369   1HB   CYS  85           HB2      CYS  85 146.994  -6.232  -2.908
 1370   2HB   CYS  85           HB1      CYS  85 145.323  -6.788  -2.856
 1371    HG   CYS  85           HG       CYS  85 146.312  -4.279  -1.263
 1372    H    ASP  86           HN       ASP  86 148.312  -8.423  -2.238
 1373    HA   ASP  86           HA       ASP  86 146.948 -10.733  -3.182
 1374   1HB   ASP  86           HB2      ASP  86 149.873 -10.241  -2.577
 1375   2HB   ASP  86           HB1      ASP  86 149.278 -11.714  -3.344
 1376    H    ALA  87           HN       ALA  87 148.707 -10.141  -0.146
 1377    HA   ALA  87           HA       ALA  87 148.281 -12.916   0.734
 1378   1HB   ALA  87           HB1      ALA  87 150.329 -11.445   1.271
 1379   2HB   ALA  87           HB3      ALA  87 149.289 -10.644   2.450
 1380   3HB   ALA  87           HB2      ALA  87 149.628 -12.368   2.601
 1381    H    PHE  88           HN       PHE  88 147.021  -9.692   1.538
 1382    HA   PHE  88           HA       PHE  88 145.099 -10.963   3.447
 1383   1HB   PHE  88           HB2      PHE  88 145.922  -8.083   3.015
 1384   2HB   PHE  88           HB1      PHE  88 144.696  -8.602   4.171
 1385    HD1  PHE  88           HD2      PHE  88 145.320 -10.135   6.050
 1386    HD2  PHE  88           HD1      PHE  88 148.271  -8.362   3.476
 1387    HE1  PHE  88           HE2      PHE  88 147.088 -10.673   7.703
 1388    HE2  PHE  88           HE1      PHE  88 150.043  -8.906   5.135
 1389    HZ   PHE  88           HZ       PHE  88 149.445 -10.057   7.247
 1390    H    LEU  89           HN       LEU  89 144.544  -7.941   1.679
 1391    HA   LEU  89           HA       LEU  89 141.906  -8.961   0.866
 1392   1HB   LEU  89           HB2      LEU  89 141.969  -6.695   1.691
 1393   2HB   LEU  89           HB1      LEU  89 143.270  -6.265   0.586
 1394    HG   LEU  89           HG       LEU  89 141.792  -6.496  -1.334
 1395   1HD1  LEU  89          HD12      LEU  89 139.871  -7.588   0.725
 1396   2HD1  LEU  89          HD11      LEU  89 139.302  -6.944  -0.815
 1397   3HD1  LEU  89          HD13      LEU  89 140.392  -8.329  -0.788
 1398   1HD2  LEU  89          HD21      LEU  89 141.729  -4.395   0.144
 1399   2HD2  LEU  89          HD23      LEU  89 140.360  -4.634  -0.944
 1400   3HD2  LEU  89          HD22      LEU  89 140.202  -5.018   0.771
   
  No H/Q in entry =        1400
  Start of MODEL   17
    1   1H    MET   1           HT1      MET   1 113.858  -8.760   9.135
    2   2H    MET   1           HT3      MET   1 113.252 -10.283   9.570
    3   3H    MET   1           HT2      MET   1 112.285  -8.899   9.762
    4    HA   MET   1           HA       MET   1 113.628  -8.069  11.506
    5   1HB   MET   1           HB2      MET   1 113.225 -11.060  11.829
    6   2HB   MET   1           HB1      MET   1 113.449  -9.909  13.146
    7   1HG   MET   1           HG2      MET   1 111.210  -9.725  11.114
    8   2HG   MET   1           HG1      MET   1 111.035 -10.491  12.691
    9   1HE   MET   1           HE2      MET   1 111.463  -9.580  14.775
   10   2HE   MET   1           HE1      MET   1 112.719  -8.346  14.782
   11   3HE   MET   1           HE3      MET   1 111.069  -7.937  15.268
   12    H    THR   2           HN       THR   2 114.988 -11.307  10.752
   13    HA   THR   2           HA       THR   2 117.595 -10.535  11.791
   14    HB   THR   2           HB       THR   2 118.320 -12.747  11.048
   15    HG1  THR   2           HG1      THR   2 116.861 -14.018   9.836
   16   1HG2  THR   2          HG23      THR   2 115.544 -12.649  12.243
   17   2HG2  THR   2          HG22      THR   2 116.484 -14.137  12.120
   18   3HG2  THR   2          HG21      THR   2 117.081 -12.796  13.096
   19    H    THR   3           HN       THR   3 119.579 -10.534  10.439
   20    HA   THR   3           HA       THR   3 119.222  -8.913   8.061
   21    HB   THR   3           HB       THR   3 121.689  -9.084   7.866
   22    HG1  THR   3           HG1      THR   3 122.752 -10.314   9.498
   23   1HG2  THR   3          HG23      THR   3 120.625  -8.605  10.664
   24   2HG2  THR   3          HG22      THR   3 122.228  -8.120  10.112
   25   3HG2  THR   3          HG21      THR   3 120.790  -7.407   9.380
   26    H    SER   4           HN       SER   4 120.040  -9.541   5.905
   27    HA   SER   4           HA       SER   4 119.046 -12.136   5.104
   28   1HB   SER   4           HB2      SER   4 120.685 -10.087   3.585
   29   2HB   SER   4           HB1      SER   4 119.924 -11.500   2.861
   30    HG   SER   4           HG       SER   4 118.415  -9.722   4.435
   31    H    GLN   5           HN       GLN   5 120.338 -13.780   4.014
   32    HA   GLN   5           HA       GLN   5 122.562 -14.669   5.533
   33   1HB   GLN   5           HB2      GLN   5 121.576 -15.439   2.778
   34   2HB   GLN   5           HB1      GLN   5 122.904 -16.270   3.587
   35   1HG   GLN   5           HG2      GLN   5 120.172 -15.907   4.842
   36   2HG   GLN   5           HG1      GLN   5 120.627 -17.338   3.916
   37   1HE2  GLN   5          HE22      GLN   5 123.200 -18.237   6.402
   38   2HE2  GLN   5          HE21      GLN   5 123.097 -18.040   4.719
   39    H    LYS   6           HN       LYS   6 122.450 -12.517   2.749
   40    HA   LYS   6           HA       LYS   6 125.101 -12.853   1.813
   41   1HB   LYS   6           HB2      LYS   6 123.289 -10.430   1.885
   42   2HB   LYS   6           HB1      LYS   6 124.842 -10.455   1.050
   43   1HG   LYS   6           HG2      LYS   6 124.075 -12.354  -0.329
   44   2HG   LYS   6           HG1      LYS   6 122.519 -12.326   0.502
   45   1HD   LYS   6           HD2      LYS   6 122.127 -10.025  -0.283
   46   2HD   LYS   6           HD1      LYS   6 123.684 -10.037  -1.113
   47   1HE   LYS   6           HE2      LYS   6 121.546 -12.098  -1.681
   48   2HE   LYS   6           HE1      LYS   6 121.631 -10.566  -2.551
   49   1HZ   LYS   6           HZ1      LYS   6 124.165 -11.890  -2.373
   50   2HZ   LYS   6           HZ3      LYS   6 123.002 -12.825  -3.180
   51   3HZ   LYS   6           HZ2      LYS   6 123.366 -11.260  -3.733
   52    H    HIS   7           HN       HIS   7 123.796 -10.870   4.456
   53    HA   HIS   7           HA       HIS   7 126.146  -9.386   5.001
   54   1HB   HIS   7           HB2      HIS   7 124.078  -8.744   6.043
   55   2HB   HIS   7           HB1      HIS   7 123.906 -10.321   6.809
   56    HD2  HIS   7           HD2      HIS   7 125.270 -10.606   9.234
   57    HE1  HIS   7           HE1      HIS   7 127.196  -6.849   9.206
   58    HE2  HIS   7           HE2      HIS   7 126.728  -8.921  10.589
   59    H    ARG   8           HN       ARG   8 125.088 -12.463   6.545
   60    HA   ARG   8           HA       ARG   8 127.508 -12.735   8.066
   61   1HB   ARG   8           HB2      ARG   8 125.365 -14.717   7.272
   62   2HB   ARG   8           HB1      ARG   8 126.717 -15.125   8.331
   63   1HG   ARG   8           HG2      ARG   8 126.033 -13.264   9.851
   64   2HG   ARG   8           HG1      ARG   8 124.623 -12.990   8.826
   65   1HD   ARG   8           HD2      ARG   8 123.972 -14.411  10.694
   66   2HD   ARG   8           HD1      ARG   8 123.941 -15.367   9.211
   67    HE   ARG   8           HE       ARG   8 126.496 -15.770  10.208
   68   1HH1  ARG   8          HH21      ARG   8 123.271 -16.046  11.392
   69   2HH1  ARG   8          HH22      ARG   8 123.643 -17.333  12.491
   70   1HH2  ARG   8          HH11      ARG   8 127.001 -17.450  11.630
   71   2HH2  ARG   8          HH12      ARG   8 125.755 -18.128  12.624
   72    H    ASP   9           HN       ASP   9 126.473 -13.806   4.893
   73    HA   ASP   9           HA       ASP   9 128.688 -15.620   4.471
   74   1HB   ASP   9           HB2      ASP   9 126.767 -14.269   2.570
   75   2HB   ASP   9           HB1      ASP   9 128.000 -15.412   2.045
   76    H    PHE  10           HN       PHE  10 128.100 -12.191   3.733
   77    HA   PHE  10           HA       PHE  10 130.469 -11.855   2.134
   78   1HB   PHE  10           HB2      PHE  10 128.497 -10.309   2.160
   79   2HB   PHE  10           HB1      PHE  10 128.988  -9.775   3.766
   80    HD1  PHE  10           HD1      PHE  10 129.821  -9.750   0.180
   81    HD2  PHE  10           HD2      PHE  10 130.994  -8.420   4.092
   82    HE1  PHE  10           HE1      PHE  10 131.397  -8.130  -0.845
   83    HE2  PHE  10           HE2      PHE  10 132.572  -6.804   3.069
   84    HZ   PHE  10           HZ       PHE  10 132.774  -6.658   0.602
   85    H    VAL  11           HN       VAL  11 129.816 -11.386   5.612
   86    HA   VAL  11           HA       VAL  11 132.594 -10.531   6.097
   87    HB   VAL  11           HB       VAL  11 131.912 -10.365   8.430
   88   1HG1  VAL  11          HG13      VAL  11 129.802  -9.403   6.476
   89   2HG1  VAL  11          HG12      VAL  11 129.899  -8.872   8.155
   90   3HG1  VAL  11          HG11      VAL  11 131.215  -8.509   7.038
   91   1HG2  VAL  11          HG23      VAL  11 129.571 -11.990   7.444
   92   2HG2  VAL  11          HG22      VAL  11 130.614 -12.295   8.832
   93   3HG2  VAL  11          HG21      VAL  11 129.422 -10.997   8.894
   94    H    ALA  12           HN       ALA  12 131.582 -13.372   5.166
   95    HA   ALA  12           HA       ALA  12 133.047 -14.973   7.241
   96   1HB   ALA  12           HB1      ALA  12 130.901 -15.754   5.259
   97   2HB   ALA  12           HB3      ALA  12 131.808 -16.916   6.226
   98   3HB   ALA  12           HB2      ALA  12 130.771 -15.728   7.017
   99    H    GLU  13           HN       GLU  13 133.328 -13.746   4.074
  100    HA   GLU  13           HA       GLU  13 135.691 -15.430   3.634
  101   1HB   GLU  13           HB2      GLU  13 134.852 -15.979   1.259
  102   2HB   GLU  13           HB1      GLU  13 134.142 -16.898   2.587
  103   1HG   GLU  13           HG2      GLU  13 132.176 -15.516   2.590
  104   2HG   GLU  13           HG1      GLU  13 132.903 -14.378   1.456
  105    HA   PRO  14           HA       PRO  14 137.399 -11.741   1.826
  106   1HB   PRO  14           HB2      PRO  14 137.914 -13.403  -0.628
  107   2HB   PRO  14           HB1      PRO  14 139.013 -12.312   0.242
  108   1HG   PRO  14           HG2      PRO  14 139.169 -14.967   0.521
  109   2HG   PRO  14           HG1      PRO  14 139.483 -13.866   1.874
  110   1HD   PRO  14           HD2      PRO  14 137.147 -15.654   1.424
  111   2HD   PRO  14           HD1      PRO  14 137.795 -15.000   2.944
  112    H    MET  15           HN       MET  15 136.923 -10.163   0.074
  113    HA   MET  15           HA       MET  15 134.159 -10.482  -0.922
  114   1HB   MET  15           HB2      MET  15 134.547  -8.085  -1.702
  115   2HB   MET  15           HB1      MET  15 134.627  -8.346   0.040
  116   1HG   MET  15           HG2      MET  15 136.985  -8.220   0.073
  117   2HG   MET  15           HG1      MET  15 137.112  -8.469  -1.669
  118   1HE   MET  15           HE2      MET  15 135.345  -6.315   0.962
  119   2HE   MET  15           HE1      MET  15 137.043  -5.899   1.166
  120   3HE   MET  15           HE3      MET  15 135.892  -4.679   0.600
  121    H    GLY  16           HN       GLY  16 137.400 -10.719  -2.105
  122   1HA   GLY  16           HA2      GLY  16 138.265 -11.064  -4.260
  123   2HA   GLY  16           HA1      GLY  16 136.769 -11.954  -4.525
  124    H    GLU  17           HN       GLU  17 136.277 -11.282  -6.589
  125    HA   GLU  17           HA       GLU  17 136.231  -8.361  -7.182
  126   1HB   GLU  17           HB2      GLU  17 136.098 -10.817  -8.947
  127   2HB   GLU  17           HB1      GLU  17 135.942  -9.168  -9.550
  128   1HG   GLU  17           HG2      GLU  17 138.164  -8.616  -8.625
  129   2HG   GLU  17           HG1      GLU  17 138.323 -10.267  -8.027
  130    H    LYS  18           HN       LYS  18 134.103  -9.803  -5.574
  131    HA   LYS  18           HA       LYS  18 131.764 -10.181  -7.145
  132   1HB   LYS  18           HB2      LYS  18 132.113  -9.250  -4.280
  133   2HB   LYS  18           HB1      LYS  18 130.545  -9.635  -4.983
  134   1HG   LYS  18           HG2      LYS  18 131.191 -11.920  -5.372
  135   2HG   LYS  18           HG1      LYS  18 132.870 -11.572  -4.954
  136   1HD   LYS  18           HD2      LYS  18 132.223 -11.063  -2.649
  137   2HD   LYS  18           HD1      LYS  18 130.524 -11.319  -3.048
  138   1HE   LYS  18           HE2      LYS  18 131.449 -13.323  -1.975
  139   2HE   LYS  18           HE1      LYS  18 131.037 -13.668  -3.656
  140   1HZ   LYS  18           HZ3      LYS  18 133.606 -12.736  -3.745
  141   2HZ   LYS  18           HZ2      LYS  18 133.580 -13.731  -2.368
  142   3HZ   LYS  18           HZ1      LYS  18 133.120 -14.355  -3.880
  143    HA   PRO  19           HA       PRO  19 130.847  -6.003  -8.362
  144   1HB   PRO  19           HB2      PRO  19 128.123  -6.088  -8.631
  145   2HB   PRO  19           HB1      PRO  19 129.228  -6.895  -9.763
  146   1HG   PRO  19           HG2      PRO  19 127.718  -8.054  -7.455
  147   2HG   PRO  19           HG1      PRO  19 127.927  -8.696  -9.095
  148   1HD   PRO  19           HD2      PRO  19 129.411  -9.599  -7.007
  149   2HD   PRO  19           HD1      PRO  19 130.072  -9.501  -8.654
  150    H    VAL  20           HN       VAL  20 129.808  -4.013  -7.653
  151    HA   VAL  20           HA       VAL  20 129.912  -3.550  -4.883
  152    HB   VAL  20           HB       VAL  20 130.079  -1.698  -6.412
  153   1HG1  VAL  20          HG11      VAL  20 128.525  -2.763  -8.135
  154   2HG1  VAL  20          HG13      VAL  20 127.183  -2.129  -7.184
  155   3HG1  VAL  20          HG12      VAL  20 128.344  -1.025  -7.917
  156   1HG2  VAL  20          HG21      VAL  20 128.884  -1.400  -4.139
  157   2HG2  VAL  20          HG23      VAL  20 128.676  -0.117  -5.333
  158   3HG2  VAL  20          HG22      VAL  20 127.394  -1.302  -5.078
  159    H    GLY  21           HN       GLY  21 127.021  -4.063  -6.909
  160   1HA   GLY  21           HA2      GLY  21 125.041  -3.721  -4.969
  161   2HA   GLY  21           HA1      GLY  21 124.887  -4.827  -6.332
  162    H    SER  22           HN       SER  22 127.541  -5.964  -4.762
  163    HA   SER  22           HA       SER  22 125.971  -8.098  -3.501
  164   1HB   SER  22           HB2      SER  22 128.119  -8.492  -4.786
  165   2HB   SER  22           HB1      SER  22 128.976  -7.711  -3.459
  166    HG   SER  22           HG       SER  22 128.959  -9.686  -2.694
  167    H    LEU  23           HN       LEU  23 127.564  -5.169  -2.514
  168    HA   LEU  23           HA       LEU  23 128.085  -5.859   0.217
  169   1HB   LEU  23           HB2      LEU  23 127.389  -3.167  -0.996
  170   2HB   LEU  23           HB1      LEU  23 128.031  -3.403   0.628
  171    HG   LEU  23           HG       LEU  23 129.433  -4.266  -1.921
  172   1HD1  LEU  23          HD13      LEU  23 129.767  -1.840  -0.139
  173   2HD1  LEU  23          HD12      LEU  23 130.996  -2.364  -1.290
  174   3HD1  LEU  23          HD11      LEU  23 129.406  -1.866  -1.866
  175   1HD2  LEU  23          HD23      LEU  23 130.094  -4.435   1.020
  176   2HD2  LEU  23          HD22      LEU  23 130.319  -5.649  -0.239
  177   3HD2  LEU  23          HD21      LEU  23 131.400  -4.264  -0.153
  178    H    ALA  24           HN       ALA  24 126.782  -5.942   1.971
  179    HA   ALA  24           HA       ALA  24 123.956  -6.223   1.629
  180   1HB   ALA  24           HB3      ALA  24 125.452  -7.138   3.517
  181   2HB   ALA  24           HB2      ALA  24 125.280  -5.546   4.258
  182   3HB   ALA  24           HB1      ALA  24 123.855  -6.546   3.974
  183    H    GLY  25           HN       GLY  25 122.297  -4.794   1.883
  184   1HA   GLY  25           HA2      GLY  25 121.259  -2.745   2.659
  185   2HA   GLY  25           HA1      GLY  25 122.861  -2.034   2.863
  186    H    ILE  26           HN       ILE  26 123.434  -3.351   0.077
  187    HA   ILE  26           HA       ILE  26 122.413  -1.021  -1.499
  188    HB   ILE  26           HB       ILE  26 124.543  -3.048  -2.244
  189   1HG1  ILE  26          HG12      ILE  26 125.277  -1.846  -0.259
  190   2HG1  ILE  26          HG11      ILE  26 126.151  -1.220  -1.654
  191   1HG2  ILE  26          HG21      ILE  26 123.464  -1.825  -4.120
  192   2HG2  ILE  26          HG23      ILE  26 123.901  -0.299  -3.354
  193   3HG2  ILE  26          HG22      ILE  26 125.162  -1.388  -3.934
  194   1HD1  ILE  26          HD11      ILE  26 124.152   0.532  -1.720
  195   2HD1  ILE  26          HD13      ILE  26 123.995   0.082  -0.023
  196   3HD1  ILE  26          HD12      ILE  26 125.508   0.760  -0.620
  197    H    GLY  27           HN       GLY  27 120.558  -1.484  -2.675
  198   1HA   GLY  27           HA2      GLY  27 119.996  -4.308  -3.380
  199   2HA   GLY  27           HA1      GLY  27 118.862  -2.962  -3.492
  200    H    GLU  28           HN       GLU  28 118.855  -4.411  -5.685
  201    HA   GLU  28           HA       GLU  28 120.870  -3.984  -7.623
  202   1HB   GLU  28           HB2      GLU  28 117.889  -4.409  -7.947
  203   2HB   GLU  28           HB1      GLU  28 119.033  -4.433  -9.291
  204   1HG   GLU  28           HG2      GLU  28 119.278  -6.207  -6.846
  205   2HG   GLU  28           HG1      GLU  28 118.511  -6.715  -8.349
  206    H    VAL  29           HN       VAL  29 118.028  -1.967  -6.826
  207    HA   VAL  29           HA       VAL  29 118.426  -0.110  -8.990
  208    HB   VAL  29           HB       VAL  29 117.116   0.272  -6.279
  209   1HG1  VAL  29          HG12      VAL  29 117.270   2.031  -8.731
  210   2HG1  VAL  29          HG11      VAL  29 115.955   2.181  -7.566
  211   3HG1  VAL  29          HG13      VAL  29 117.620   2.458  -7.056
  212   1HG2  VAL  29          HG22      VAL  29 116.051  -0.403  -9.036
  213   2HG2  VAL  29          HG21      VAL  29 115.975  -1.410  -7.589
  214   3HG2  VAL  29          HG23      VAL  29 115.025   0.074  -7.683
  215    H    LEU  30           HN       LEU  30 119.465  -0.094  -5.596
  216    HA   LEU  30           HA       LEU  30 120.867   2.402  -5.720
  217   1HB   LEU  30           HB2      LEU  30 121.360   0.006  -3.924
  218   2HB   LEU  30           HB1      LEU  30 121.990   1.630  -3.653
  219    HG   LEU  30           HG       LEU  30 119.043   0.917  -3.813
  220   1HD1  LEU  30          HD13      LEU  30 120.849   1.505  -1.448
  221   2HD1  LEU  30          HD12      LEU  30 119.089   1.423  -1.356
  222   3HD1  LEU  30          HD11      LEU  30 120.018  -0.012  -1.791
  223   1HD2  LEU  30          HD21      LEU  30 120.574   3.491  -3.454
  224   2HD2  LEU  30          HD23      LEU  30 119.127   3.179  -4.412
  225   3HD2  LEU  30          HD22      LEU  30 119.009   3.307  -2.661
  226    H    GLY  31           HN       GLY  31 121.830  -0.933  -6.372
  227   1HA   GLY  31           HA2      GLY  31 124.628  -0.514  -6.622
  228   2HA   GLY  31           HA1      GLY  31 123.727  -1.780  -7.458
  229    H    LYS  32           HN       LYS  32 121.990  -0.101  -8.974
  230    HA   LYS  32           HA       LYS  32 123.670   0.471 -11.221
  231   1HB   LYS  32           HB2      LYS  32 120.821   1.279 -10.592
  232   2HB   LYS  32           HB1      LYS  32 121.609   1.632 -12.130
  233   1HG   LYS  32           HG2      LYS  32 122.021  -0.777 -12.476
  234   2HG   LYS  32           HG1      LYS  32 121.229  -1.132 -10.940
  235   1HD   LYS  32           HD2      LYS  32 119.137  -0.132 -11.778
  236   2HD   LYS  32           HD1      LYS  32 119.921   0.229 -13.316
  237   1HE   LYS  32           HE2      LYS  32 120.440  -2.289 -13.446
  238   2HE   LYS  32           HE1      LYS  32 119.265  -2.477 -12.143
  239   1HZ   LYS  32           HZ3      LYS  32 118.137  -0.801 -14.061
  240   2HZ   LYS  32           HZ2      LYS  32 118.794  -2.129 -14.892
  241   3HZ   LYS  32           HZ1      LYS  32 117.663  -2.376 -13.647
  242    H    LYS  33           HN       LYS  33 122.272   2.617  -8.724
  243    HA   LYS  33           HA       LYS  33 123.141   5.040 -10.001
  244   1HB   LYS  33           HB2      LYS  33 122.521   4.393  -7.107
  245   2HB   LYS  33           HB1      LYS  33 122.886   6.022  -7.682
  246   1HG   LYS  33           HG2      LYS  33 121.012   5.883  -9.280
  247   2HG   LYS  33           HG1      LYS  33 120.644   4.256  -8.706
  248   1HD   LYS  33           HD2      LYS  33 120.214   5.148  -6.447
  249   2HD   LYS  33           HD1      LYS  33 120.578   6.777  -7.021
  250   1HE   LYS  33           HE2      LYS  33 118.378   5.003  -8.122
  251   2HE   LYS  33           HE1      LYS  33 118.131   6.332  -6.989
  252   1HZ   LYS  33           HZ1      LYS  33 119.533   7.562  -8.873
  253   2HZ   LYS  33           HZ3      LYS  33 118.748   6.402  -9.829
  254   3HZ   LYS  33           HZ2      LYS  33 117.837   7.483  -8.886
  255    H    LEU  34           HN       LEU  34 124.634   3.097  -7.376
  256    HA   LEU  34           HA       LEU  34 126.975   4.721  -7.140
  257   1HB   LEU  34           HB2      LEU  34 126.656   1.743  -6.651
  258   2HB   LEU  34           HB1      LEU  34 128.005   2.724  -6.097
  259    HG   LEU  34           HG       LEU  34 125.127   3.264  -5.340
  260   1HD1  LEU  34          HD13      LEU  34 127.316   1.751  -3.887
  261   2HD1  LEU  34          HD12      LEU  34 125.828   2.305  -3.118
  262   3HD1  LEU  34          HD11      LEU  34 125.759   1.116  -4.419
  263   1HD2  LEU  34          HD21      LEU  34 127.809   4.436  -4.565
  264   2HD2  LEU  34          HD23      LEU  34 126.314   5.269  -4.992
  265   3HD2  LEU  34          HD22      LEU  34 126.464   4.482  -3.427
  266    H    GLU  35           HN       GLU  35 126.208   1.956  -9.214
  267    HA   GLU  35           HA       GLU  35 128.803   1.620 -10.354
  268   1HB   GLU  35           HB2      GLU  35 126.977  -0.011 -10.680
  269   2HB   GLU  35           HB1      GLU  35 126.106   1.160 -11.669
  270   1HG   GLU  35           HG2      GLU  35 127.978   1.189 -13.286
  271   2HG   GLU  35           HG1      GLU  35 128.848   0.019 -12.294
  272    H    GLU  36           HN       GLU  36 126.131   3.748 -11.309
  273    HA   GLU  36           HA       GLU  36 127.454   4.796 -13.649
  274   1HB   GLU  36           HB2      GLU  36 125.218   5.877 -11.911
  275   2HB   GLU  36           HB1      GLU  36 125.767   6.672 -13.388
  276   1HG   GLU  36           HG2      GLU  36 125.185   4.747 -14.726
  277   2HG   GLU  36           HG1      GLU  36 124.841   3.790 -13.286
  278    H    ARG  37           HN       ARG  37 127.801   5.332 -10.276
  279    HA   ARG  37           HA       ARG  37 129.067   7.982 -10.627
  280   1HB   ARG  37           HB2      ARG  37 128.596   6.243  -8.190
  281   2HB   ARG  37           HB1      ARG  37 129.358   7.830  -8.134
  282   1HG   ARG  37           HG2      ARG  37 126.653   7.464  -9.427
  283   2HG   ARG  37           HG1      ARG  37 126.794   7.674  -7.685
  284   1HD   ARG  37           HD2      ARG  37 128.104   9.793  -8.128
  285   2HD   ARG  37           HD1      ARG  37 127.697   9.615  -9.836
  286    HE   ARG  37           HE       ARG  37 125.241   9.482  -8.613
  287   1HH1  ARG  37          HH21      ARG  37 127.948  11.618  -8.470
  288   2HH1  ARG  37          HH22      ARG  37 126.988  13.021  -8.139
  289   1HH2  ARG  37          HH11      ARG  37 123.979  11.306  -8.184
  290   2HH2  ARG  37          HH12      ARG  37 124.745  12.846  -7.976
  291    H    GLY  38           HN       GLY  38 130.120   4.866 -11.118
  292   1HA   GLY  38           HA2      GLY  38 132.431   4.524 -11.806
  293   2HA   GLY  38           HA1      GLY  38 132.949   5.720 -10.629
  294    H    PHE  39           HN       PHE  39 130.670   3.721  -9.151
  295    HA   PHE  39           HA       PHE  39 132.866   2.100  -7.900
  296   1HB   PHE  39           HB2      PHE  39 130.056   2.721  -6.980
  297   2HB   PHE  39           HB1      PHE  39 131.183   1.692  -6.108
  298    HD1  PHE  39           HD2      PHE  39 133.183   2.648  -5.031
  299    HD2  PHE  39           HD1      PHE  39 130.330   5.123  -7.072
  300    HE1  PHE  39           HE2      PHE  39 134.168   4.659  -3.967
  301    HE2  PHE  39           HE1      PHE  39 131.314   7.135  -6.011
  302    HZ   PHE  39           HZ       PHE  39 133.239   6.904  -4.454
  303    H    ASP  40           HN       ASP  40 132.723   0.778  -9.962
  304    HA   ASP  40           HA       ASP  40 130.282  -0.777 -10.371
  305   1HB   ASP  40           HB2      ASP  40 131.562  -1.873 -12.160
  306   2HB   ASP  40           HB1      ASP  40 131.721  -0.119 -12.262
  307    H    LYS  41           HN       LYS  41 132.963  -1.115  -8.260
  308    HA   LYS  41           HA       LYS  41 132.163  -3.954  -7.765
  309   1HB   LYS  41           HB2      LYS  41 134.997  -2.951  -8.135
  310   2HB   LYS  41           HB1      LYS  41 134.586  -4.533  -7.466
  311   1HG   LYS  41           HG2      LYS  41 133.321  -5.072  -9.530
  312   2HG   LYS  41           HG1      LYS  41 133.750  -3.499 -10.194
  313   1HD   LYS  41           HD2      LYS  41 135.390  -4.840 -11.161
  314   2HD   LYS  41           HD1      LYS  41 136.225  -4.286  -9.713
  315   1HE   LYS  41           HE2      LYS  41 136.521  -6.703  -9.947
  316   2HE   LYS  41           HE1      LYS  41 135.498  -6.382  -8.548
  317   1HZ   LYS  41           HZ3      LYS  41 134.134  -6.695 -11.097
  318   2HZ   LYS  41           HZ2      LYS  41 134.844  -8.098 -10.458
  319   3HZ   LYS  41           HZ1      LYS  41 133.689  -7.241  -9.554
  320    H    ALA  42           HN       ALA  42 132.761  -4.731  -5.644
  321    HA   ALA  42           HA       ALA  42 132.095  -2.891  -3.579
  322   1HB   ALA  42           HB2      ALA  42 133.291  -5.663  -3.492
  323   2HB   ALA  42           HB1      ALA  42 132.786  -4.783  -2.050
  324   3HB   ALA  42           HB3      ALA  42 131.600  -5.210  -3.283
  325    H    TYR  43           HN       TYR  43 135.335  -4.286  -4.358
  326    HA   TYR  43           HA       TYR  43 136.601  -3.127  -2.105
  327   1HB   TYR  43           HB2      TYR  43 138.724  -3.520  -3.178
  328   2HB   TYR  43           HB1      TYR  43 137.656  -4.880  -3.491
  329    HD1  TYR  43           HD1      TYR  43 138.941  -1.700  -4.986
  330    HD2  TYR  43           HD2      TYR  43 137.195  -5.560  -5.699
  331    HE1  TYR  43           HE1      TYR  43 139.339  -1.427  -7.419
  332    HE2  TYR  43           HE2      TYR  43 137.584  -5.288  -8.129
  333    HH   TYR  43           HH       TYR  43 139.087  -3.998  -9.620
  334    H    VAL  44           HN       VAL  44 135.511  -1.511  -4.976
  335    HA   VAL  44           HA       VAL  44 137.339   0.765  -4.622
  336    HB   VAL  44           HB       VAL  44 134.729   0.621  -6.178
  337   1HG1  VAL  44          HG11      VAL  44 135.512   2.917  -5.631
  338   2HG1  VAL  44          HG13      VAL  44 137.074   2.539  -6.359
  339   3HG1  VAL  44          HG12      VAL  44 135.621   2.583  -7.358
  340   1HG2  VAL  44          HG23      VAL  44 137.595   0.026  -6.935
  341   2HG2  VAL  44          HG22      VAL  44 136.177  -0.998  -7.157
  342   3HG2  VAL  44          HG21      VAL  44 136.383   0.449  -8.145
  343    H    VAL  45           HN       VAL  45 134.166  -0.236  -3.673
  344    HA   VAL  45           HA       VAL  45 133.348   2.300  -2.475
  345    HB   VAL  45           HB       VAL  45 132.272  -0.513  -2.075
  346   1HG1  VAL  45          HG12      VAL  45 131.273   2.215  -1.227
  347   2HG1  VAL  45          HG11      VAL  45 130.223   0.801  -1.304
  348   3HG1  VAL  45          HG13      VAL  45 131.598   0.821  -0.200
  349   1HG2  VAL  45          HG22      VAL  45 132.099   0.343  -4.398
  350   2HG2  VAL  45          HG21      VAL  45 130.513   0.215  -3.637
  351   3HG2  VAL  45          HG23      VAL  45 131.291   1.788  -3.790
  352    H    LEU  46           HN       LEU  46 134.795  -0.733  -1.352
  353    HA   LEU  46           HA       LEU  46 134.761  -0.141   1.441
  354   1HB   LEU  46           HB2      LEU  46 135.367  -2.380   0.537
  355   2HB   LEU  46           HB1      LEU  46 136.831  -1.694  -0.160
  356    HG   LEU  46           HG       LEU  46 137.557  -1.032   2.148
  357   1HD1  LEU  46          HD12      LEU  46 134.960  -2.368   2.848
  358   2HD1  LEU  46          HD11      LEU  46 136.295  -2.397   3.997
  359   3HD1  LEU  46          HD13      LEU  46 135.633  -0.857   3.458
  360   1HD2  LEU  46          HD21      LEU  46 137.863  -3.461   0.932
  361   2HD2  LEU  46          HD23      LEU  46 138.604  -3.033   2.471
  362   3HD2  LEU  46          HD22      LEU  46 137.105  -3.954   2.446
  363    H    GLY  47           HN       GLY  47 136.965   0.669  -1.181
  364   1HA   GLY  47           HA2      GLY  47 139.077   1.854   0.238
  365   2HA   GLY  47           HA1      GLY  47 138.560   2.380  -1.361
  366    H    GLN  48           HN       GLN  48 136.022   3.396  -0.850
  367    HA   GLN  48           HA       GLN  48 136.615   5.979   0.206
  368   1HB   GLN  48           HB2      GLN  48 134.720   5.398  -1.365
  369   2HB   GLN  48           HB1      GLN  48 133.871   4.701   0.014
  370   1HG   GLN  48           HG2      GLN  48 133.090   6.978  -0.294
  371   2HG   GLN  48           HG1      GLN  48 134.063   6.921   1.176
  372   1HE2  GLN  48          HE22      GLN  48 135.975   9.600  -0.080
  373   2HE2  GLN  48          HE21      GLN  48 135.053   8.974   1.199
  374    H    PHE  49           HN       PHE  49 135.007   3.163   1.686
  375    HA   PHE  49           HA       PHE  49 134.321   4.374   4.176
  376   1HB   PHE  49           HB2      PHE  49 133.511   2.147   3.424
  377   2HB   PHE  49           HB1      PHE  49 135.140   1.503   3.620
  378    HD1  PHE  49           HD1      PHE  49 132.536   3.398   5.546
  379    HD2  PHE  49           HD2      PHE  49 135.705   0.497   5.666
  380    HE1  PHE  49           HE1      PHE  49 132.051   2.965   7.939
  381    HE2  PHE  49           HE2      PHE  49 135.218   0.067   8.059
  382    HZ   PHE  49           HZ       PHE  49 133.392   1.301   9.195
  383    H    LEU  50           HN       LEU  50 137.252   2.749   3.072
  384    HA   LEU  50           HA       LEU  50 138.648   2.931   5.599
  385   1HB   LEU  50           HB2      LEU  50 139.743   2.727   2.773
  386   2HB   LEU  50           HB1      LEU  50 140.688   2.478   4.239
  387    HG   LEU  50           HG       LEU  50 138.203   0.870   3.559
  388   1HD1  LEU  50          HD11      LEU  50 141.130   0.258   3.055
  389   2HD1  LEU  50          HD13      LEU  50 139.854  -0.960   3.003
  390   3HD1  LEU  50          HD12      LEU  50 139.844   0.377   1.858
  391   1HD2  LEU  50          HD22      LEU  50 140.327   0.718   5.702
  392   2HD2  LEU  50          HD21      LEU  50 138.575   0.654   5.878
  393   3HD2  LEU  50          HD23      LEU  50 139.443  -0.727   5.217
  394    H    VAL  51           HN       VAL  51 138.429   5.051   2.776
  395    HA   VAL  51           HA       VAL  51 140.387   6.955   3.666
  396    HB   VAL  51           HB       VAL  51 138.062   7.174   1.738
  397   1HG1  VAL  51          HG11      VAL  51 140.145   9.203   2.562
  398   2HG1  VAL  51          HG13      VAL  51 139.390   9.259   0.967
  399   3HG1  VAL  51          HG12      VAL  51 138.400   9.420   2.417
  400   1HG2  VAL  51          HG21      VAL  51 140.044   5.685   1.216
  401   2HG2  VAL  51          HG23      VAL  51 139.773   6.981   0.051
  402   3HG2  VAL  51          HG22      VAL  51 141.054   7.131   1.255
  403    H    LEU  52           HN       LEU  52 137.018   6.481   4.504
  404    HA   LEU  52           HA       LEU  52 136.795   9.178   5.705
  405   1HB   LEU  52           HB2      LEU  52 134.892   6.821   5.635
  406   2HB   LEU  52           HB1      LEU  52 134.518   8.367   6.392
  407    HG   LEU  52           HG       LEU  52 135.296   8.034   3.476
  408   1HD1  LEU  52          HD13      LEU  52 133.123   6.957   4.034
  409   2HD1  LEU  52          HD12      LEU  52 132.560   8.486   4.708
  410   3HD1  LEU  52          HD11      LEU  52 132.919   8.361   2.987
  411   1HD2  LEU  52          HD21      LEU  52 134.557  10.376   5.225
  412   2HD2  LEU  52          HD23      LEU  52 135.770  10.272   3.948
  413   3HD2  LEU  52          HD22      LEU  52 134.065  10.401   3.532
  414    H    LYS  53           HN       LYS  53 138.570   6.757   6.709
  415    HA   LYS  53           HA       LYS  53 139.198   5.883   8.803
  416   1HB   LYS  53           HB2      LYS  53 138.111   8.580   9.657
  417   2HB   LYS  53           HB1      LYS  53 139.122   7.537  10.653
  418   1HG   LYS  53           HG2      LYS  53 140.928   7.685   8.981
  419   2HG   LYS  53           HG1      LYS  53 139.919   8.731   7.980
  420   1HD   LYS  53           HD2      LYS  53 139.805  10.375   9.821
  421   2HD   LYS  53           HD1      LYS  53 140.822   9.330  10.812
  422   1HE   LYS  53           HE2      LYS  53 141.669  10.432   8.122
  423   2HE   LYS  53           HE1      LYS  53 142.082  11.181   9.663
  424   1HZ   LYS  53           HZ1      LYS  53 142.654   8.330   9.220
  425   2HZ   LYS  53           HZ3      LYS  53 143.702   9.503   8.586
  426   3HZ   LYS  53           HZ2      LYS  53 143.422   9.431  10.261
  427    H    LYS  54           HN       LYS  54 136.527   5.127   7.958
  428    HA   LYS  54           HA       LYS  54 134.627   4.060   8.818
  429   1HB   LYS  54           HB2      LYS  54 136.141   4.236  11.446
  430   2HB   LYS  54           HB1      LYS  54 134.779   3.179  11.092
  431   1HG   LYS  54           HG2      LYS  54 136.079   2.062   9.331
  432   2HG   LYS  54           HG1      LYS  54 137.450   3.121   9.662
  433   1HD   LYS  54           HD2      LYS  54 137.549   2.263  11.978
  434   2HD   LYS  54           HD1      LYS  54 136.192   1.190  11.632
  435   1HE   LYS  54           HE2      LYS  54 138.825   1.152  10.133
  436   2HE   LYS  54           HE1      LYS  54 138.408   0.045  11.440
  437   1HZ   LYS  54           HZ1      LYS  54 136.645   0.360   9.098
  438   2HZ   LYS  54           HZ3      LYS  54 137.978  -0.686   9.042
  439   3HZ   LYS  54           HZ2      LYS  54 136.747  -0.940  10.187
  440    H    ASP  55           HN       ASP  55 134.970   7.175   9.063
  441    HA   ASP  55           HA       ASP  55 133.474   7.900  11.422
  442   1HB   ASP  55           HB2      ASP  55 133.931   9.294   8.776
  443   2HB   ASP  55           HB1      ASP  55 132.966  10.019  10.065
  444    H    GLU  56           HN       GLU  56 131.433   7.191  11.801
  445    HA   GLU  56           HA       GLU  56 129.750   6.009   9.832
  446   1HB   GLU  56           HB2      GLU  56 129.649   5.496  12.243
  447   2HB   GLU  56           HB1      GLU  56 129.016   7.112  12.552
  448   1HG   GLU  56           HG2      GLU  56 127.041   6.627  11.166
  449   2HG   GLU  56           HG1      GLU  56 127.682   5.026  10.795
  450    H    ASP  57           HN       ASP  57 129.621   9.282  11.272
  451    HA   ASP  57           HA       ASP  57 127.139   9.979   9.976
  452   1HB   ASP  57           HB2      ASP  57 129.369  11.666  11.141
  453   2HB   ASP  57           HB1      ASP  57 127.870  12.349  10.508
  454    H    LEU  58           HN       LEU  58 130.519  10.418   9.120
  455    HA   LEU  58           HA       LEU  58 129.933  11.971   6.734
  456   1HB   LEU  58           HB2      LEU  58 132.392  10.312   7.377
  457   2HB   LEU  58           HB1      LEU  58 132.274  11.512   6.093
  458    HG   LEU  58           HG       LEU  58 131.928  12.078   9.053
  459   1HD1  LEU  58          HD13      LEU  58 134.218  12.543   7.130
  460   2HD1  LEU  58          HD12      LEU  58 134.083  13.372   8.680
  461   3HD1  LEU  58          HD11      LEU  58 134.240  11.616   8.630
  462   1HD2  LEU  58          HD23      LEU  58 131.668  13.755   6.561
  463   2HD2  LEU  58          HD22      LEU  58 130.664  13.749   8.013
  464   3HD2  LEU  58          HD21      LEU  58 132.253  14.506   8.047
  465    H    PHE  59           HN       PHE  59 130.412   8.521   7.383
  466    HA   PHE  59           HA       PHE  59 130.339   7.683   4.640
  467   1HB   PHE  59           HB2      PHE  59 131.117   6.195   6.450
  468   2HB   PHE  59           HB1      PHE  59 129.489   6.169   7.128
  469    HD1  PHE  59           HD1      PHE  59 131.543   5.211   4.186
  470    HD2  PHE  59           HD2      PHE  59 127.760   4.793   6.180
  471    HE1  PHE  59           HE1      PHE  59 130.945   3.350   2.660
  472    HE2  PHE  59           HE2      PHE  59 127.162   2.932   4.652
  473    HZ   PHE  59           HZ       PHE  59 128.754   2.211   2.892
  474    H    ARG  60           HN       ARG  60 127.757   7.914   7.111
  475    HA   ARG  60           HA       ARG  60 125.652   6.970   5.460
  476   1HB   ARG  60           HB2      ARG  60 125.619   8.910   7.778
  477   2HB   ARG  60           HB1      ARG  60 124.154   8.306   7.006
  478   1HG   ARG  60           HG2      ARG  60 124.872   5.984   7.515
  479   2HG   ARG  60           HG1      ARG  60 126.288   6.615   8.344
  480   1HD   ARG  60           HD2      ARG  60 123.392   7.124   9.078
  481   2HD   ARG  60           HD1      ARG  60 124.547   6.147   9.987
  482    HE   ARG  60           HE       ARG  60 125.767   8.619   9.863
  483   1HH1  ARG  60          HH21      ARG  60 122.683   7.396  10.799
  484   2HH1  ARG  60          HH22      ARG  60 122.391   8.645  11.963
  485   1HH2  ARG  60          HH11      ARG  60 125.400  10.263  11.375
  486   2HH2  ARG  60          HH12      ARG  60 123.928  10.267  12.289
  487    H    GLU  61           HN       GLU  61 126.729  10.373   5.975
  488    HA   GLU  61           HA       GLU  61 124.709  11.485   4.270
  489   1HB   GLU  61           HB2      GLU  61 126.048  12.843   5.859
  490   2HB   GLU  61           HB1      GLU  61 127.482  12.561   4.873
  491   1HG   GLU  61           HG2      GLU  61 126.439  13.686   2.969
  492   2HG   GLU  61           HG1      GLU  61 124.946  13.898   3.883
  493    H    TRP  62           HN       TRP  62 127.941  10.176   3.632
  494    HA   TRP  62           HA       TRP  62 128.175  11.084   0.952
  495   1HB   TRP  62           HB2      TRP  62 130.122  10.196   2.009
  496   2HB   TRP  62           HB1      TRP  62 129.310   8.675   2.382
  497    HD1  TRP  62           HD1      TRP  62 130.804  10.627  -0.571
  498    HE1  TRP  62           HE1      TRP  62 131.198   8.977  -2.518
  499    HE3  TRP  62           HE3      TRP  62 128.611   6.450   1.364
  500    HZ2  TRP  62           HZ2      TRP  62 130.637   6.230  -3.166
  501    HZ3  TRP  62           HZ3      TRP  62 128.553   4.337   0.075
  502    HH2  TRP  62           HH2      TRP  62 129.563   4.221  -2.184
  503    H    LEU  63           HN       LEU  63 126.873   7.965   2.156
  504    HA   LEU  63           HA       LEU  63 126.253   7.019  -0.484
  505   1HB   LEU  63           HB2      LEU  63 126.508   5.491   1.430
  506   2HB   LEU  63           HB1      LEU  63 125.091   6.200   2.194
  507    HG   LEU  63           HG       LEU  63 123.693   5.447   0.310
  508   1HD1  LEU  63          HD13      LEU  63 126.362   4.560  -0.769
  509   2HD1  LEU  63          HD12      LEU  63 124.903   3.678  -1.220
  510   3HD1  LEU  63          HD11      LEU  63 125.047   5.391  -1.601
  511   1HD2  LEU  63          HD21      LEU  63 124.229   3.985   2.330
  512   2HD2  LEU  63          HD23      LEU  63 123.675   3.120   0.897
  513   3HD2  LEU  63          HD22      LEU  63 125.391   3.147   1.302
  514    H    LYS  64           HN       LYS  64 124.260   8.596   2.009
  515    HA   LYS  64           HA       LYS  64 121.810   8.502   0.539
  516   1HB   LYS  64           HB2      LYS  64 122.018   9.059   2.975
  517   2HB   LYS  64           HB1      LYS  64 122.645  10.641   2.509
  518   1HG   LYS  64           HG2      LYS  64 120.577  11.083   1.231
  519   2HG   LYS  64           HG1      LYS  64 119.941   9.513   1.716
  520   1HD   LYS  64           HD2      LYS  64 120.803  11.626   3.703
  521   2HD   LYS  64           HD1      LYS  64 119.153  11.499   3.099
  522   1HE   LYS  64           HE2      LYS  64 119.270   9.025   3.871
  523   2HE   LYS  64           HE1      LYS  64 120.683   9.528   4.798
  524   1HZ   LYS  64           HZ1      LYS  64 118.211  11.100   4.980
  525   2HZ   LYS  64           HZ3      LYS  64 118.334   9.648   5.849
  526   3HZ   LYS  64           HZ2      LYS  64 119.450  10.899   6.125
  527    H    ASP  65           HN       ASP  65 124.243  11.088   0.802
  528    HA   ASP  65           HA       ASP  65 122.932  12.862  -1.042
  529   1HB   ASP  65           HB2      ASP  65 124.737  13.496   0.626
  530   2HB   ASP  65           HB1      ASP  65 125.903  12.737  -0.459
  531    H    THR  66           HN       THR  66 125.157  10.184  -1.422
  532    HA   THR  66           HA       THR  66 125.836  10.810  -4.165
  533    HB   THR  66           HB       THR  66 126.142   8.269  -2.544
  534    HG1  THR  66           HG1      THR  66 128.078  10.152  -3.385
  535   1HG2  THR  66          HG21      THR  66 127.078   9.026  -5.315
  536   2HG2  THR  66          HG23      THR  66 127.858   7.759  -4.368
  537   3HG2  THR  66          HG22      THR  66 126.163   7.599  -4.830
  538    H    CYS  67           HN       CYS  67 123.367   8.704  -2.639
  539    HA   CYS  67           HA       CYS  67 122.215   8.328  -5.389
  540   1HB   CYS  67           HB2      CYS  67 121.652   6.008  -4.783
  541   2HB   CYS  67           HB1      CYS  67 123.393   6.282  -4.758
  542    HG   CYS  67           HG       CYS  67 121.610   5.898  -2.237
  543    H    GLY  68           HN       GLY  68 121.569   8.546  -1.907
  544   1HA   GLY  68           HA2      GLY  68 119.533   9.778  -1.220
  545   2HA   GLY  68           HA1      GLY  68 118.678   9.027  -2.569
  546    H    ALA  69           HN       ALA  69 120.900   7.001  -0.873
  547    HA   ALA  69           HA       ALA  69 119.016   5.017  -0.234
  548   1HB   ALA  69           HB2      ALA  69 121.497   4.712  -0.168
  549   2HB   ALA  69           HB1      ALA  69 121.541   5.647   1.328
  550   3HB   ALA  69           HB3      ALA  69 120.698   4.098   1.279
  551    H    ASN  70           HN       ASN  70 117.972   4.454   1.808
  552    HA   ASN  70           HA       ASN  70 117.152   6.854   3.318
  553   1HB   ASN  70           HB2      ASN  70 115.525   5.091   2.500
  554   2HB   ASN  70           HB1      ASN  70 116.228   3.994   3.691
  555   1HD2  ASN  70          HD22      ASN  70 113.745   5.281   5.891
  556   2HD2  ASN  70          HD21      ASN  70 114.243   3.938   4.981
  557    H    ALA  71           HN       ALA  71 116.920   6.517   5.756
  558    HA   ALA  71           HA       ALA  71 119.481   6.210   6.931
  559   1HB   ALA  71           HB2      ALA  71 117.578   7.504   7.908
  560   2HB   ALA  71           HB1      ALA  71 116.798   5.976   8.319
  561   3HB   ALA  71           HB3      ALA  71 118.336   6.409   9.066
  562    H    LYS  72           HN       LYS  72 116.876   3.841   6.496
  563    HA   LYS  72           HA       LYS  72 118.037   1.910   8.316
  564   1HB   LYS  72           HB2      LYS  72 115.626   1.953   7.567
  565   2HB   LYS  72           HB1      LYS  72 116.165   1.349   6.000
  566   1HG   LYS  72           HG2      LYS  72 117.240  -0.588   7.194
  567   2HG   LYS  72           HG1      LYS  72 116.492  -0.022   8.685
  568   1HD   LYS  72           HD2      LYS  72 114.927  -0.665   6.170
  569   2HD   LYS  72           HD1      LYS  72 115.188  -1.822   7.473
  570   1HE   LYS  72           HE2      LYS  72 114.194  -0.020   9.033
  571   2HE   LYS  72           HE1      LYS  72 113.635   0.768   7.558
  572   1HZ   LYS  72           HZ1      LYS  72 112.814  -1.671   7.063
  573   2HZ   LYS  72           HZ3      LYS  72 112.783  -1.750   8.757
  574   3HZ   LYS  72           HZ2      LYS  72 111.872  -0.567   7.945
  575    H    GLN  73           HN       GLN  73 118.215   2.373   4.798
  576    HA   GLN  73           HA       GLN  73 119.703  -0.017   4.271
  577   1HB   GLN  73           HB2      GLN  73 119.413   2.578   2.742
  578   2HB   GLN  73           HB1      GLN  73 120.297   1.182   2.120
  579   1HG   GLN  73           HG2      GLN  73 118.308  -0.205   2.251
  580   2HG   GLN  73           HG1      GLN  73 117.409   1.095   3.033
  581   1HE2  GLN  73          HE22      GLN  73 116.917   0.999  -0.781
  582   2HE2  GLN  73          HE21      GLN  73 116.962  -0.274   0.342
  583    H    SER  74           HN       SER  74 120.708   3.304   5.030
  584    HA   SER  74           HA       SER  74 123.486   2.879   4.497
  585   1HB   SER  74           HB2      SER  74 122.270   4.804   6.494
  586   2HB   SER  74           HB1      SER  74 123.851   4.927   5.729
  587    HG   SER  74           HG       SER  74 121.328   5.478   4.733
  588    H    ARG  75           HN       ARG  75 121.488   2.376   7.403
  589    HA   ARG  75           HA       ARG  75 123.607   1.913   9.240
  590   1HB   ARG  75           HB2      ARG  75 120.800   0.773   9.101
  591   2HB   ARG  75           HB1      ARG  75 121.880   0.499  10.461
  592   1HG   ARG  75           HG2      ARG  75 121.261   3.295   9.504
  593   2HG   ARG  75           HG1      ARG  75 120.179   2.466  10.612
  594   1HD   ARG  75           HD2      ARG  75 123.085   3.171  11.072
  595   2HD   ARG  75           HD1      ARG  75 121.696   3.805  11.933
  596    HE   ARG  75           HE       ARG  75 123.160   1.412  12.560
  597   1HH1  ARG  75          HH21      ARG  75 119.919   2.589  12.352
  598   2HH1  ARG  75          HH22      ARG  75 119.263   1.296  13.297
  599   1HH2  ARG  75          HH11      ARG  75 122.318  -0.254  13.794
  600   2HH2  ARG  75          HH12      ARG  75 120.617  -0.307  14.115
  601    H    ASP  76           HN       ASP  76 121.985  -0.298   6.965
  602    HA   ASP  76           HA       ASP  76 123.310  -2.651   7.909
  603   1HB   ASP  76           HB2      ASP  76 122.036  -1.971   5.252
  604   2HB   ASP  76           HB1      ASP  76 122.667  -3.572   5.638
  605    H    CYS  77           HN       CYS  77 124.198  -0.306   5.344
  606    HA   CYS  77           HA       CYS  77 126.451  -1.860   4.441
  607   1HB   CYS  77           HB2      CYS  77 125.763   1.080   4.211
  608   2HB   CYS  77           HB1      CYS  77 127.187   0.359   3.459
  609    HG   CYS  77           HG       CYS  77 125.085   0.339   1.793
  610    H    PHE  78           HN       PHE  78 126.075   0.750   6.863
  611    HA   PHE  78           HA       PHE  78 128.851   1.125   7.343
  612   1HB   PHE  78           HB2      PHE  78 127.127   2.634   8.230
  613   2HB   PHE  78           HB1      PHE  78 126.533   1.352   9.286
  614    HD1  PHE  78           HD1      PHE  78 129.533   3.426   8.502
  615    HD2  PHE  78           HD2      PHE  78 127.556   0.929  11.384
  616    HE1  PHE  78           HE1      PHE  78 131.219   4.059  10.207
  617    HE2  PHE  78           HE2      PHE  78 129.243   1.560  13.089
  618    HZ   PHE  78           HZ       PHE  78 131.075   3.124  12.500
  619    H    GLY  79           HN       GLY  79 126.590  -0.812   9.334
  620   1HA   GLY  79           HA2      GLY  79 128.616  -2.069  10.873
  621   2HA   GLY  79           HA1      GLY  79 126.985  -2.698  10.660
  622    H    CYS  80           HN       CYS  80 127.264  -2.915   7.727
  623    HA   CYS  80           HA       CYS  80 128.378  -5.589   7.646
  624   1HB   CYS  80           HB2      CYS  80 126.553  -4.884   6.144
  625   2HB   CYS  80           HB1      CYS  80 127.639  -3.730   5.369
  626    HG   CYS  80           HG       CYS  80 127.655  -5.977   3.983
  627    H    LEU  81           HN       LEU  81 129.521  -2.435   6.404
  628    HA   LEU  81           HA       LEU  81 131.968  -3.545   5.336
  629   1HB   LEU  81           HB2      LEU  81 131.234  -0.709   6.124
  630   2HB   LEU  81           HB1      LEU  81 132.708  -1.151   5.266
  631    HG   LEU  81           HG       LEU  81 129.901  -1.739   4.273
  632   1HD1  LEU  81          HD12      LEU  81 131.845   0.491   3.649
  633   2HD1  LEU  81          HD11      LEU  81 130.536   0.047   2.554
  634   3HD1  LEU  81          HD13      LEU  81 130.168   0.626   4.179
  635   1HD2  LEU  81          HD21      LEU  81 132.666  -2.310   3.241
  636   2HD2  LEU  81          HD23      LEU  81 131.212  -3.303   3.160
  637   3HD2  LEU  81          HD22      LEU  81 131.403  -1.934   2.071
  638    H    ARG  82           HN       ARG  82 131.057  -2.055   8.425
  639    HA   ARG  82           HA       ARG  82 133.663  -1.877   9.561
  640   1HB   ARG  82           HB2      ARG  82 131.518  -0.904  10.502
  641   2HB   ARG  82           HB1      ARG  82 131.116  -2.527  11.060
  642   1HG   ARG  82           HG2      ARG  82 133.517  -2.444  12.157
  643   2HG   ARG  82           HG1      ARG  82 133.328  -0.699  11.978
  644   1HD   ARG  82           HD2      ARG  82 131.777  -2.610  13.696
  645   2HD   ARG  82           HD1      ARG  82 132.392  -1.004  14.087
  646    HE   ARG  82           HE       ARG  82 130.473  -0.524  12.145
  647   1HH1  ARG  82          HH21      ARG  82 130.640  -2.191  15.159
  648   2HH1  ARG  82          HH22      ARG  82 128.975  -1.923  15.552
  649   1HH2  ARG  82          HH11      ARG  82 128.292  -0.170  12.641
  650   2HH2  ARG  82          HH12      ARG  82 127.646  -0.782  14.127
  651    H    GLU  83           HN       GLU  83 131.325  -4.564   9.515
  652    HA   GLU  83           HA       GLU  83 132.900  -6.278  11.206
  653   1HB   GLU  83           HB2      GLU  83 130.661  -6.847   9.255
  654   2HB   GLU  83           HB1      GLU  83 131.424  -8.100  10.235
  655   1HG   GLU  83           HG2      GLU  83 130.828  -6.885  12.285
  656   2HG   GLU  83           HG1      GLU  83 130.089  -5.605  11.327
  657    H    TRP  84           HN       TRP  84 132.733  -5.915   7.640
  658    HA   TRP  84           HA       TRP  84 134.382  -8.181   7.067
  659   1HB   TRP  84           HB2      TRP  84 133.051  -6.838   5.369
  660   2HB   TRP  84           HB1      TRP  84 134.298  -5.595   5.486
  661    HD1  TRP  84           HD1      TRP  84 133.685  -9.133   4.228
  662    HE1  TRP  84           HE1      TRP  84 135.653  -9.845   2.721
  663    HE3  TRP  84           HE3      TRP  84 136.858  -5.204   5.001
  664    HZ2  TRP  84           HZ2      TRP  84 138.231  -8.879   1.948
  665    HZ3  TRP  84           HZ3      TRP  84 139.061  -5.128   3.869
  666    HH2  TRP  84           HH2      TRP  84 139.750  -6.958   2.345
  667    H    CYS  85           HN       CYS  85 135.155  -4.732   7.607
  668    HA   CYS  85           HA       CYS  85 137.964  -4.942   7.281
  669   1HB   CYS  85           HB2      CYS  85 136.184  -3.070   8.841
  670   2HB   CYS  85           HB1      CYS  85 137.938  -2.898   8.885
  671    HG   CYS  85           HG       CYS  85 137.961  -2.302   6.406
  672    H    ASP  86           HN       ASP  86 135.923  -5.430  10.144
  673    HA   ASP  86           HA       ASP  86 138.005  -5.706  12.054
  674   1HB   ASP  86           HB2      ASP  86 135.253  -6.960  11.912
  675   2HB   ASP  86           HB1      ASP  86 136.315  -7.116  13.312
  676    H    ALA  87           HN       ALA  87 136.735  -7.985   9.680
  677    HA   ALA  87           HA       ALA  87 138.353 -10.191  10.838
  678   1HB   ALA  87           HB1      ALA  87 135.984 -10.483   9.896
  679   2HB   ALA  87           HB3      ALA  87 136.714 -10.295   8.301
  680   3HB   ALA  87           HB2      ALA  87 137.201 -11.632   9.342
  681    H    PHE  88           HN       PHE  88 138.348  -8.026   8.048
  682    HA   PHE  88           HA       PHE  88 140.813  -9.387   7.010
  683   1HB   PHE  88           HB2      PHE  88 138.776  -7.615   5.658
  684   2HB   PHE  88           HB1      PHE  88 140.268  -8.156   4.890
  685    HD1  PHE  88           HD2      PHE  88 140.697 -10.654   4.666
  686    HD2  PHE  88           HD1      PHE  88 136.874  -9.041   5.790
  687    HE1  PHE  88           HE2      PHE  88 139.611 -12.797   4.053
  688    HE2  PHE  88           HE1      PHE  88 135.788 -11.191   5.176
  689    HZ   PHE  88           HZ       PHE  88 137.159 -13.061   4.301
  690    H    LEU  89           HN       LEU  89 140.086  -6.762   8.900
  691    HA   LEU  89           HA       LEU  89 142.595  -5.383   8.063
  692   1HB   LEU  89           HB2      LEU  89 140.534  -4.302   6.972
  693   2HB   LEU  89           HB1      LEU  89 140.039  -3.853   8.598
  694    HG   LEU  89           HG       LEU  89 142.424  -2.827   8.820
  695   1HD1  LEU  89          HD11      LEU  89 142.186  -3.216   5.824
  696   2HD1  LEU  89          HD13      LEU  89 143.178  -1.935   6.520
  697   3HD1  LEU  89          HD12      LEU  89 143.536  -3.616   6.886
  698   1HD2  LEU  89          HD22      LEU  89 140.127  -1.711   7.216
  699   2HD2  LEU  89          HD21      LEU  89 140.640  -1.300   8.852
  700   3HD2  LEU  89          HD23      LEU  89 141.582  -0.747   7.468
  701   1H    MET   1           HT1      MET   1 169.892  -2.769  -1.687
  702   2H    MET   1           HT3      MET   1 170.985  -3.884  -1.022
  703   3H    MET   1           HT2      MET   1 171.502  -2.809  -2.232
  704    HA   MET   1           HA       MET   1 170.211  -3.877  -3.883
  705   1HB   MET   1           HB2      MET   1 171.542  -5.938  -2.095
  706   2HB   MET   1           HB1      MET   1 171.156  -6.159  -3.803
  707   1HG   MET   1           HG2      MET   1 172.942  -3.949  -2.753
  708   2HG   MET   1           HG1      MET   1 173.549  -5.483  -3.370
  709   1HE   MET   1           HE2      MET   1 173.150  -6.450  -5.430
  710   2HE   MET   1           HE1      MET   1 171.591  -6.033  -6.134
  711   3HE   MET   1           HE3      MET   1 173.087  -5.591  -6.966
  712    H    THR   2           HN       THR   2 169.815  -5.904  -0.944
  713    HA   THR   2           HA       THR   2 167.257  -6.917  -1.897
  714    HB   THR   2           HB       THR   2 167.146  -8.079   0.249
  715    HG1  THR   2           HG1      THR   2 168.750  -7.627   1.814
  716   1HG2  THR   2          HG23      THR   2 169.894  -7.983  -1.011
  717   2HG2  THR   2          HG22      THR   2 169.444  -9.163   0.220
  718   3HG2  THR   2          HG21      THR   2 168.601  -9.139  -1.330
  719    H    THR   3           HN       THR   3 165.206  -6.596  -0.694
  720    HA   THR   3           HA       THR   3 164.733  -3.785  -0.158
  721    HB   THR   3           HB       THR   3 162.432  -4.527   0.398
  722    HG1  THR   3           HG1      THR   3 162.019  -6.781   0.217
  723   1HG2  THR   3          HG23      THR   3 163.669  -5.806  -2.055
  724   2HG2  THR   3          HG22      THR   3 161.935  -5.603  -1.805
  725   3HG2  THR   3          HG21      THR   3 162.978  -4.187  -1.946
  726    H    SER   4           HN       SER   4 163.870  -2.963   1.912
  727    HA   SER   4           HA       SER   4 165.489  -3.807   4.155
  728   1HB   SER   4           HB2      SER   4 163.116  -1.925   4.020
  729   2HB   SER   4           HB1      SER   4 164.166  -2.118   5.421
  730    HG   SER   4           HG       SER   4 165.262  -1.571   2.888
  731    H    GLN   5           HN       GLN   5 164.625  -4.536   6.225
  732    HA   GLN   5           HA       GLN   5 162.996  -6.850   6.024
  733   1HB   GLN   5           HB2      GLN   5 163.793  -5.158   8.402
  734   2HB   GLN   5           HB1      GLN   5 162.901  -6.670   8.557
  735   1HG   GLN   5           HG2      GLN   5 165.535  -6.450   7.080
  736   2HG   GLN   5           HG1      GLN   5 165.418  -6.894   8.783
  737   1HE2  GLN   5          HE22      GLN   5 163.595  -9.987   7.949
  738   2HE2  GLN   5          HE21      GLN   5 163.412  -8.665   9.000
  739    H    LYS   6           HN       LYS   6 162.079  -3.488   6.511
  740    HA   LYS   6           HA       LYS   6 159.556  -3.881   7.735
  741   1HB   LYS   6           HB2      LYS   6 160.543  -1.782   5.791
  742   2HB   LYS   6           HB1      LYS   6 158.972  -1.699   6.590
  743   1HG   LYS   6           HG2      LYS   6 160.088  -1.760   8.793
  744   2HG   LYS   6           HG1      LYS   6 161.659  -1.836   7.992
  745   1HD   LYS   6           HD2      LYS   6 161.223   0.338   6.913
  746   2HD   LYS   6           HD1      LYS   6 159.649   0.420   7.704
  747   1HE   LYS   6           HE2      LYS   6 162.216   0.116   9.271
  748   2HE   LYS   6           HE1      LYS   6 161.558   1.695   8.843
  749   1HZ   LYS   6           HZ1      LYS   6 159.591  -0.076   9.939
  750   2HZ   LYS   6           HZ3      LYS   6 160.864   0.224  11.019
  751   3HZ   LYS   6           HZ2      LYS   6 159.974   1.521  10.375
  752    H    HIS   7           HN       HIS   7 160.536  -4.000   4.323
  753    HA   HIS   7           HA       HIS   7 157.939  -4.125   3.200
  754   1HB   HIS   7           HB2      HIS   7 159.830  -3.780   1.759
  755   2HB   HIS   7           HB1      HIS   7 160.577  -5.289   2.278
  756    HD2  HIS   7           HD2      HIS   7 159.696  -7.568   0.914
  757    HE1  HIS   7           HE1      HIS   7 156.736  -5.677  -1.427
  758    HE2  HIS   7           HE2      HIS   7 157.997  -7.842  -1.043
  759    H    ARG   8           HN       ARG   8 160.080  -6.881   4.091
  760    HA   ARG   8           HA       ARG   8 158.078  -8.851   3.491
  761   1HB   ARG   8           HB2      ARG   8 160.600  -8.948   5.164
  762   2HB   ARG   8           HB1      ARG   8 159.587 -10.360   4.853
  763   1HG   ARG   8           HG2      ARG   8 159.869  -9.974   2.403
  764   2HG   ARG   8           HG1      ARG   8 160.980  -8.652   2.772
  765   1HD   ARG   8           HD2      ARG   8 162.275 -10.671   2.340
  766   2HD   ARG   8           HD1      ARG   8 162.399 -10.265   4.052
  767    HE   ARG   8           HE       ARG   8 160.244 -12.005   3.940
  768   1HH1  ARG   8          HH21      ARG   8 163.529 -12.010   2.889
  769   2HH1  ARG   8          HH22      ARG   8 163.712 -13.725   3.042
  770   1HH2  ARG   8          HH11      ARG   8 160.465 -14.243   4.140
  771   2HH2  ARG   8          HH12      ARG   8 161.978 -14.990   3.749
  772    H    ASP   9           HN       ASP   9 158.961  -7.049   6.364
  773    HA   ASP   9           HA       ASP   9 157.368  -8.633   8.190
  774   1HB   ASP   9           HB2      ASP   9 158.520  -5.847   8.377
  775   2HB   ASP   9           HB1      ASP   9 157.635  -6.614   9.693
  776    H    PHE  10           HN       PHE  10 156.779  -5.698   6.270
  777    HA   PHE  10           HA       PHE  10 154.232  -5.104   7.472
  778   1HB   PHE  10           HB2      PHE  10 155.625  -3.497   6.147
  779   2HB   PHE  10           HB1      PHE  10 155.213  -4.402   4.692
  780    HD1  PHE  10           HD1      PHE  10 153.941  -2.175   7.335
  781    HD2  PHE  10           HD2      PHE  10 152.952  -4.359   3.770
  782    HE1  PHE  10           HE1      PHE  10 151.827  -0.892   7.137
  783    HE2  PHE  10           HE2      PHE  10 150.837  -3.079   3.574
  784    HZ   PHE  10           HZ       PHE  10 150.274  -1.346   5.256
  785    H    VAL  11           HN       VAL  11 155.166  -6.991   4.591
  786    HA   VAL  11           HA       VAL  11 152.349  -7.618   3.992
  787    HB   VAL  11           HB       VAL  11 153.253  -8.907   2.132
  788   1HG1  VAL  11          HG13      VAL  11 154.690  -6.277   2.603
  789   2HG1  VAL  11          HG12      VAL  11 154.658  -7.115   1.052
  790   3HG1  VAL  11          HG11      VAL  11 153.159  -6.514   1.760
  791   1HG2  VAL  11          HG23      VAL  11 155.823  -8.573   3.673
  792   2HG2  VAL  11          HG22      VAL  11 155.116 -10.049   3.018
  793   3HG2  VAL  11          HG21      VAL  11 155.857  -8.870   1.935
  794    H    ALA  12           HN       ALA  12 154.053  -8.532   6.493
  795    HA   ALA  12           HA       ALA  12 153.425 -11.463   6.302
  796   1HB   ALA  12           HB1      ALA  12 155.427  -9.949   7.993
  797   2HB   ALA  12           HB3      ALA  12 155.053 -11.659   8.213
  798   3HB   ALA  12           HB2      ALA  12 155.774 -11.101   6.702
  799    H    GLU  13           HN       GLU  13 152.367  -8.560   7.741
  800    HA   GLU  13           HA       GLU  13 150.593 -10.089   9.508
  801   1HB   GLU  13           HB2      GLU  13 151.236  -8.557  11.478
  802   2HB   GLU  13           HB1      GLU  13 152.361  -9.854  11.079
  803   1HG   GLU  13           HG2      GLU  13 153.798  -8.343   9.885
  804   2HG   GLU  13           HG1      GLU  13 152.616  -7.039   9.995
  805    HA   PRO  14           HA       PRO  14 147.619  -6.954   8.461
  806   1HB   PRO  14           HB2      PRO  14 147.314  -6.513  11.422
  807   2HB   PRO  14           HB1      PRO  14 146.061  -6.736  10.183
  808   1HG   PRO  14           HG2      PRO  14 146.759  -8.719  11.835
  809   2HG   PRO  14           HG1      PRO  14 146.308  -9.025  10.148
  810   1HD   PRO  14           HD2      PRO  14 148.996  -9.166  11.419
  811   2HD   PRO  14           HD1      PRO  14 148.388  -9.983   9.963
  812    H    MET  15           HN       MET  15 147.353  -4.564   8.559
  813    HA   MET  15           HA       MET  15 149.928  -3.238   9.154
  814   1HB   MET  15           HB2      MET  15 148.732  -1.243   8.106
  815   2HB   MET  15           HB1      MET  15 148.967  -2.636   7.051
  816   1HG   MET  15           HG2      MET  15 146.707  -3.306   7.231
  817   2HG   MET  15           HG1      MET  15 146.433  -2.305   8.658
  818   1HE   MET  15           HE2      MET  15 147.792  -2.162   5.078
  819   2HE   MET  15           HE1      MET  15 146.091  -2.557   4.854
  820   3HE   MET  15           HE3      MET  15 146.727  -1.011   4.273
  821    H    GLY  16           HN       GLY  16 146.784  -3.574  10.559
  822   1HA   GLY  16           HA2      GLY  16 145.791  -2.586  12.442
  823   2HA   GLY  16           HA1      GLY  16 147.440  -2.521  13.058
  824    H    GLU  17           HN       GLU  17 147.422  -0.508  14.003
  825    HA   GLU  17           HA       GLU  17 146.499   1.833  12.403
  826   1HB   GLU  17           HB2      GLU  17 147.136   1.475  15.344
  827   2HB   GLU  17           HB1      GLU  17 146.701   3.020  14.618
  828   1HG   GLU  17           HG2      GLU  17 144.561   2.062  13.848
  829   2HG   GLU  17           HG1      GLU  17 144.994   0.515  14.578
  830    H    LYS  18           HN       LYS  18 149.152   0.436  11.987
  831    HA   LYS  18           HA       LYS  18 151.269   1.986  13.089
  832   1HB   LYS  18           HB2      LYS  18 151.043   0.516  10.445
  833   2HB   LYS  18           HB1      LYS  18 152.544   1.232  11.025
  834   1HG   LYS  18           HG2      LYS  18 152.573  -0.199  12.958
  835   2HG   LYS  18           HG1      LYS  18 150.940  -0.777  12.622
  836   1HD   LYS  18           HD2      LYS  18 151.705  -1.832  10.550
  837   2HD   LYS  18           HD1      LYS  18 153.333  -1.202  10.807
  838   1HE   LYS  18           HE2      LYS  18 153.208  -3.542  11.538
  839   2HE   LYS  18           HE1      LYS  18 153.480  -2.485  12.923
  840   1HZ   LYS  18           HZ3      LYS  18 150.760  -2.602  12.657
  841   2HZ   LYS  18           HZ2      LYS  18 151.269  -4.195  12.358
  842   3HZ   LYS  18           HZ1      LYS  18 151.692  -3.423  13.812
  843    HA   PRO  19           HA       PRO  19 150.703   5.850  10.960
  844   1HB   PRO  19           HB2      PRO  19 153.263   6.818  10.877
  845   2HB   PRO  19           HB1      PRO  19 152.316   6.726  12.377
  846   1HG   PRO  19           HG2      PRO  19 154.396   4.839  11.345
  847   2HG   PRO  19           HG1      PRO  19 154.180   5.486  12.985
  848   1HD   PRO  19           HD2      PRO  19 153.327   2.998  12.307
  849   2HD   PRO  19           HD1      PRO  19 152.456   3.997  13.491
  850    H    VAL  20           HN       VAL  20 151.171   6.988   8.957
  851    HA   VAL  20           HA       VAL  20 151.300   5.353   6.674
  852    HB   VAL  20           HB       VAL  20 150.377   7.570   6.505
  853   1HG1  VAL  20          HG11      VAL  20 151.942   8.533   8.280
  854   2HG1  VAL  20          HG13      VAL  20 153.139   8.709   6.999
  855   3HG1  VAL  20          HG12      VAL  20 151.611   9.581   6.905
  856   1HG2  VAL  20          HG21      VAL  20 151.720   6.564   4.537
  857   2HG2  VAL  20          HG23      VAL  20 151.364   8.290   4.471
  858   3HG2  VAL  20          HG22      VAL  20 152.968   7.738   4.954
  859    H    GLY  21           HN       GLY  21 153.918   7.301   8.121
  860   1HA   GLY  21           HA2      GLY  21 155.934   6.801   6.255
  861   2HA   GLY  21           HA1      GLY  21 156.238   7.060   7.971
  862    H    SER  22           HN       SER  22 154.287   4.417   7.970
  863    HA   SER  22           HA       SER  22 156.583   2.631   8.350
  864   1HB   SER  22           HB2      SER  22 154.506   2.594   9.797
  865   2HB   SER  22           HB1      SER  22 153.637   1.931   8.417
  866    HG   SER  22           HG       SER  22 154.353   0.112   9.232
  867    H    LEU  23           HN       LEU  23 154.322   3.383   5.816
  868    HA   LEU  23           HA       LEU  23 154.405   0.890   4.410
  869   1HB   LEU  23           HB2      LEU  23 154.078   3.705   3.327
  870   2HB   LEU  23           HB1      LEU  23 153.762   2.232   2.414
  871    HG   LEU  23           HG       LEU  23 152.361   2.989   4.997
  872   1HD1  LEU  23          HD13      LEU  23 151.545   3.252   2.092
  873   2HD1  LEU  23          HD12      LEU  23 150.392   3.323   3.425
  874   3HD1  LEU  23          HD11      LEU  23 151.666   4.535   3.295
  875   1HD2  LEU  23          HD23      LEU  23 152.179   0.649   3.097
  876   2HD2  LEU  23          HD22      LEU  23 152.171   0.651   4.861
  877   3HD2  LEU  23          HD21      LEU  23 150.740   1.167   3.976
  878    H    ALA  24           HN       ALA  24 155.890   0.031   3.055
  879    HA   ALA  24           HA       ALA  24 158.599   0.950   3.148
  880   1HB   ALA  24           HB3      ALA  24 157.712  -1.412   2.615
  881   2HB   ALA  24           HB2      ALA  24 157.492  -0.824   0.967
  882   3HB   ALA  24           HB1      ALA  24 159.102  -0.848   1.689
  883    H    GLY  25           HN       GLY  25 159.765   2.230   1.777
  884   1HA   GLY  25           HA2      GLY  25 160.218   3.356  -0.321
  885   2HA   GLY  25           HA1      GLY  25 158.517   3.189  -0.758
  886    H    ILE  26           HN       ILE  26 158.007   4.066   2.205
  887    HA   ILE  26           HA       ILE  26 158.056   6.996   1.598
  888    HB   ILE  26           HB       ILE  26 156.567   5.518   3.788
  889   1HG1  ILE  26          HG12      ILE  26 155.769   4.715   1.634
  890   2HG1  ILE  26          HG11      ILE  26 154.572   5.819   2.303
  891   1HG2  ILE  26          HG21      ILE  26 156.961   7.943   4.152
  892   2HG2  ILE  26          HG23      ILE  26 156.188   8.284   2.605
  893   3HG2  ILE  26          HG22      ILE  26 155.251   7.578   3.921
  894   1HD1  ILE  26          HD11      ILE  26 155.918   7.628   0.894
  895   2HD1  ILE  26          HD13      ILE  26 156.425   6.209  -0.023
  896   3HD1  ILE  26          HD12      ILE  26 154.714   6.604   0.119
  897    H    GLY  27           HN       GLY  27 159.793   8.071   2.531
  898   1HA   GLY  27           HA2      GLY  27 161.083   6.876   4.917
  899   2HA   GLY  27           HA1      GLY  27 161.734   8.184   3.928
  900    H    GLU  28           HN       GLU  28 161.887   8.748   6.489
  901    HA   GLU  28           HA       GLU  28 159.598   9.743   7.821
  902   1HB   GLU  28           HB2      GLU  28 162.498  10.605   7.978
  903   2HB   GLU  28           HB1      GLU  28 161.249  11.163   9.093
  904   1HG   GLU  28           HG2      GLU  28 161.880   8.239   8.605
  905   2HG   GLU  28           HG1      GLU  28 162.558   9.177   9.934
  906    H    VAL  29           HN       VAL  29 161.774  11.394   5.514
  907    HA   VAL  29           HA       VAL  29 160.547  13.978   5.823
  908    HB   VAL  29           HB       VAL  29 162.027  12.768   3.466
  909   1HG1  VAL  29          HG12      VAL  29 161.017  15.562   4.022
  910   2HG1  VAL  29          HG11      VAL  29 162.365  15.265   2.924
  911   3HG1  VAL  29          HG13      VAL  29 160.777  14.581   2.576
  912   1HG2  VAL  29          HG22      VAL  29 162.871  14.552   5.768
  913   2HG2  VAL  29          HG21      VAL  29 163.441  12.919   5.422
  914   3HG2  VAL  29          HG23      VAL  29 163.872  14.250   4.349
  915    H    LEU  30           HN       LEU  30 160.012  11.330   3.517
  916    HA   LEU  30           HA       LEU  30 157.912  12.624   2.056
  917   1HB   LEU  30           HB2      LEU  30 158.411   9.660   2.482
  918   2HB   LEU  30           HB1      LEU  30 157.362  10.353   1.246
  919    HG   LEU  30           HG       LEU  30 160.335  10.900   1.498
  920   1HD1  LEU  30          HD13      LEU  30 158.768   9.097  -0.372
  921   2HD1  LEU  30          HD12      LEU  30 160.465   9.522  -0.596
  922   3HD1  LEU  30          HD11      LEU  30 159.967   8.597   0.819
  923   1HD2  LEU  30          HD21      LEU  30 158.159  11.870  -0.351
  924   2HD2  LEU  30          HD23      LEU  30 159.491  12.771   0.374
  925   3HD2  LEU  30          HD22      LEU  30 159.796  11.688  -0.977
  926    H    GLY  31           HN       GLY  31 157.935  10.585   4.945
  927   1HA   GLY  31           HA2      GLY  31 155.132  10.168   5.168
  928   2HA   GLY  31           HA1      GLY  31 156.253  10.191   6.531
  929    H    LYS  32           HN       LYS  32 157.185  12.873   6.245
  930    HA   LYS  32           HA       LYS  32 155.126  14.278   7.652
  931   1HB   LYS  32           HB2      LYS  32 157.652  15.258   6.300
  932   2HB   LYS  32           HB1      LYS  32 156.596  16.304   7.249
  933   1HG   LYS  32           HG2      LYS  32 156.894  14.834   9.207
  934   2HG   LYS  32           HG1      LYS  32 157.955  13.789   8.260
  935   1HD   LYS  32           HD2      LYS  32 159.510  15.671   7.911
  936   2HD   LYS  32           HD1      LYS  32 158.456  16.722   8.857
  937   1HE   LYS  32           HE2      LYS  32 158.718  14.997  10.749
  938   2HE   LYS  32           HE1      LYS  32 160.055  14.340   9.805
  939   1HZ   LYS  32           HZ3      LYS  32 160.358  17.107   9.882
  940   2HZ   LYS  32           HZ2      LYS  32 160.031  16.603  11.471
  941   3HZ   LYS  32           HZ1      LYS  32 161.337  15.933  10.615
  942    H    LYS  33           HN       LYS  33 156.122  14.399   4.217
  943    HA   LYS  33           HA       LYS  33 154.396  16.602   3.564
  944   1HB   LYS  33           HB2      LYS  33 155.565  14.378   1.872
  945   2HB   LYS  33           HB1      LYS  33 154.649  15.730   1.201
  946   1HG   LYS  33           HG2      LYS  33 156.245  17.318   2.210
  947   2HG   LYS  33           HG1      LYS  33 157.164  15.970   2.879
  948   1HD   LYS  33           HD2      LYS  33 157.597  15.130   0.600
  949   2HD   LYS  33           HD1      LYS  33 156.682  16.481  -0.070
  950   1HE   LYS  33           HE2      LYS  33 159.158  16.753   1.661
  951   2HE   LYS  33           HE1      LYS  33 159.129  16.921  -0.095
  952   1HZ   LYS  33           HZ1      LYS  33 157.188  18.594   0.574
  953   2HZ   LYS  33           HZ3      LYS  33 158.153  18.732   1.962
  954   3HZ   LYS  33           HZ2      LYS  33 158.813  19.073   0.433
  955    H    LEU  34           HN       LEU  34 153.927  13.060   3.220
  956    HA   LEU  34           HA       LEU  34 151.256  13.240   2.213
  957   1HB   LEU  34           HB2      LEU  34 152.527  11.045   3.879
  958   2HB   LEU  34           HB1      LEU  34 151.029  10.892   2.973
  959    HG   LEU  34           HG       LEU  34 153.682  11.611   1.708
  960   1HD1  LEU  34          HD13      LEU  34 152.267   8.944   1.985
  961   2HD1  LEU  34          HD12      LEU  34 153.605   9.234   0.874
  962   3HD1  LEU  34          HD11      LEU  34 153.858   9.372   2.613
  963   1HD2  LEU  34          HD21      LEU  34 150.899  11.019   0.672
  964   2HD2  LEU  34          HD23      LEU  34 151.997  12.324   0.221
  965   3HD2  LEU  34          HD22      LEU  34 152.307  10.684  -0.335
  966    H    GLU  35           HN       GLU  35 152.548  13.090   5.505
  967    HA   GLU  35           HA       GLU  35 150.051  12.853   6.867
  968   1HB   GLU  35           HB2      GLU  35 152.226  12.571   8.003
  969   2HB   GLU  35           HB1      GLU  35 152.559  14.290   7.793
  970   1HG   GLU  35           HG2      GLU  35 150.569  14.845   9.155
  971   2HG   GLU  35           HG1      GLU  35 150.235  13.126   9.361
  972    H    GLU  36           HN       GLU  36 151.799  15.731   5.750
  973    HA   GLU  36           HA       GLU  36 149.923  17.621   6.858
  974   1HB   GLU  36           HB2      GLU  36 151.932  17.829   4.599
  975   2HB   GLU  36           HB1      GLU  36 150.973  19.196   5.170
  976   1HG   GLU  36           HG2      GLU  36 151.930  19.035   7.380
  977   2HG   GLU  36           HG1      GLU  36 152.737  17.520   6.976
  978    H    ARG  37           HN       ARG  37 149.874  15.544   4.126
  979    HA   ARG  37           HA       ARG  37 147.829  17.136   2.701
  980   1HB   ARG  37           HB2      ARG  37 149.128  14.463   2.110
  981   2HB   ARG  37           HB1      ARG  37 147.934  15.228   1.064
  982   1HG   ARG  37           HG2      ARG  37 150.418  16.721   1.915
  983   2HG   ARG  37           HG1      ARG  37 150.464  15.615   0.546
  984   1HD   ARG  37           HD2      ARG  37 148.520  16.900  -0.447
  985   2HD   ARG  37           HD1      ARG  37 148.729  18.088   0.840
  986    HE   ARG  37           HE       ARG  37 151.249  17.911  -0.239
  987   1HH1  ARG  37          HH21      ARG  37 148.066  18.383  -1.483
  988   2HH1  ARG  37          HH22      ARG  37 148.588  19.373  -2.805
  989   1HH2  ARG  37          HH11      ARG  37 151.946  19.203  -1.953
  990   2HH2  ARG  37          HH12      ARG  37 150.786  19.840  -3.070
  991    H    GLY  38           HN       GLY  38 147.719  15.109   5.327
  992   1HA   GLY  38           HA2      GLY  38 145.556  14.644   6.343
  993   2HA   GLY  38           HA1      GLY  38 144.855  14.458   4.743
  994    H    PHE  39           HN       PHE  39 147.812  12.832   4.784
  995    HA   PHE  39           HA       PHE  39 146.395  10.232   5.282
  996   1HB   PHE  39           HB2      PHE  39 148.982  10.863   3.855
  997   2HB   PHE  39           HB1      PHE  39 148.343   9.242   4.084
  998    HD1  PHE  39           HD2      PHE  39 146.313   8.513   2.897
  999    HD2  PHE  39           HD1      PHE  39 147.981  12.423   2.300
 1000    HE1  PHE  39           HE2      PHE  39 144.914   8.797   0.870
 1001    HE2  PHE  39           HE1      PHE  39 146.583  12.711   0.273
 1002    HZ   PHE  39           HZ       PHE  39 145.044  10.895  -0.446
 1003    H    ASP  40           HN       ASP  40 146.661  10.830   7.650
 1004    HA   ASP  40           HA       ASP  40 149.381  10.838   8.714
 1005   1HB   ASP  40           HB2      ASP  40 148.272  10.951  10.905
 1006   2HB   ASP  40           HB1      ASP  40 147.576  12.127   9.790
 1007    H    LYS  41           HN       LYS  41 147.231   8.336   7.775
 1008    HA   LYS  41           HA       LYS  41 148.917   6.376   9.280
 1009   1HB   LYS  41           HB2      LYS  41 145.890   6.415   9.199
 1010   2HB   LYS  41           HB1      LYS  41 146.849   5.043   9.763
 1011   1HG   LYS  41           HG2      LYS  41 147.932   6.492  11.453
 1012   2HG   LYS  41           HG1      LYS  41 146.969   7.856  10.897
 1013   1HD   LYS  41           HD2      LYS  41 145.694   7.141  12.708
 1014   2HD   LYS  41           HD1      LYS  41 144.928   6.250  11.395
 1015   1HE   LYS  41           HE2      LYS  41 145.349   4.735  13.268
 1016   2HE   LYS  41           HE1      LYS  41 146.403   4.295  11.923
 1017   1HZ   LYS  41           HZ3      LYS  41 147.447   6.262  13.795
 1018   2HZ   LYS  41           HZ2      LYS  41 147.289   4.679  14.389
 1019   3HZ   LYS  41           HZ1      LYS  41 148.238   4.982  13.014
 1020    H    ALA  42           HN       ALA  42 148.875   4.224   8.376
 1021    HA   ALA  42           HA       ALA  42 149.217   4.214   5.554
 1022   1HB   ALA  42           HB2      ALA  42 148.941   1.969   7.553
 1023   2HB   ALA  42           HB1      ALA  42 149.337   1.704   5.854
 1024   3HB   ALA  42           HB3      ALA  42 150.426   2.639   6.879
 1025    H    TYR  43           HN       TYR  43 146.484   2.827   7.466
 1026    HA   TYR  43           HA       TYR  43 145.227   1.650   5.218
 1027   1HB   TYR  43           HB2      TYR  43 143.207   1.479   6.520
 1028   2HB   TYR  43           HB1      TYR  43 144.589   1.130   7.548
 1029    HD1  TYR  43           HD1      TYR  43 142.214   3.849   6.575
 1030    HD2  TYR  43           HD2      TYR  43 144.940   2.349   9.535
 1031    HE1  TYR  43           HE1      TYR  43 141.437   5.574   8.169
 1032    HE2  TYR  43           HE2      TYR  43 144.164   4.079  11.127
 1033    HH   TYR  43           HH       TYR  43 142.154   5.484  11.480
 1034    H    VAL  44           HN       VAL  44 145.390   5.025   6.016
 1035    HA   VAL  44           HA       VAL  44 143.017   5.712   4.418
 1036    HB   VAL  44           HB       VAL  44 145.320   7.491   5.304
 1037   1HG1  VAL  44          HG11      VAL  44 143.958   8.380   3.423
 1038   2HG1  VAL  44          HG13      VAL  44 142.502   8.157   4.392
 1039   3HG1  VAL  44          HG12      VAL  44 143.727   9.320   4.896
 1040   1HG2  VAL  44          HG23      VAL  44 142.698   6.742   6.606
 1041   2HG2  VAL  44          HG22      VAL  44 144.318   6.661   7.296
 1042   3HG2  VAL  44          HG21      VAL  44 143.551   8.226   7.025
 1043    H    VAL  45           HN       VAL  45 146.446   5.386   4.044
 1044    HA   VAL  45           HA       VAL  45 146.599   6.475   1.337
 1045    HB   VAL  45           HB       VAL  45 148.524   4.683   2.859
 1046   1HG1  VAL  45          HG12      VAL  45 148.750   6.200   0.249
 1047   2HG1  VAL  45          HG11      VAL  45 150.159   5.647   1.153
 1048   3HG1  VAL  45          HG13      VAL  45 149.003   4.476   0.521
 1049   1HG2  VAL  45          HG22      VAL  45 148.119   6.897   3.906
 1050   2HG2  VAL  45          HG21      VAL  45 149.756   6.776   3.258
 1051   3HG2  VAL  45          HG23      VAL  45 148.525   7.677   2.376
 1052    H    LEU  46           HN       LEU  46 146.306   3.266   2.809
 1053    HA   LEU  46           HA       LEU  46 146.533   1.739   0.408
 1054   1HB   LEU  46           HB2      LEU  46 146.519   0.703   2.670
 1055   2HB   LEU  46           HB1      LEU  46 144.835   1.183   2.869
 1056    HG   LEU  46           HG       LEU  46 144.259  -0.194   0.854
 1057   1HD1  LEU  46          HD12      LEU  46 147.208  -0.750   0.963
 1058   2HD1  LEU  46          HD11      LEU  46 146.112  -1.971   0.322
 1059   3HD1  LEU  46          HD13      LEU  46 146.197  -0.382  -0.434
 1060   1HD2  LEU  46          HD21      LEU  46 144.544  -1.049   3.434
 1061   2HD2  LEU  46          HD23      LEU  46 143.922  -2.055   2.130
 1062   3HD2  LEU  46          HD22      LEU  46 145.612  -2.179   2.604
 1063    H    GLY  47           HN       GLY  47 143.860   3.399   1.981
 1064   1HA   GLY  47           HA2      GLY  47 141.695   2.541   0.408
 1065   2HA   GLY  47           HA1      GLY  47 141.806   4.146   1.125
 1066    H    GLN  48           HN       GLN  48 143.968   5.242  -0.253
 1067    HA   GLN  48           HA       GLN  48 142.758   6.036  -2.712
 1068   1HB   GLN  48           HB2      GLN  48 144.518   7.318  -1.423
 1069   2HB   GLN  48           HB1      GLN  48 145.711   6.172  -2.032
 1070   1HG   GLN  48           HG2      GLN  48 145.711   8.122  -3.481
 1071   2HG   GLN  48           HG1      GLN  48 145.007   6.770  -4.367
 1072   1HE2  GLN  48          HE22      GLN  48 142.218   8.802  -5.089
 1073   2HE2  GLN  48          HE21      GLN  48 143.453   7.799  -5.683
 1074    H    PHE  49           HN       PHE  49 145.327   3.663  -2.024
 1075    HA   PHE  49           HA       PHE  49 145.932   2.952  -4.721
 1076   1HB   PHE  49           HB2      PHE  49 147.274   2.259  -2.745
 1077   2HB   PHE  49           HB1      PHE  49 145.960   1.199  -2.240
 1078    HD1  PHE  49           HD1      PHE  49 148.096   1.921  -5.240
 1079    HD2  PHE  49           HD2      PHE  49 146.002  -1.041  -2.939
 1080    HE1  PHE  49           HE1      PHE  49 149.005   0.140  -6.706
 1081    HE2  PHE  49           HE2      PHE  49 146.911  -2.822  -4.407
 1082    HZ   PHE  49           HZ       PHE  49 148.411  -2.231  -6.290
 1083    H    LEU  50           HN       LEU  50 143.519   1.743  -2.449
 1084    HA   LEU  50           HA       LEU  50 142.480  -0.308  -4.203
 1085   1HB   LEU  50           HB2      LEU  50 141.138   1.169  -1.911
 1086   2HB   LEU  50           HB1      LEU  50 140.513  -0.295  -2.667
 1087    HG   LEU  50           HG       LEU  50 143.257  -0.117  -1.379
 1088   1HD1  LEU  50          HD11      LEU  50 140.616  -1.075  -0.238
 1089   2HD1  LEU  50          HD13      LEU  50 142.182  -1.444   0.485
 1090   3HD1  LEU  50          HD12      LEU  50 141.633   0.226   0.376
 1091   1HD2  LEU  50          HD22      LEU  50 141.584  -2.346  -2.543
 1092   2HD2  LEU  50          HD21      LEU  50 143.280  -1.968  -2.840
 1093   3HD2  LEU  50          HD23      LEU  50 142.795  -2.689  -1.310
 1094    H    VAL  51           HN       VAL  51 141.671   3.095  -3.685
 1095    HA   VAL  51           HA       VAL  51 139.360   3.129  -5.392
 1096    HB   VAL  51           HB       VAL  51 141.229   5.317  -4.452
 1097   1HG1  VAL  51          HG11      VAL  51 138.756   5.442  -6.184
 1098   2HG1  VAL  51          HG13      VAL  51 139.247   6.808  -5.181
 1099   3HG1  VAL  51          HG12      VAL  51 140.318   6.215  -6.449
 1100   1HG2  VAL  51          HG21      VAL  51 139.742   4.085  -2.811
 1101   2HG2  VAL  51          HG23      VAL  51 139.451   5.821  -2.904
 1102   3HG2  VAL  51          HG22      VAL  51 138.356   4.697  -3.713
 1103    H    LEU  52           HN       LEU  52 142.796   3.282  -6.078
 1104    HA   LEU  52           HA       LEU  52 142.343   4.292  -8.822
 1105   1HB   LEU  52           HB2      LEU  52 144.845   3.377  -7.381
 1106   2HB   LEU  52           HB1      LEU  52 144.827   3.987  -9.033
 1107    HG   LEU  52           HG       LEU  52 143.813   5.536  -6.627
 1108   1HD1  LEU  52          HD13      LEU  52 146.264   5.116  -6.548
 1109   2HD1  LEU  52          HD12      LEU  52 146.419   5.829  -8.153
 1110   3HD1  LEU  52          HD11      LEU  52 145.890   6.822  -6.796
 1111   1HD2  LEU  52          HD21      LEU  52 144.030   6.102  -9.581
 1112   2HD2  LEU  52          HD23      LEU  52 142.746   6.532  -8.452
 1113   3HD2  LEU  52          HD22      LEU  52 144.257   7.432  -8.449
 1114    H    LYS  53           HN       LYS  53 141.539   1.459  -7.647
 1115    HA   LYS  53           HA       LYS  53 141.493  -0.745  -8.462
 1116   1HB   LYS  53           HB2      LYS  53 141.807   0.768 -11.070
 1117   2HB   LYS  53           HB1      LYS  53 141.298  -0.913 -10.927
 1118   1HG   LYS  53           HG2      LYS  53 139.334  -0.214  -9.610
 1119   2HG   LYS  53           HG1      LYS  53 139.839   1.472  -9.754
 1120   1HD   LYS  53           HD2      LYS  53 139.684   1.311 -12.213
 1121   2HD   LYS  53           HD1      LYS  53 139.172  -0.370 -12.067
 1122   1HE   LYS  53           HE2      LYS  53 137.685   1.949 -10.811
 1123   2HE   LYS  53           HE1      LYS  53 137.272   1.251 -12.378
 1124   1HZ   LYS  53           HZ1      LYS  53 137.545  -0.492 -10.027
 1125   2HZ   LYS  53           HZ3      LYS  53 136.114   0.388 -10.254
 1126   3HZ   LYS  53           HZ2      LYS  53 136.623  -0.722 -11.435
 1127    H    LYS  54           HN       LYS  54 144.127   0.165  -7.665
 1128    HA   LYS  54           HA       LYS  54 146.354  -0.540  -7.776
 1129   1HB   LYS  54           HB2      LYS  54 145.220  -2.704  -9.580
 1130   2HB   LYS  54           HB1      LYS  54 146.780  -2.733  -8.769
 1131   1HG   LYS  54           HG2      LYS  54 145.666  -2.651  -6.579
 1132   2HG   LYS  54           HG1      LYS  54 144.092  -2.610  -7.377
 1133   1HD   LYS  54           HD2      LYS  54 144.571  -4.795  -8.428
 1134   2HD   LYS  54           HD1      LYS  54 146.131  -4.842  -7.605
 1135   1HE   LYS  54           HE2      LYS  54 143.457  -4.655  -6.191
 1136   2HE   LYS  54           HE1      LYS  54 144.365  -6.150  -6.411
 1137   1HZ   LYS  54           HZ1      LYS  54 145.616  -3.788  -5.171
 1138   2HZ   LYS  54           HZ3      LYS  54 144.669  -4.847  -4.246
 1139   3HZ   LYS  54           HZ2      LYS  54 146.059  -5.423  -5.037
 1140    H    ASP  55           HN       ASP  55 145.120   1.232 -10.056
 1141    HA   ASP  55           HA       ASP  55 146.621   0.540 -12.424
 1142   1HB   ASP  55           HB2      ASP  55 145.410   3.133 -11.439
 1143   2HB   ASP  55           HB1      ASP  55 146.273   3.025 -12.975
 1144    H    GLU  56           HN       GLU  56 148.814   0.437 -12.444
 1145    HA   GLU  56           HA       GLU  56 150.503   1.541 -10.437
 1146   1HB   GLU  56           HB2      GLU  56 151.075  -0.427 -11.813
 1147   2HB   GLU  56           HB1      GLU  56 151.221   0.614 -13.227
 1148   1HG   GLU  56           HG2      GLU  56 153.043   1.866 -12.145
 1149   2HG   GLU  56           HG1      GLU  56 152.878   0.870 -10.698
 1150    H    ASP  57           HN       ASP  57 149.814   2.742 -13.738
 1151    HA   ASP  57           HA       ASP  57 151.777   4.857 -13.600
 1152   1HB   ASP  57           HB2      ASP  57 149.315   4.476 -15.320
 1153   2HB   ASP  57           HB1      ASP  57 150.437   5.822 -15.524
 1154    H    LEU  58           HN       LEU  58 148.339   4.696 -12.884
 1155    HA   LEU  58           HA       LEU  58 148.106   7.535 -12.325
 1156   1HB   LEU  58           HB2      LEU  58 146.383   5.239 -11.343
 1157   2HB   LEU  58           HB1      LEU  58 145.953   6.945 -11.264
 1158    HG   LEU  58           HG       LEU  58 146.499   5.392 -13.815
 1159   1HD1  LEU  58          HD13      LEU  58 143.944   6.322 -12.480
 1160   2HD1  LEU  58          HD12      LEU  58 144.022   5.830 -14.172
 1161   3HD1  LEU  58          HD11      LEU  58 144.402   4.671 -12.899
 1162   1HD2  LEU  58          HD23      LEU  58 145.903   8.287 -13.217
 1163   2HD2  LEU  58          HD22      LEU  58 147.044   7.599 -14.374
 1164   3HD2  LEU  58          HD21      LEU  58 145.319   7.581 -14.725
 1165    H    PHE  59           HN       PHE  59 148.785   4.676 -10.345
 1166    HA   PHE  59           HA       PHE  59 148.747   6.037  -7.820
 1167   1HB   PHE  59           HB2      PHE  59 148.704   3.573  -7.990
 1168   2HB   PHE  59           HB1      PHE  59 150.338   3.590  -8.654
 1169    HD1  PHE  59           HD1      PHE  59 148.301   4.354  -5.645
 1170    HD2  PHE  59           HD2      PHE  59 152.263   3.871  -7.239
 1171    HE1  PHE  59           HE1      PHE  59 149.229   4.371  -3.346
 1172    HE2  PHE  59           HE2      PHE  59 153.189   3.890  -4.937
 1173    HZ   PHE  59           HZ       PHE  59 151.673   4.140  -2.991
 1174    H    ARG  60           HN       ARG  60 151.439   5.285 -10.058
 1175    HA   ARG  60           HA       ARG  60 153.494   6.449  -8.488
 1176   1HB   ARG  60           HB2      ARG  60 153.245   6.135 -11.484
 1177   2HB   ARG  60           HB1      ARG  60 154.707   6.721 -10.695
 1178   1HG   ARG  60           HG2      ARG  60 154.801   4.629  -9.363
 1179   2HG   ARG  60           HG1      ARG  60 153.385   4.034 -10.218
 1180   1HD   ARG  60           HD2      ARG  60 156.059   4.756 -11.447
 1181   2HD   ARG  60           HD1      ARG  60 155.390   3.132 -11.275
 1182    HE   ARG  60           HE       ARG  60 153.467   4.453 -12.748
 1183   1HH1  ARG  60          HH21      ARG  60 156.872   3.962 -12.949
 1184   2HH1  ARG  60          HH22      ARG  60 156.923   4.076 -14.677
 1185   1HH2  ARG  60          HH11      ARG  60 153.514   4.613 -15.006
 1186   2HH2  ARG  60          HH12      ARG  60 155.023   4.447 -15.840
 1187    H    GLU  61           HN       GLU  61 151.509   7.996 -11.067
 1188    HA   GLU  61           HA       GLU  61 152.853  10.521 -10.868
 1189   1HB   GLU  61           HB2      GLU  61 151.390   9.905 -12.776
 1190   2HB   GLU  61           HB1      GLU  61 149.992   9.957 -11.704
 1191   1HG   GLU  61           HG2      GLU  61 150.380  12.329 -11.251
 1192   2HG   GLU  61           HG1      GLU  61 151.847  12.298 -12.231
 1193    H    TRP  62           HN       TRP  62 150.112   9.107  -9.119
 1194    HA   TRP  62           HA       TRP  62 149.266  11.477  -7.805
 1195   1HB   TRP  62           HB2      TRP  62 147.838   9.569  -7.703
 1196   2HB   TRP  62           HB1      TRP  62 149.115   8.561  -7.023
 1197    HD1  TRP  62           HD1      TRP  62 146.725  11.417  -6.075
 1198    HE1  TRP  62           HE1      TRP  62 146.602  11.554  -3.499
 1199    HE3  TRP  62           HE3      TRP  62 150.318   8.010  -4.841
 1200    HZ2  TRP  62           HZ2      TRP  62 147.878  10.368  -1.213
 1201    HZ3  TRP  62           HZ3      TRP  62 150.842   7.528  -2.470
 1202    HH2  TRP  62           HH2      TRP  62 149.626   8.701  -0.656
 1203    H    LEU  63           HN       LEU  63 151.598   8.999  -6.667
 1204    HA   LEU  63           HA       LEU  63 152.122  10.385  -4.207
 1205   1HB   LEU  63           HB2      LEU  63 152.603   7.987  -4.491
 1206   2HB   LEU  63           HB1      LEU  63 153.826   8.368  -5.698
 1207    HG   LEU  63           HG       LEU  63 155.124   9.596  -4.004
 1208   1HD1  LEU  63          HD13      LEU  63 152.730   8.936  -2.297
 1209   2HD1  LEU  63          HD12      LEU  63 154.315   9.116  -1.543
 1210   3HD1  LEU  63          HD11      LEU  63 153.610  10.459  -2.435
 1211   1HD2  LEU  63          HD21      LEU  63 155.330   7.079  -4.362
 1212   2HD2  LEU  63          HD23      LEU  63 155.922   7.676  -2.811
 1213   3HD2  LEU  63          HD22      LEU  63 154.349   6.885  -2.909
 1214    H    LYS  64           HN       LYS  64 153.851  10.323  -7.316
 1215    HA   LYS  64           HA       LYS  64 156.000  12.030  -6.505
 1216   1HB   LYS  64           HB2      LYS  64 155.957  10.651  -8.600
 1217   2HB   LYS  64           HB1      LYS  64 154.824  11.816  -9.286
 1218   1HG   LYS  64           HG2      LYS  64 156.470  13.624  -8.932
 1219   2HG   LYS  64           HG1      LYS  64 157.611  12.455  -8.272
 1220   1HD   LYS  64           HD2      LYS  64 156.421  12.210 -11.042
 1221   2HD   LYS  64           HD1      LYS  64 157.934  13.051 -10.725
 1222   1HE   LYS  64           HE2      LYS  64 158.680  10.860  -9.554
 1223   2HE   LYS  64           HE1      LYS  64 157.317  10.115 -10.387
 1224   1HZ   LYS  64           HZ1      LYS  64 159.196  11.783 -11.905
 1225   2HZ   LYS  64           HZ3      LYS  64 159.635  10.194 -11.508
 1226   3HZ   LYS  64           HZ2      LYS  64 158.239  10.483 -12.432
 1227    H    ASP  65           HN       ASP  65 152.952  12.792  -8.181
 1228    HA   ASP  65           HA       ASP  65 153.406  15.630  -8.250
 1229   1HB   ASP  65           HB2      ASP  65 151.734  14.347  -9.662
 1230   2HB   ASP  65           HB1      ASP  65 150.718  14.232  -8.225
 1231    H    THR  66           HN       THR  66 152.066  13.449  -5.859
 1232    HA   THR  66           HA       THR  66 150.875  15.540  -4.252
 1233    HB   THR  66           HB       THR  66 151.574  12.662  -3.616
 1234    HG1  THR  66           HG1      THR  66 149.065  13.881  -4.080
 1235   1HG2  THR  66          HG21      THR  66 150.088  14.778  -2.054
 1236   2HG2  THR  66          HG23      THR  66 149.871  13.054  -1.753
 1237   3HG2  THR  66          HG22      THR  66 151.455  13.797  -1.523
 1238    H    CYS  67           HN       CYS  67 154.045  13.865  -4.184
 1239    HA   CYS  67           HA       CYS  67 154.886  15.870  -2.109
 1240   1HB   CYS  67           HB2      CYS  67 156.200  14.101  -1.006
 1241   2HB   CYS  67           HB1      CYS  67 154.477  13.727  -1.002
 1242    HG   CYS  67           HG       CYS  67 156.611  12.292  -2.753
 1243    H    GLY  68           HN       GLY  68 155.888  13.814  -4.820
 1244   1HA   GLY  68           HA2      GLY  68 157.529  14.777  -6.410
 1245   2HA   GLY  68           HA1      GLY  68 158.384  15.476  -5.035
 1246    H    ALA  69           HN       ALA  69 157.132  12.298  -4.567
 1247    HA   ALA  69           HA       ALA  69 159.595  11.135  -3.886
 1248   1HB   ALA  69           HB2      ALA  69 157.353  10.126  -3.420
 1249   2HB   ALA  69           HB1      ALA  69 157.230   9.694  -5.127
 1250   3HB   ALA  69           HB3      ALA  69 158.487   8.972  -4.123
 1251    H    ASN  70           HN       ASN  70 161.022   9.680  -5.081
 1252    HA   ASN  70           HA       ASN  70 161.260  10.467  -7.915
 1253   1HB   ASN  70           HB2      ASN  70 163.226  10.379  -6.318
 1254   2HB   ASN  70           HB1      ASN  70 163.058   8.623  -6.321
 1255   1HD2  ASN  70          HD22      ASN  70 165.298   8.714  -9.082
 1256   2HD2  ASN  70          HD21      ASN  70 165.116   8.311  -7.442
 1257    H    ALA  71           HN       ALA  71 161.907   8.639  -9.452
 1258    HA   ALA  71           HA       ALA  71 159.741   6.838  -9.764
 1259   1HB   ALA  71           HB2      ALA  71 161.274   7.603 -11.585
 1260   2HB   ALA  71           HB1      ALA  71 162.529   6.560 -10.917
 1261   3HB   ALA  71           HB3      ALA  71 161.048   5.854 -11.564
 1262    H    LYS  72           HN       LYS  72 162.866   6.386  -8.141
 1263    HA   LYS  72           HA       LYS  72 162.597   3.510  -7.961
 1264   1HB   LYS  72           HB2      LYS  72 164.758   4.797  -7.750
 1265   2HB   LYS  72           HB1      LYS  72 164.223   5.313  -6.150
 1266   1HG   LYS  72           HG2      LYS  72 163.959   2.889  -5.530
 1267   2HG   LYS  72           HG1      LYS  72 164.689   2.464  -7.077
 1268   1HD   LYS  72           HD2      LYS  72 166.028   4.257  -5.032
 1269   2HD   LYS  72           HD1      LYS  72 166.307   2.520  -5.130
 1270   1HE   LYS  72           HE2      LYS  72 166.902   2.934  -7.607
 1271   2HE   LYS  72           HE1      LYS  72 166.994   4.639  -7.169
 1272   1HZ   LYS  72           HZ1      LYS  72 168.446   3.633  -5.231
 1273   2HZ   LYS  72           HZ3      LYS  72 168.723   2.423  -6.388
 1274   3HZ   LYS  72           HZ2      LYS  72 169.115   4.039  -6.740
 1275    H    GLN  73           HN       GLN  73 161.822   6.182  -5.750
 1276    HA   GLN  73           HA       GLN  73 161.075   4.519  -3.543
 1277   1HB   GLN  73           HB2      GLN  73 160.354   7.362  -4.278
 1278   2HB   GLN  73           HB1      GLN  73 159.861   6.601  -2.764
 1279   1HG   GLN  73           HG2      GLN  73 162.176   6.215  -2.141
 1280   2HG   GLN  73           HG1      GLN  73 162.734   6.806  -3.705
 1281   1HE2  GLN  73          HE22      GLN  73 162.724   9.517  -0.980
 1282   2HE2  GLN  73          HE21      GLN  73 163.216   7.895  -0.898
 1283    H    SER  74           HN       SER  74 159.215   5.867  -6.252
 1284    HA   SER  74           HA       SER  74 156.658   5.094  -5.238
 1285   1HB   SER  74           HB2      SER  74 157.483   5.360  -8.140
 1286   2HB   SER  74           HB1      SER  74 155.853   5.474  -7.486
 1287    HG   SER  74           HG       SER  74 157.931   7.304  -7.463
 1288    H    ARG  75           HN       ARG  75 159.081   3.377  -7.209
 1289    HA   ARG  75           HA       ARG  75 157.464   1.159  -7.939
 1290   1HB   ARG  75           HB2      ARG  75 160.440   1.367  -7.394
 1291   2HB   ARG  75           HB1      ARG  75 159.683  -0.081  -8.043
 1292   1HG   ARG  75           HG2      ARG  75 159.291   2.604  -9.365
 1293   2HG   ARG  75           HG1      ARG  75 160.710   1.631  -9.715
 1294   1HD   ARG  75           HD2      ARG  75 157.815   0.882 -10.176
 1295   2HD   ARG  75           HD1      ARG  75 159.047   1.135 -11.398
 1296    HE   ARG  75           HE       ARG  75 158.478  -1.320 -10.015
 1297   1HH1  ARG  75          HH21      ARG  75 161.147   0.597 -11.076
 1298   2HH1  ARG  75          HH22      ARG  75 162.286  -0.699 -10.935
 1299   1HH2  ARG  75          HH11      ARG  75 159.945  -3.002  -9.840
 1300   2HH2  ARG  75          HH12      ARG  75 161.608  -2.732 -10.243
 1301    H    ASP  76           HN       ASP  76 159.364   1.770  -4.988
 1302    HA   ASP  76           HA       ASP  76 158.954  -0.832  -3.874
 1303   1HB   ASP  76           HB2      ASP  76 159.594   1.839  -2.609
 1304   2HB   ASP  76           HB1      ASP  76 159.539   0.328  -1.699
 1305    H    CYS  77           HN       CYS  77 157.059   2.198  -3.557
 1306    HA   CYS  77           HA       CYS  77 155.287   1.105  -1.564
 1307   1HB   CYS  77           HB2      CYS  77 155.017   3.409  -3.513
 1308   2HB   CYS  77           HB1      CYS  77 153.792   3.019  -2.307
 1309    HG   CYS  77           HG       CYS  77 155.562   4.797  -1.359
 1310    H    PHE  78           HN       PHE  78 155.171   1.271  -5.139
 1311    HA   PHE  78           HA       PHE  78 152.503   0.330  -5.401
 1312   1HB   PHE  78           HB2      PHE  78 153.789   1.240  -7.286
 1313   2HB   PHE  78           HB1      PHE  78 154.878  -0.145  -7.224
 1314    HD1  PHE  78           HD1      PHE  78 151.314   0.830  -7.734
 1315    HD2  PHE  78           HD2      PHE  78 154.322  -2.185  -8.303
 1316    HE1  PHE  78           HE1      PHE  78 149.759  -0.451  -9.180
 1317    HE2  PHE  78           HE2      PHE  78 152.765  -3.464  -9.747
 1318    HZ   PHE  78           HZ       PHE  78 150.484  -2.598 -10.186
 1319    H    GLY  79           HN       GLY  79 155.487  -1.615  -5.759
 1320   1HA   GLY  79           HA2      GLY  79 154.169  -4.126  -5.742
 1321   2HA   GLY  79           HA1      GLY  79 155.869  -3.886  -5.352
 1322    H    CYS  80           HN       CYS  80 155.280  -2.100  -3.079
 1323    HA   CYS  80           HA       CYS  80 155.032  -4.142  -1.037
 1324   1HB   CYS  80           HB2      CYS  80 156.339  -2.079  -0.676
 1325   2HB   CYS  80           HB1      CYS  80 154.861  -1.124  -0.790
 1326    HG   CYS  80           HG       CYS  80 155.346  -1.647   1.753
 1327    H    LEU  81           HN       LEU  81 152.828  -1.568  -2.193
 1328    HA   LEU  81           HA       LEU  81 150.719  -2.315  -0.363
 1329   1HB   LEU  81           HB2      LEU  81 150.655  -0.771  -2.975
 1330   2HB   LEU  81           HB1      LEU  81 149.283  -0.925  -1.878
 1331    HG   LEU  81           HG       LEU  81 151.977   0.240  -1.104
 1332   1HD1  LEU  81          HD12      LEU  81 149.382   1.535  -1.964
 1333   2HD1  LEU  81          HD11      LEU  81 150.608   2.402  -1.037
 1334   3HD1  LEU  81          HD13      LEU  81 150.994   1.775  -2.640
 1335   1HD2  LEU  81          HD21      LEU  81 149.406  -0.283   0.361
 1336   2HD2  LEU  81          HD23      LEU  81 151.068  -0.423   0.929
 1337   3HD2  LEU  81          HD22      LEU  81 150.320   1.163   0.781
 1338    H    ARG  82           HN       ARG  82 151.529  -3.184  -3.709
 1339    HA   ARG  82           HA       ARG  82 149.169  -4.654  -4.321
 1340   1HB   ARG  82           HB2      ARG  82 151.023  -4.000  -5.926
 1341   2HB   ARG  82           HB1      ARG  82 151.970  -5.327  -5.253
 1342   1HG   ARG  82           HG2      ARG  82 149.821  -6.765  -5.801
 1343   2HG   ARG  82           HG1      ARG  82 149.452  -5.439  -6.904
 1344   1HD   ARG  82           HD2      ARG  82 151.724  -7.399  -6.988
 1345   2HD   ARG  82           HD1      ARG  82 150.709  -6.811  -8.305
 1346    HE   ARG  82           HE       ARG  82 152.113  -4.562  -7.487
 1347   1HH1  ARG  82          HH21      ARG  82 152.865  -7.781  -8.468
 1348   2HH1  ARG  82          HH22      ARG  82 154.405  -7.359  -9.138
 1349   1HH2  ARG  82          HH11      ARG  82 154.125  -3.995  -8.351
 1350   2HH2  ARG  82          HH12      ARG  82 155.118  -5.218  -9.073
 1351    H    GLU  83           HN       GLU  83 152.189  -5.667  -2.720
 1352    HA   GLU  83           HA       GLU  83 151.444  -8.442  -2.547
 1353   1HB   GLU  83           HB2      GLU  83 153.473  -6.783  -1.036
 1354   2HB   GLU  83           HB1      GLU  83 153.265  -8.516  -0.778
 1355   1HG   GLU  83           HG2      GLU  83 153.731  -8.944  -3.151
 1356   2HG   GLU  83           HG1      GLU  83 153.905  -7.216  -3.443
 1357    H    TRP  84           HN       TRP  84 151.022  -5.692  -0.279
 1358    HA   TRP  84           HA       TRP  84 150.078  -7.291   1.898
 1359   1HB   TRP  84           HB2      TRP  84 150.700  -4.830   2.017
 1360   2HB   TRP  84           HB1      TRP  84 149.161  -4.477   1.228
 1361    HD1  TRP  84           HD1      TRP  84 150.650  -5.741   4.493
 1362    HE1  TRP  84           HE1      TRP  84 148.810  -5.787   6.299
 1363    HE3  TRP  84           HE3      TRP  84 146.565  -4.681   1.618
 1364    HZ2  TRP  84           HZ2      TRP  84 145.979  -5.428   6.496
 1365    HZ3  TRP  84           HZ3      TRP  84 144.313  -4.541   2.638
 1366    HH2  TRP  84           HH2      TRP  84 144.014  -4.916   5.066
 1367    H    CYS  85           HN       CYS  85 148.370  -5.639  -0.772
 1368    HA   CYS  85           HA       CYS  85 145.743  -6.424  -0.052
 1369   1HB   CYS  85           HB2      CYS  85 147.056  -5.723  -2.675
 1370   2HB   CYS  85           HB1      CYS  85 145.357  -6.179  -2.608
 1371    HG   CYS  85           HG       CYS  85 144.828  -4.083  -1.252
 1372    H    ASP  86           HN       ASP  86 148.198  -8.085  -2.006
 1373    HA   ASP  86           HA       ASP  86 146.571 -10.221  -2.923
 1374   1HB   ASP  86           HB2      ASP  86 149.529 -10.095  -2.293
 1375   2HB   ASP  86           HB1      ASP  86 148.763 -11.491  -3.052
 1376    H    ALA  87           HN       ALA  87 148.150  -9.693   0.184
 1377    HA   ALA  87           HA       ALA  87 147.446 -12.434   1.082
 1378   1HB   ALA  87           HB1      ALA  87 149.644 -11.253   1.665
 1379   2HB   ALA  87           HB3      ALA  87 148.688 -10.248   2.758
 1380   3HB   ALA  87           HB2      ALA  87 148.768 -11.993   3.006
 1381    H    PHE  88           HN       PHE  88 146.417  -9.091   1.576
 1382    HA   PHE  88           HA       PHE  88 144.369 -10.032   3.557
 1383   1HB   PHE  88           HB2      PHE  88 145.575  -7.311   3.048
 1384   2HB   PHE  88           HB1      PHE  88 144.229  -7.594   4.151
 1385    HD1  PHE  88           HD2      PHE  88 144.554  -9.212   6.089
 1386    HD2  PHE  88           HD1      PHE  88 147.819  -7.750   3.707
 1387    HE1  PHE  88           HE2      PHE  88 146.150  -9.863   7.873
 1388    HE2  PHE  88           HE1      PHE  88 149.417  -8.403   5.496
 1389    HZ   PHE  88           HZ       PHE  88 148.576  -9.452   7.577
 1390    H    LEU  89           HN       LEU  89 144.509  -9.392   0.308
 1391    HA   LEU  89           HA       LEU  89 141.615  -8.684   0.257
 1392   1HB   LEU  89           HB2      LEU  89 143.083  -6.584   0.043
 1393   2HB   LEU  89           HB1      LEU  89 143.628  -7.252  -1.490
 1394    HG   LEU  89           HG       LEU  89 141.093  -7.468  -2.058
 1395   1HD1  LEU  89          HD11      LEU  89 141.048  -5.572   0.308
 1396   2HD1  LEU  89          HD13      LEU  89 139.804  -5.539  -0.941
 1397   3HD1  LEU  89          HD12      LEU  89 140.042  -6.993   0.022
 1398   1HD2  LEU  89          HD22      LEU  89 142.715  -4.926  -1.976
 1399   2HD2  LEU  89          HD21      LEU  89 142.316  -5.942  -3.359
 1400   3HD2  LEU  89          HD23      LEU  89 141.080  -4.911  -2.638
   
  No H/Q in entry =        1400
  Start of MODEL   18
    1   1H    MET   1           HT3      MET   1 114.467  -8.798  11.203
    2   2H    MET   1           HT2      MET   1 113.298  -8.756  12.435
    3   3H    MET   1           HT1      MET   1 113.761  -7.322  11.651
    4    HA   MET   1           HA       MET   1 115.354  -6.980  13.127
    5   1HB   MET   1           HB2      MET   1 114.367  -9.637  14.203
    6   2HB   MET   1           HB1      MET   1 115.555  -8.635  15.037
    7   1HG   MET   1           HG2      MET   1 113.949  -6.764  15.088
    8   2HG   MET   1           HG1      MET   1 112.759  -7.760  14.255
    9   1HE   MET   1           HE1      MET   1 111.889  -9.813  14.926
   10   2HE   MET   1           HE3      MET   1 113.089 -10.757  15.818
   11   3HE   MET   1           HE2      MET   1 111.559 -10.331  16.577
   12    H    THR   2           HN       THR   2 115.534 -10.506  12.492
   13    HA   THR   2           HA       THR   2 118.395 -10.600  12.589
   14    HB   THR   2           HB       THR   2 116.542 -12.466  11.076
   15    HG1  THR   2           HG1      THR   2 116.724 -13.641  13.121
   16   1HG2  THR   2          HG23      THR   2 118.956 -12.736  10.605
   17   2HG2  THR   2          HG22      THR   2 119.269 -12.888  12.334
   18   3HG2  THR   2          HG21      THR   2 118.316 -14.114  11.499
   19    H    THR   3           HN       THR   3 119.921 -10.303  10.985
   20    HA   THR   3           HA       THR   3 119.088  -8.857   8.594
   21    HB   THR   3           HB       THR   3 121.508  -8.775   8.099
   22    HG1  THR   3           HG1      THR   3 121.987 -10.870   8.893
   23   1HG2  THR   3          HG22      THR   3 120.690  -8.225  10.958
   24   2HG2  THR   3          HG21      THR   3 122.222  -7.686  10.271
   25   3HG2  THR   3          HG23      THR   3 120.699  -7.090   9.609
   26    H    SER   4           HN       SER   4 120.022  -9.577   6.412
   27    HA   SER   4           HA       SER   4 118.987 -12.198   5.781
   28   1HB   SER   4           HB2      SER   4 119.681 -11.717   3.512
   29   2HB   SER   4           HB1      SER   4 119.017 -10.240   4.203
   30    HG   SER   4           HG       SER   4 121.006  -9.859   3.152
   31    H    GLN   5           HN       GLN   5 120.291 -13.880   4.686
   32    HA   GLN   5           HA       GLN   5 122.495 -14.724   6.308
   33   1HB   GLN   5           HB2      GLN   5 121.469 -15.673   3.618
   34   2HB   GLN   5           HB1      GLN   5 122.746 -16.492   4.517
   35   1HG   GLN   5           HG2      GLN   5 121.221 -16.777   6.436
   36   2HG   GLN   5           HG1      GLN   5 119.941 -15.961   5.537
   37   1HE2  GLN   5          HE22      GLN   5 120.475 -18.943   3.095
   38   2HE2  GLN   5          HE21      GLN   5 121.171 -17.398   3.015
   39    H    LYS   6           HN       LYS   6 122.334 -12.685   3.495
   40    HA   LYS   6           HA       LYS   6 124.950 -13.130   2.442
   41   1HB   LYS   6           HB2      LYS   6 123.256 -10.617   2.447
   42   2HB   LYS   6           HB1      LYS   6 124.666 -10.887   1.428
   43   1HG   LYS   6           HG2      LYS   6 122.302 -12.769   1.396
   44   2HG   LYS   6           HG1      LYS   6 122.349 -11.331   0.383
   45   1HD   LYS   6           HD2      LYS   6 124.583 -12.169  -0.508
   46   2HD   LYS   6           HD1      LYS   6 124.247 -13.689   0.320
   47   1HE   LYS   6           HE2      LYS   6 122.180 -13.971  -0.941
   48   2HE   LYS   6           HE1      LYS   6 122.407 -12.401  -1.714
   49   1HZ   LYS   6           HZ2      LYS   6 124.402 -14.580  -1.914
   50   2HZ   LYS   6           HZ1      LYS   6 123.132 -14.399  -3.029
   51   3HZ   LYS   6           HZ3      LYS   6 124.291 -13.172  -2.858
   52    H    HIS   7           HN       HIS   7 123.715 -11.032   5.021
   53    HA   HIS   7           HA       HIS   7 126.049  -9.470   5.409
   54   1HB   HIS   7           HB2      HIS   7 123.937  -8.902   6.494
   55   2HB   HIS   7           HB1      HIS   7 123.978 -10.401   7.420
   56    HD2  HIS   7           HD2      HIS   7 125.579 -10.320   9.726
   57    HE1  HIS   7           HE1      HIS   7 127.095  -6.420   9.166
   58    HE2  HIS   7           HE2      HIS   7 126.979  -8.382  10.768
   59    H    ARG   8           HN       ARG   8 125.099 -12.482   7.104
   60    HA   ARG   8           HA       ARG   8 127.562 -12.656   8.572
   61   1HB   ARG   8           HB2      ARG   8 125.396 -14.675   7.925
   62   2HB   ARG   8           HB1      ARG   8 126.771 -15.036   8.973
   63   1HG   ARG   8           HG2      ARG   8 126.136 -13.169  10.458
   64   2HG   ARG   8           HG1      ARG   8 124.760 -12.808   9.416
   65   1HD   ARG   8           HD2      ARG   8 125.206 -15.427  10.881
   66   2HD   ARG   8           HD1      ARG   8 124.068 -14.167  11.361
   67    HE   ARG   8           HE       ARG   8 123.375 -14.755   8.732
   68   1HH1  ARG   8          HH21      ARG   8 123.798 -16.492  11.680
   69   2HH1  ARG   8          HH22      ARG   8 122.627 -17.706  11.287
   70   1HH2  ARG   8          HH11      ARG   8 121.845 -16.330   8.202
   71   2HH2  ARG   8          HH12      ARG   8 121.523 -17.615   9.317
   72    H    ASP   9           HN       ASP   9 126.482 -13.812   5.450
   73    HA   ASP   9           HA       ASP   9 128.696 -15.640   5.048
   74   1HB   ASP   9           HB2      ASP   9 126.733 -14.370   3.141
   75   2HB   ASP   9           HB1      ASP   9 127.963 -15.520   2.632
   76    H    PHE  10           HN       PHE  10 128.065 -12.248   4.158
   77    HA   PHE  10           HA       PHE  10 130.406 -11.981   2.508
   78   1HB   PHE  10           HB2      PHE  10 128.405 -10.435   2.531
   79   2HB   PHE  10           HB1      PHE  10 129.008  -9.784   4.055
   80    HD1  PHE  10           HD1      PHE  10 129.614 -10.074   0.432
   81    HD2  PHE  10           HD2      PHE  10 131.038  -8.426   4.135
   82    HE1  PHE  10           HE1      PHE  10 131.147  -8.578  -0.823
   83    HE2  PHE  10           HE2      PHE  10 132.571  -6.931   2.880
   84    HZ   PHE  10           HZ       PHE  10 132.624  -7.006   0.402
   85    H    VAL  11           HN       VAL  11 129.827 -11.373   5.976
   86    HA   VAL  11           HA       VAL  11 132.579 -10.411   6.351
   87    HB   VAL  11           HB       VAL  11 131.959 -10.264   8.720
   88   1HG1  VAL  11          HG11      VAL  11 129.755  -9.341   6.849
   89   2HG1  VAL  11          HG13      VAL  11 130.035  -8.720   8.476
   90   3HG1  VAL  11          HG12      VAL  11 131.237  -8.457   7.212
   91   1HG2  VAL  11          HG22      VAL  11 129.560 -11.830   7.759
   92   2HG2  VAL  11          HG21      VAL  11 130.669 -12.238   9.066
   93   3HG2  VAL  11          HG23      VAL  11 129.527 -10.908   9.262
   94    H    ALA  12           HN       ALA  12 131.800 -13.298   5.457
   95    HA   ALA  12           HA       ALA  12 133.438 -14.743   7.526
   96   1HB   ALA  12           HB1      ALA  12 131.080 -15.500   7.443
   97   2HB   ALA  12           HB3      ALA  12 131.272 -15.871   5.730
   98   3HB   ALA  12           HB2      ALA  12 132.196 -16.766   6.936
   99    H    GLU  13           HN       GLU  13 133.473 -13.602   4.349
  100    HA   GLU  13           HA       GLU  13 135.802 -15.296   3.774
  101   1HB   GLU  13           HB2      GLU  13 134.885 -15.904   1.482
  102   2HB   GLU  13           HB1      GLU  13 134.133 -16.740   2.841
  103   1HG   GLU  13           HG2      GLU  13 132.282 -15.133   2.826
  104   2HG   GLU  13           HG1      GLU  13 133.034 -14.255   1.495
  105    HA   PRO  14           HA       PRO  14 137.467 -11.609   1.912
  106   1HB   PRO  14           HB2      PRO  14 137.907 -13.313  -0.526
  107   2HB   PRO  14           HB1      PRO  14 139.035 -12.216   0.297
  108   1HG   PRO  14           HG2      PRO  14 139.147 -14.888   0.606
  109   2HG   PRO  14           HG1      PRO  14 139.574 -13.761   1.906
  110   1HD   PRO  14           HD2      PRO  14 137.207 -15.536   1.690
  111   2HD   PRO  14           HD1      PRO  14 137.913 -14.764   3.127
  112    H    MET  15           HN       MET  15 136.976 -10.064   0.130
  113    HA   MET  15           HA       MET  15 134.198 -10.424  -0.855
  114   1HB   MET  15           HB2      MET  15 134.541  -7.997  -1.594
  115   2HB   MET  15           HB1      MET  15 134.548  -8.304   0.141
  116   1HG   MET  15           HG2      MET  15 136.915  -8.136   0.274
  117   2HG   MET  15           HG1      MET  15 137.099  -8.269  -1.476
  118   1HE   MET  15           HE2      MET  15 134.950  -6.241   1.084
  119   2HE   MET  15           HE1      MET  15 136.625  -5.985   1.559
  120   3HE   MET  15           HE3      MET  15 135.656  -4.636   0.949
  121    H    GLY  16           HN       GLY  16 137.457 -10.529  -2.022
  122   1HA   GLY  16           HA2      GLY  16 138.334 -10.828  -4.182
  123   2HA   GLY  16           HA1      GLY  16 136.816 -11.664  -4.514
  124    H    GLU  17           HN       GLU  17 136.348 -10.837  -6.535
  125    HA   GLU  17           HA       GLU  17 136.296  -7.867  -6.885
  126   1HB   GLU  17           HB2      GLU  17 136.282 -10.164  -8.861
  127   2HB   GLU  17           HB1      GLU  17 136.056  -8.478  -9.327
  128   1HG   GLU  17           HG2      GLU  17 138.239  -7.902  -8.341
  129   2HG   GLU  17           HG1      GLU  17 138.469  -9.583  -7.858
  130    H    LYS  18           HN       LYS  18 134.199  -9.354  -5.404
  131    HA   LYS  18           HA       LYS  18 131.901  -9.815  -6.998
  132   1HB   LYS  18           HB2      LYS  18 132.232  -8.942  -4.120
  133   2HB   LYS  18           HB1      LYS  18 130.650  -9.281  -4.820
  134   1HG   LYS  18           HG2      LYS  18 131.477 -11.548  -5.477
  135   2HG   LYS  18           HG1      LYS  18 132.989 -11.200  -4.639
  136   1HD   LYS  18           HD2      LYS  18 131.559 -10.722  -2.568
  137   2HD   LYS  18           HD1      LYS  18 130.223 -11.465  -3.449
  138   1HE   LYS  18           HE2      LYS  18 131.681 -13.493  -3.796
  139   2HE   LYS  18           HE1      LYS  18 132.865 -12.756  -2.716
  140   1HZ   LYS  18           HZ2      LYS  18 130.346 -12.627  -1.501
  141   2HZ   LYS  18           HZ1      LYS  18 130.586 -14.220  -2.037
  142   3HZ   LYS  18           HZ3      LYS  18 131.715 -13.498  -0.998
  143    HA   PRO  19           HA       PRO  19 130.766  -5.728  -8.287
  144   1HB   PRO  19           HB2      PRO  19 128.022  -5.949  -8.442
  145   2HB   PRO  19           HB1      PRO  19 129.134  -6.658  -9.629
  146   1HG   PRO  19           HG2      PRO  19 127.745  -7.962  -7.330
  147   2HG   PRO  19           HG1      PRO  19 128.016  -8.570  -8.973
  148   1HD   PRO  19           HD2      PRO  19 129.542  -9.367  -6.862
  149   2HD   PRO  19           HD1      PRO  19 130.194  -9.245  -8.510
  150    H    VAL  20           HN       VAL  20 129.758  -3.748  -7.574
  151    HA   VAL  20           HA       VAL  20 129.853  -3.254  -4.804
  152    HB   VAL  20           HB       VAL  20 129.999  -1.446  -6.426
  153   1HG1  VAL  20          HG12      VAL  20 128.331  -2.518  -8.020
  154   2HG1  VAL  20          HG11      VAL  20 127.055  -1.872  -6.989
  155   3HG1  VAL  20          HG13      VAL  20 128.160  -0.775  -7.815
  156   1HG2  VAL  20          HG23      VAL  20 128.964  -1.103  -4.080
  157   2HG2  VAL  20          HG22      VAL  20 128.700   0.168  -5.274
  158   3HG2  VAL  20          HG21      VAL  20 127.418  -0.990  -4.921
  159    H    GLY  21           HN       GLY  21 127.040  -3.991  -6.843
  160   1HA   GLY  21           HA2      GLY  21 125.043  -3.607  -4.856
  161   2HA   GLY  21           HA1      GLY  21 124.857  -4.615  -6.288
  162    H    SER  22           HN       SER  22 127.512  -5.895  -4.843
  163    HA   SER  22           HA       SER  22 125.934  -8.094  -3.712
  164   1HB   SER  22           HB2      SER  22 128.038  -8.485  -5.010
  165   2HB   SER  22           HB1      SER  22 128.942  -7.690  -3.724
  166    HG   SER  22           HG       SER  22 128.086 -10.217  -3.867
  167    H    LEU  23           HN       LEU  23 127.531  -5.245  -2.556
  168    HA   LEU  23           HA       LEU  23 128.009  -6.103   0.144
  169   1HB   LEU  23           HB2      LEU  23 127.472  -3.331  -0.958
  170   2HB   LEU  23           HB1      LEU  23 128.072  -3.672   0.663
  171    HG   LEU  23           HG       LEU  23 129.463  -4.559  -1.880
  172   1HD1  LEU  23          HD12      LEU  23 130.045  -2.198  -0.068
  173   2HD1  LEU  23          HD11      LEU  23 131.051  -2.720  -1.419
  174   3HD1  LEU  23          HD13      LEU  23 129.426  -2.106  -1.717
  175   1HD2  LEU  23          HD21      LEU  23 130.070  -4.774   1.066
  176   2HD2  LEU  23          HD23      LEU  23 130.287  -5.973  -0.208
  177   3HD2  LEU  23          HD22      LEU  23 131.407  -4.622  -0.070
  178    H    ALA  24           HN       ALA  24 126.720  -6.047   1.922
  179    HA   ALA  24           HA       ALA  24 123.883  -6.282   1.562
  180   1HB   ALA  24           HB2      ALA  24 125.415  -7.154   3.493
  181   2HB   ALA  24           HB1      ALA  24 125.114  -5.577   4.222
  182   3HB   ALA  24           HB3      ALA  24 123.767  -6.661   3.874
  183    H    GLY  25           HN       GLY  25 122.282  -4.787   1.659
  184   1HA   GLY  25           HA2      GLY  25 121.293  -2.697   2.484
  185   2HA   GLY  25           HA1      GLY  25 122.913  -2.015   2.604
  186    H    ILE  26           HN       ILE  26 123.517  -3.274  -0.144
  187    HA   ILE  26           HA       ILE  26 122.339  -1.029  -1.731
  188    HB   ILE  26           HB       ILE  26 124.511  -2.963  -2.576
  189   1HG1  ILE  26          HG12      ILE  26 125.321  -1.871  -0.573
  190   2HG1  ILE  26          HG11      ILE  26 126.082  -1.089  -1.957
  191   1HG2  ILE  26          HG23      ILE  26 123.322  -1.638  -4.329
  192   2HG2  ILE  26          HG22      ILE  26 123.812  -0.161  -3.500
  193   3HG2  ILE  26          HG21      ILE  26 125.032  -1.223  -4.203
  194   1HD1  ILE  26          HD12      ILE  26 124.133   0.605  -1.835
  195   2HD1  ILE  26          HD11      ILE  26 123.831  -0.059  -0.229
  196   3HD1  ILE  26          HD13      ILE  26 125.375   0.709  -0.590
  197    H    GLY  27           HN       GLY  27 120.551  -1.542  -2.970
  198   1HA   GLY  27           HA2      GLY  27 120.031  -4.396  -3.588
  199   2HA   GLY  27           HA1      GLY  27 118.889  -3.066  -3.778
  200    H    GLU  28           HN       GLU  28 118.949  -4.604  -5.917
  201    HA   GLU  28           HA       GLU  28 121.004  -4.241  -7.828
  202   1HB   GLU  28           HB2      GLU  28 118.026  -4.658  -8.194
  203   2HB   GLU  28           HB1      GLU  28 119.178  -4.681  -9.530
  204   1HG   GLU  28           HG2      GLU  28 120.424  -6.506  -8.417
  205   2HG   GLU  28           HG1      GLU  28 119.250  -6.494  -7.101
  206    H    VAL  29           HN       VAL  29 118.158  -2.210  -7.142
  207    HA   VAL  29           HA       VAL  29 118.583  -0.402  -9.337
  208    HB   VAL  29           HB       VAL  29 117.182  -0.038  -6.671
  209   1HG1  VAL  29          HG13      VAL  29 117.440   1.786  -9.063
  210   2HG1  VAL  29          HG12      VAL  29 116.046   1.882  -7.987
  211   3HG1  VAL  29          HG11      VAL  29 117.669   2.171  -7.358
  212   1HG2  VAL  29          HG22      VAL  29 116.249  -0.697  -9.478
  213   2HG2  VAL  29          HG21      VAL  29 116.085  -1.692  -8.031
  214   3HG2  VAL  29          HG23      VAL  29 115.152  -0.204  -8.188
  215    H    LEU  30           HN       LEU  30 119.543  -0.283  -5.922
  216    HA   LEU  30           HA       LEU  30 120.897   2.239  -6.078
  217   1HB   LEU  30           HB2      LEU  30 121.395  -0.092  -4.202
  218   2HB   LEU  30           HB1      LEU  30 121.957   1.561  -3.956
  219    HG   LEU  30           HG       LEU  30 119.051   0.718  -4.173
  220   1HD1  LEU  30          HD11      LEU  30 120.831   1.403  -1.823
  221   2HD1  LEU  30          HD13      LEU  30 119.070   1.440  -1.724
  222   3HD1  LEU  30          HD12      LEU  30 119.900  -0.073  -2.085
  223   1HD2  LEU  30          HD23      LEU  30 120.443   3.378  -3.873
  224   2HD2  LEU  30          HD22      LEU  30 119.063   2.954  -4.886
  225   3HD2  LEU  30          HD21      LEU  30 118.851   3.145  -3.150
  226    H    GLY  31           HN       GLY  31 121.949  -1.087  -6.609
  227   1HA   GLY  31           HA2      GLY  31 124.750  -0.598  -6.772
  228   2HA   GLY  31           HA1      GLY  31 123.913  -1.918  -7.593
  229    H    LYS  32           HN       LYS  32 122.176  -0.333  -9.207
  230    HA   LYS  32           HA       LYS  32 123.878   0.163 -11.447
  231   1HB   LYS  32           HB2      LYS  32 121.444  -0.411 -11.572
  232   2HB   LYS  32           HB1      LYS  32 121.070   1.211 -10.991
  233   1HG   LYS  32           HG2      LYS  32 122.242   2.182 -12.935
  234   2HG   LYS  32           HG1      LYS  32 122.612   0.558 -13.519
  235   1HD   LYS  32           HD2      LYS  32 120.210   0.057 -13.693
  236   2HD   LYS  32           HD1      LYS  32 119.822   1.668 -13.089
  237   1HE   LYS  32           HE2      LYS  32 120.950   2.681 -15.026
  238   2HE   LYS  32           HE1      LYS  32 121.374   1.078 -15.628
  239   1HZ   LYS  32           HZ3      LYS  32 118.889   0.624 -15.533
  240   2HZ   LYS  32           HZ2      LYS  32 118.697   2.308 -15.394
  241   3HZ   LYS  32           HZ1      LYS  32 119.442   1.645 -16.770
  242    H    LYS  33           HN       LYS  33 122.424   2.437  -9.082
  243    HA   LYS  33           HA       LYS  33 123.312   4.793 -10.473
  244   1HB   LYS  33           HB2      LYS  33 122.635   4.311  -7.564
  245   2HB   LYS  33           HB1      LYS  33 123.030   5.904  -8.212
  246   1HG   LYS  33           HG2      LYS  33 121.184   5.708  -9.831
  247   2HG   LYS  33           HG1      LYS  33 120.779   4.118  -9.183
  248   1HD   LYS  33           HD2      LYS  33 120.346   5.127  -6.972
  249   2HD   LYS  33           HD1      LYS  33 120.745   6.720  -7.621
  250   1HE   LYS  33           HE2      LYS  33 118.417   4.940  -8.377
  251   2HE   LYS  33           HE1      LYS  33 118.361   6.566  -7.695
  252   1HZ   LYS  33           HZ3      LYS  33 119.498   7.345  -9.740
  253   2HZ   LYS  33           HZ2      LYS  33 119.315   5.788 -10.395
  254   3HZ   LYS  33           HZ1      LYS  33 117.946   6.721 -10.019
  255    H    LEU  34           HN       LEU  34 124.761   3.019  -7.721
  256    HA   LEU  34           HA       LEU  34 127.080   4.665  -7.523
  257   1HB   LEU  34           HB2      LEU  34 126.620   1.753  -6.828
  258   2HB   LEU  34           HB1      LEU  34 128.104   2.606  -6.439
  259    HG   LEU  34           HG       LEU  34 125.439   3.742  -5.596
  260   1HD1  LEU  34          HD11      LEU  34 127.095   1.648  -4.158
  261   2HD1  LEU  34          HD13      LEU  34 125.828   2.602  -3.386
  262   3HD1  LEU  34          HD12      LEU  34 125.424   1.492  -4.697
  263   1HD2  LEU  34          HD23      LEU  34 128.304   3.971  -4.589
  264   2HD2  LEU  34          HD22      LEU  34 127.330   5.244  -5.321
  265   3HD2  LEU  34          HD21      LEU  34 126.916   4.627  -3.727
  266    H    GLU  35           HN       GLU  35 126.360   1.821  -9.480
  267    HA   GLU  35           HA       GLU  35 128.961   1.432 -10.575
  268   1HB   GLU  35           HB2      GLU  35 127.122  -0.192 -10.856
  269   2HB   GLU  35           HB1      GLU  35 126.270   0.950 -11.891
  270   1HG   GLU  35           HG2      GLU  35 128.104   0.893 -13.517
  271   2HG   GLU  35           HG1      GLU  35 129.019  -0.189 -12.469
  272    H    GLU  36           HN       GLU  36 126.270   3.448 -11.777
  273    HA   GLU  36           HA       GLU  36 127.664   4.401 -14.096
  274   1HB   GLU  36           HB2      GLU  36 125.204   4.601 -13.804
  275   2HB   GLU  36           HB1      GLU  36 125.465   5.761 -12.500
  276   1HG   GLU  36           HG2      GLU  36 126.608   7.281 -14.068
  277   2HG   GLU  36           HG1      GLU  36 126.376   6.118 -15.374
  278    H    ARG  37           HN       ARG  37 127.942   5.111 -10.747
  279    HA   ARG  37           HA       ARG  37 129.209   7.743 -11.216
  280   1HB   ARG  37           HB2      ARG  37 128.636   6.156  -8.709
  281   2HB   ARG  37           HB1      ARG  37 129.497   7.696  -8.702
  282   1HG   ARG  37           HG2      ARG  37 127.587   8.761  -9.837
  283   2HG   ARG  37           HG1      ARG  37 126.715   7.232  -9.820
  284   1HD   ARG  37           HD2      ARG  37 127.093   7.281  -7.257
  285   2HD   ARG  37           HD1      ARG  37 127.477   8.985  -7.481
  286    HE   ARG  37           HE       ARG  37 124.855   7.856  -7.381
  287   1HH1  ARG  37          HH21      ARG  37 126.706  10.109  -9.232
  288   2HH1  ARG  37          HH22      ARG  37 125.319  10.806  -9.996
  289   1HH2  ARG  37          HH11      ARG  37 123.054   8.772  -8.355
  290   2HH2  ARG  37          HH12      ARG  37 123.258  10.058  -9.495
  291    H    GLY  38           HN       GLY  38 130.282   4.636 -11.556
  292   1HA   GLY  38           HA2      GLY  38 132.606   4.279 -12.193
  293   2HA   GLY  38           HA1      GLY  38 133.100   5.515 -11.046
  294    H    PHE  39           HN       PHE  39 130.798   3.563  -9.541
  295    HA   PHE  39           HA       PHE  39 132.975   1.976  -8.218
  296   1HB   PHE  39           HB2      PHE  39 130.161   2.590  -7.305
  297   2HB   PHE  39           HB1      PHE  39 131.356   1.693  -6.378
  298    HD1  PHE  39           HD2      PHE  39 133.332   2.833  -5.445
  299    HD2  PHE  39           HD1      PHE  39 130.294   4.986  -7.571
  300    HE1  PHE  39           HE2      PHE  39 134.234   4.969  -4.565
  301    HE2  PHE  39           HE1      PHE  39 131.188   7.123  -6.691
  302    HZ   PHE  39           HZ       PHE  39 133.162   7.118  -5.187
  303    H    ASP  40           HN       ASP  40 132.827   0.595 -10.239
  304    HA   ASP  40           HA       ASP  40 130.380  -0.971 -10.589
  305   1HB   ASP  40           HB2      ASP  40 131.579  -2.086 -12.378
  306   2HB   ASP  40           HB1      ASP  40 131.885  -0.352 -12.489
  307    H    LYS  41           HN       LYS  41 133.048  -1.194  -8.486
  308    HA   LYS  41           HA       LYS  41 132.332  -4.039  -7.887
  309   1HB   LYS  41           HB2      LYS  41 135.112  -2.881  -8.194
  310   2HB   LYS  41           HB1      LYS  41 134.775  -4.456  -7.468
  311   1HG   LYS  41           HG2      LYS  41 133.649  -5.181  -9.535
  312   2HG   LYS  41           HG1      LYS  41 133.970  -3.611 -10.270
  313   1HD   LYS  41           HD2      LYS  41 136.432  -4.042  -9.870
  314   2HD   LYS  41           HD1      LYS  41 135.993  -5.689  -9.412
  315   1HE   LYS  41           HE2      LYS  41 135.305  -4.403 -12.069
  316   2HE   LYS  41           HE1      LYS  41 136.656  -5.506 -11.810
  317   1HZ   LYS  41           HZ2      LYS  41 134.876  -7.063 -10.866
  318   2HZ   LYS  41           HZ1      LYS  41 133.764  -6.065 -11.674
  319   3HZ   LYS  41           HZ3      LYS  41 134.966  -6.877 -12.553
  320    H    ALA  42           HN       ALA  42 132.789  -4.673  -5.704
  321    HA   ALA  42           HA       ALA  42 132.033  -2.707  -3.783
  322   1HB   ALA  42           HB3      ALA  42 133.149  -5.495  -3.480
  323   2HB   ALA  42           HB2      ALA  42 132.561  -4.530  -2.125
  324   3HB   ALA  42           HB1      ALA  42 131.458  -5.000  -3.418
  325    H    TYR  43           HN       TYR  43 135.273  -4.128  -4.434
  326    HA   TYR  43           HA       TYR  43 136.482  -3.005  -2.128
  327   1HB   TYR  43           HB2      TYR  43 138.625  -3.426  -3.101
  328   2HB   TYR  43           HB1      TYR  43 137.555  -4.744  -3.556
  329    HD1  TYR  43           HD1      TYR  43 138.943  -1.490  -4.794
  330    HD2  TYR  43           HD2      TYR  43 137.269  -5.312  -5.822
  331    HE1  TYR  43           HE1      TYR  43 139.485  -1.085  -7.172
  332    HE2  TYR  43           HE2      TYR  43 137.818  -4.905  -8.202
  333    HH   TYR  43           HH       TYR  43 139.925  -2.540  -9.227
  334    H    VAL  44           HN       VAL  44 135.456  -1.338  -4.988
  335    HA   VAL  44           HA       VAL  44 137.303   0.914  -4.574
  336    HB   VAL  44           HB       VAL  44 134.718   0.812  -6.175
  337   1HG1  VAL  44          HG12      VAL  44 135.645   3.102  -5.516
  338   2HG1  VAL  44          HG11      VAL  44 137.067   2.699  -6.472
  339   3HG1  VAL  44          HG13      VAL  44 135.491   2.817  -7.247
  340   1HG2  VAL  44          HG22      VAL  44 137.603   0.299  -6.942
  341   2HG2  VAL  44          HG21      VAL  44 136.244  -0.817  -7.081
  342   3HG2  VAL  44          HG23      VAL  44 136.327   0.604  -8.122
  343    H    VAL  45           HN       VAL  45 134.127  -0.084  -3.658
  344    HA   VAL  45           HA       VAL  45 133.326   2.442  -2.419
  345    HB   VAL  45           HB       VAL  45 132.218  -0.374  -2.165
  346   1HG1  VAL  45          HG11      VAL  45 131.290   2.269  -1.019
  347   2HG1  VAL  45          HG13      VAL  45 130.203   0.896  -1.226
  348   3HG1  VAL  45          HG12      VAL  45 131.599   0.761  -0.159
  349   1HG2  VAL  45          HG22      VAL  45 131.444   2.075  -3.766
  350   2HG2  VAL  45          HG21      VAL  45 131.835   0.466  -4.369
  351   3HG2  VAL  45          HG23      VAL  45 130.329   0.736  -3.491
  352    H    LEU  46           HN       LEU  46 134.738  -0.629  -1.348
  353    HA   LEU  46           HA       LEU  46 134.666  -0.119   1.458
  354   1HB   LEU  46           HB2      LEU  46 135.278  -2.336   0.489
  355   2HB   LEU  46           HB1      LEU  46 136.763  -1.632  -0.143
  356    HG   LEU  46           HG       LEU  46 137.387  -1.022   2.240
  357   1HD1  LEU  46          HD13      LEU  46 134.845  -2.548   2.759
  358   2HD1  LEU  46          HD12      LEU  46 136.136  -2.536   3.958
  359   3HD1  LEU  46          HD11      LEU  46 135.389  -1.023   3.458
  360   1HD2  LEU  46          HD22      LEU  46 137.685  -3.486   0.895
  361   2HD2  LEU  46          HD21      LEU  46 138.615  -2.912   2.273
  362   3HD2  LEU  46          HD23      LEU  46 137.199  -3.922   2.532
  363    H    GLY  47           HN       GLY  47 136.916   0.791  -1.093
  364   1HA   GLY  47           HA2      GLY  47 138.964   1.929   0.528
  365   2HA   GLY  47           HA1      GLY  47 138.635   2.400  -1.139
  366    H    GLN  48           HN       GLN  48 135.958   3.353  -0.772
  367    HA   GLN  48           HA       GLN  48 136.453   6.036   0.069
  368   1HB   GLN  48           HB2      GLN  48 134.564   5.210  -1.433
  369   2HB   GLN  48           HB1      GLN  48 133.754   4.655   0.031
  370   1HG   GLN  48           HG2      GLN  48 132.855   6.811  -0.322
  371   2HG   GLN  48           HG1      GLN  48 134.096   7.072   0.904
  372   1HE2  GLN  48          HE22      GLN  48 136.083   7.982  -2.391
  373   2HE2  GLN  48          HE21      GLN  48 135.901   6.420  -1.750
  374    H    PHE  49           HN       PHE  49 135.021   3.250   1.736
  375    HA   PHE  49           HA       PHE  49 134.264   4.554   4.160
  376   1HB   PHE  49           HB2      PHE  49 133.582   2.252   3.533
  377   2HB   PHE  49           HB1      PHE  49 135.246   1.713   3.715
  378    HD1  PHE  49           HD1      PHE  49 132.614   3.564   5.639
  379    HD2  PHE  49           HD2      PHE  49 135.868   0.762   5.765
  380    HE1  PHE  49           HE1      PHE  49 132.185   3.173   8.049
  381    HE2  PHE  49           HE2      PHE  49 135.442   0.377   8.176
  382    HZ   PHE  49           HZ       PHE  49 133.600   1.581   9.319
  383    H    LEU  50           HN       LEU  50 137.280   3.102   3.069
  384    HA   LEU  50           HA       LEU  50 138.715   3.511   5.558
  385   1HB   LEU  50           HB2      LEU  50 139.798   3.274   2.730
  386   2HB   LEU  50           HB1      LEU  50 140.752   3.132   4.204
  387    HG   LEU  50           HG       LEU  50 138.444   1.320   3.439
  388   1HD1  LEU  50          HD11      LEU  50 140.629   1.156   2.100
  389   2HD1  LEU  50          HD13      LEU  50 141.378   0.612   3.602
  390   3HD1  LEU  50          HD12      LEU  50 140.071  -0.326   2.878
  391   1HD2  LEU  50          HD22      LEU  50 140.220   1.535   5.864
  392   2HD2  LEU  50          HD21      LEU  50 138.487   1.225   5.777
  393   3HD2  LEU  50          HD23      LEU  50 139.631  -0.051   5.369
  394    H    VAL  51           HN       VAL  51 138.295   5.430   2.619
  395    HA   VAL  51           HA       VAL  51 140.130   7.513   3.287
  396    HB   VAL  51           HB       VAL  51 137.642   7.486   1.563
  397   1HG1  VAL  51          HG12      VAL  51 139.649   9.681   2.104
  398   2HG1  VAL  51          HG11      VAL  51 138.726   9.620   0.602
  399   3HG1  VAL  51          HG13      VAL  51 137.889   9.777   2.147
  400   1HG2  VAL  51          HG22      VAL  51 139.683   6.113   0.934
  401   2HG2  VAL  51          HG21      VAL  51 139.213   7.324  -0.259
  402   3HG2  VAL  51          HG23      VAL  51 140.577   7.629   0.818
  403    H    LEU  52           HN       LEU  52 136.807   6.910   4.281
  404    HA   LEU  52           HA       LEU  52 136.574   9.585   5.520
  405   1HB   LEU  52           HB2      LEU  52 134.691   7.210   5.579
  406   2HB   LEU  52           HB1      LEU  52 134.321   8.825   6.181
  407    HG   LEU  52           HG       LEU  52 135.067   8.185   3.308
  408   1HD1  LEU  52          HD12      LEU  52 132.800   7.332   4.212
  409   2HD1  LEU  52          HD11      LEU  52 132.352   9.034   4.324
  410   3HD1  LEU  52          HD13      LEU  52 132.767   8.332   2.760
  411   1HD2  LEU  52          HD22      LEU  52 134.396  10.717   4.805
  412   2HD2  LEU  52          HD21      LEU  52 135.644  10.441   3.591
  413   3HD2  LEU  52          HD23      LEU  52 133.958  10.581   3.104
  414    H    LYS  53           HN       LYS  53 138.455   7.223   6.434
  415    HA   LYS  53           HA       LYS  53 139.177   6.354   8.492
  416   1HB   LYS  53           HB2      LYS  53 137.956   8.971   9.418
  417   2HB   LYS  53           HB1      LYS  53 139.099   7.992  10.341
  418   1HG   LYS  53           HG2      LYS  53 140.769   8.239   8.543
  419   2HG   LYS  53           HG1      LYS  53 139.630   9.222   7.621
  420   1HD   LYS  53           HD2      LYS  53 139.575  10.879   9.445
  421   2HD   LYS  53           HD1      LYS  53 140.717   9.903  10.368
  422   1HE   LYS  53           HE2      LYS  53 142.069  11.528   9.299
  423   2HE   LYS  53           HE1      LYS  53 142.259  10.083   8.305
  424   1HZ   LYS  53           HZ3      LYS  53 140.014  11.695   7.536
  425   2HZ   LYS  53           HZ2      LYS  53 141.490  12.525   7.412
  426   3HZ   LYS  53           HZ1      LYS  53 141.266  11.058   6.586
  427    H    LYS  54           HN       LYS  54 136.496   5.584   7.633
  428    HA   LYS  54           HA       LYS  54 134.677   4.385   8.450
  429   1HB   LYS  54           HB2      LYS  54 136.144   4.400  11.098
  430   2HB   LYS  54           HB1      LYS  54 134.957   3.227  10.530
  431   1HG   LYS  54           HG2      LYS  54 136.540   2.712   8.615
  432   2HG   LYS  54           HG1      LYS  54 137.744   3.689   9.448
  433   1HD   LYS  54           HD2      LYS  54 137.516   2.238  11.448
  434   2HD   LYS  54           HD1      LYS  54 136.372   1.229  10.561
  435   1HE   LYS  54           HE2      LYS  54 138.551   0.190  10.401
  436   2HE   LYS  54           HE1      LYS  54 138.153   0.862   8.821
  437   1HZ   LYS  54           HZ2      LYS  54 139.783   2.270  10.860
  438   2HZ   LYS  54           HZ1      LYS  54 140.439   1.361   9.583
  439   3HZ   LYS  54           HZ3      LYS  54 139.519   2.747   9.252
  440    H    ASP  55           HN       ASP  55 134.933   7.460   8.923
  441    HA   ASP  55           HA       ASP  55 133.446   8.005  11.335
  442   1HB   ASP  55           HB2      ASP  55 133.895   9.515   8.762
  443   2HB   ASP  55           HB1      ASP  55 132.846  10.161  10.024
  444    H    GLU  56           HN       GLU  56 131.397   7.234  11.685
  445    HA   GLU  56           HA       GLU  56 129.756   6.127   9.626
  446   1HB   GLU  56           HB2      GLU  56 129.679   5.468  12.018
  447   2HB   GLU  56           HB1      GLU  56 128.923   7.016  12.393
  448   1HG   GLU  56           HG2      GLU  56 127.022   6.495  10.972
  449   2HG   GLU  56           HG1      GLU  56 127.796   5.008  10.422
  450    H    ASP  57           HN       ASP  57 129.553   9.302  11.259
  451    HA   ASP  57           HA       ASP  57 127.042  10.026  10.034
  452   1HB   ASP  57           HB2      ASP  57 129.264  11.691  11.247
  453   2HB   ASP  57           HB1      ASP  57 127.743  12.376  10.676
  454    H    LEU  58           HN       LEU  58 130.402  10.566   9.183
  455    HA   LEU  58           HA       LEU  58 129.796  12.219   6.867
  456   1HB   LEU  58           HB2      LEU  58 132.260  10.590   7.536
  457   2HB   LEU  58           HB1      LEU  58 132.152  11.698   6.174
  458    HG   LEU  58           HG       LEU  58 131.753  12.483   9.078
  459   1HD1  LEU  58          HD11      LEU  58 134.081  11.833   8.601
  460   2HD1  LEU  58          HD13      LEU  58 134.107  12.922   7.214
  461   3HD1  LEU  58          HD12      LEU  58 133.959  13.573   8.847
  462   1HD2  LEU  58          HD23      LEU  58 131.592  13.952   6.453
  463   2HD2  LEU  58          HD22      LEU  58 130.594  14.128   7.896
  464   3HD2  LEU  58          HD21      LEU  58 132.215  14.812   7.862
  465    H    PHE  59           HN       PHE  59 130.320   8.767   7.387
  466    HA   PHE  59           HA       PHE  59 130.289   7.996   4.629
  467   1HB   PHE  59           HB2      PHE  59 131.067   6.463   6.361
  468   2HB   PHE  59           HB1      PHE  59 129.470   6.458   7.110
  469    HD1  PHE  59           HD1      PHE  59 131.007   5.921   3.719
  470    HD2  PHE  59           HD2      PHE  59 128.059   4.667   6.583
  471    HE1  PHE  59           HE1      PHE  59 130.319   4.080   2.206
  472    HE2  PHE  59           HE2      PHE  59 127.371   2.829   5.068
  473    HZ   PHE  59           HZ       PHE  59 128.500   2.535   2.881
  474    H    ARG  60           HN       ARG  60 127.680   8.177   7.061
  475    HA   ARG  60           HA       ARG  60 125.603   7.237   5.376
  476   1HB   ARG  60           HB2      ARG  60 125.566   9.106   7.748
  477   2HB   ARG  60           HB1      ARG  60 124.091   8.590   6.931
  478   1HG   ARG  60           HG2      ARG  60 124.708   6.222   7.339
  479   2HG   ARG  60           HG1      ARG  60 126.150   6.761   8.204
  480   1HD   ARG  60           HD2      ARG  60 124.768   7.927   9.850
  481   2HD   ARG  60           HD1      ARG  60 123.309   7.511   8.956
  482    HE   ARG  60           HE       ARG  60 124.520   5.061   9.514
  483   1HH1  ARG  60          HH21      ARG  60 123.490   7.836  11.283
  484   2HH1  ARG  60          HH22      ARG  60 123.081   6.941  12.708
  485   1HH2  ARG  60          HH11      ARG  60 123.985   3.876  11.367
  486   2HH2  ARG  60          HH12      ARG  60 123.361   4.701  12.756
  487    H    GLU  61           HN       GLU  61 126.672  10.638   5.921
  488    HA   GLU  61           HA       GLU  61 124.666  11.769   4.215
  489   1HB   GLU  61           HB2      GLU  61 127.430  12.743   4.994
  490   2HB   GLU  61           HB1      GLU  61 126.290  13.707   4.055
  491   1HG   GLU  61           HG2      GLU  61 125.626  12.517   6.761
  492   2HG   GLU  61           HG1      GLU  61 126.236  14.158   6.543
  493    H    TRP  62           HN       TRP  62 127.895  10.443   3.591
  494    HA   TRP  62           HA       TRP  62 128.094  11.290   0.872
  495   1HB   TRP  62           HB2      TRP  62 130.066  10.470   1.967
  496   2HB   TRP  62           HB1      TRP  62 129.284   8.942   2.365
  497    HD1  TRP  62           HD1      TRP  62 130.737  10.876  -0.614
  498    HE1  TRP  62           HE1      TRP  62 131.202   9.209  -2.526
  499    HE3  TRP  62           HE3      TRP  62 128.642   6.653   1.365
  500    HZ2  TRP  62           HZ2      TRP  62 130.738   6.443  -3.139
  501    HZ3  TRP  62           HZ3      TRP  62 128.675   4.524   0.100
  502    HH2  TRP  62           HH2      TRP  62 129.718   4.413  -2.145
  503    H    LEU  63           HN       LEU  63 126.845   8.255   2.273
  504    HA   LEU  63           HA       LEU  63 126.223   7.075  -0.266
  505   1HB   LEU  63           HB2      LEU  63 126.482   5.751   1.796
  506   2HB   LEU  63           HB1      LEU  63 125.056   6.530   2.478
  507    HG   LEU  63           HG       LEU  63 123.678   5.593   0.651
  508   1HD1  LEU  63          HD13      LEU  63 126.363   4.601  -0.276
  509   2HD1  LEU  63          HD12      LEU  63 124.921   3.652  -0.638
  510   3HD1  LEU  63          HD11      LEU  63 125.051   5.310  -1.216
  511   1HD2  LEU  63          HD23      LEU  63 125.370   3.671   2.260
  512   2HD2  LEU  63          HD22      LEU  63 123.772   4.298   2.665
  513   3HD2  LEU  63          HD21      LEU  63 123.960   3.157   1.333
  514    H    LYS  64           HN       LYS  64 124.207   8.788   2.113
  515    HA   LYS  64           HA       LYS  64 121.757   8.612   0.673
  516   1HB   LYS  64           HB2      LYS  64 121.901   9.332   3.040
  517   2HB   LYS  64           HB1      LYS  64 122.729  10.802   2.543
  518   1HG   LYS  64           HG2      LYS  64 120.458  11.434   2.882
  519   2HG   LYS  64           HG1      LYS  64 120.645  11.332   1.137
  520   1HD   LYS  64           HD2      LYS  64 119.565   9.173   1.075
  521   2HD   LYS  64           HD1      LYS  64 119.584   9.057   2.834
  522   1HE   LYS  64           HE2      LYS  64 118.178  11.331   1.431
  523   2HE   LYS  64           HE1      LYS  64 117.373   9.786   1.706
  524   1HZ   LYS  64           HZ2      LYS  64 118.740  10.837   4.017
  525   2HZ   LYS  64           HZ1      LYS  64 117.456  11.807   3.478
  526   3HZ   LYS  64           HZ3      LYS  64 117.178  10.184   3.882
  527    H    ASP  65           HN       ASP  65 124.228  11.158   0.707
  528    HA   ASP  65           HA       ASP  65 122.944  12.785  -1.287
  529   1HB   ASP  65           HB2      ASP  65 124.697  13.587   0.328
  530   2HB   ASP  65           HB1      ASP  65 125.894  12.683  -0.599
  531    H    THR  66           HN       THR  66 125.217  10.101  -1.424
  532    HA   THR  66           HA       THR  66 125.898  10.508  -4.198
  533    HB   THR  66           HB       THR  66 126.221   8.103  -2.388
  534    HG1  THR  66           HG1      THR  66 128.060  10.041  -3.335
  535   1HG2  THR  66          HG21      THR  66 127.205   8.658  -5.192
  536   2HG2  THR  66          HG23      THR  66 127.940   7.447  -4.143
  537   3HG2  THR  66          HG22      THR  66 126.256   7.279  -4.640
  538    H    CYS  67           HN       CYS  67 123.466   8.376  -2.581
  539    HA   CYS  67           HA       CYS  67 122.376   7.866  -5.341
  540   1HB   CYS  67           HB2      CYS  67 121.977   5.555  -4.772
  541   2HB   CYS  67           HB1      CYS  67 123.678   5.919  -4.481
  542    HG   CYS  67           HG       CYS  67 123.308   5.227  -2.140
  543    H    GLY  68           HN       GLY  68 121.652   8.201  -1.893
  544   1HA   GLY  68           HA2      GLY  68 119.554   9.353  -1.281
  545   2HA   GLY  68           HA1      GLY  68 118.763   8.548  -2.634
  546    H    ALA  69           HN       ALA  69 120.977   6.567  -0.878
  547    HA   ALA  69           HA       ALA  69 119.122   4.576  -0.214
  548   1HB   ALA  69           HB1      ALA  69 121.661   4.451  -0.019
  549   2HB   ALA  69           HB3      ALA  69 121.500   5.294   1.521
  550   3HB   ALA  69           HB2      ALA  69 120.769   3.703   1.306
  551    H    ASN  70           HN       ASN  70 117.989   4.082   1.811
  552    HA   ASN  70           HA       ASN  70 117.080   6.536   3.177
  553   1HB   ASN  70           HB2      ASN  70 116.174   3.675   3.599
  554   2HB   ASN  70           HB1      ASN  70 115.328   5.144   4.082
  555   1HD2  ASN  70          HD22      ASN  70 115.007   5.850   0.338
  556   2HD2  ASN  70          HD21      ASN  70 116.005   6.552   1.519
  557    H    ALA  71           HN       ALA  71 116.717   6.254   5.635
  558    HA   ALA  71           HA       ALA  71 119.233   6.037   6.926
  559   1HB   ALA  71           HB1      ALA  71 117.197   7.279   7.771
  560   2HB   ALA  71           HB3      ALA  71 116.535   5.720   8.261
  561   3HB   ALA  71           HB2      ALA  71 118.027   6.312   8.989
  562    H    LYS  72           HN       LYS  72 116.665   3.623   6.483
  563    HA   LYS  72           HA       LYS  72 117.858   1.728   8.323
  564   1HB   LYS  72           HB2      LYS  72 115.443   1.671   7.564
  565   2HB   LYS  72           HB1      LYS  72 116.019   1.083   6.003
  566   1HG   LYS  72           HG2      LYS  72 117.097  -0.837   7.116
  567   2HG   LYS  72           HG1      LYS  72 116.525  -0.255   8.679
  568   1HD   LYS  72           HD2      LYS  72 114.190  -0.477   7.908
  569   2HD   LYS  72           HD1      LYS  72 114.762  -1.064   6.347
  570   1HE   LYS  72           HE2      LYS  72 114.174  -2.987   7.699
  571   2HE   LYS  72           HE1      LYS  72 115.931  -2.936   7.555
  572   1HZ   LYS  72           HZ3      LYS  72 114.757  -1.500   9.801
  573   2HZ   LYS  72           HZ2      LYS  72 114.694  -3.197   9.871
  574   3HZ   LYS  72           HZ1      LYS  72 116.189  -2.406   9.721
  575    H    GLN  73           HN       GLN  73 118.064   2.264   4.836
  576    HA   GLN  73           HA       GLN  73 119.616  -0.068   4.234
  577   1HB   GLN  73           HB2      GLN  73 119.281   2.591   2.827
  578   2HB   GLN  73           HB1      GLN  73 120.204   1.249   2.150
  579   1HG   GLN  73           HG2      GLN  73 118.238  -0.185   2.184
  580   2HG   GLN  73           HG1      GLN  73 117.301   1.066   3.004
  581   1HE2  GLN  73          HE22      GLN  73 117.137   1.099  -0.906
  582   2HE2  GLN  73          HE21      GLN  73 117.345  -0.256   0.094
  583    H    SER  74           HN       SER  74 120.545   3.273   5.102
  584    HA   SER  74           HA       SER  74 123.332   2.903   4.598
  585   1HB   SER  74           HB2      SER  74 123.609   5.007   5.590
  586   2HB   SER  74           HB1      SER  74 121.942   5.078   5.023
  587    HG   SER  74           HG       SER  74 122.883   4.491   7.635
  588    H    ARG  75           HN       ARG  75 121.326   2.378   7.512
  589    HA   ARG  75           HA       ARG  75 123.483   1.920   9.309
  590   1HB   ARG  75           HB2      ARG  75 120.650   0.853   9.267
  591   2HB   ARG  75           HB1      ARG  75 121.777   0.524  10.585
  592   1HG   ARG  75           HG2      ARG  75 122.066   2.947  10.946
  593   2HG   ARG  75           HG1      ARG  75 120.937   3.280   9.634
  594   1HD   ARG  75           HD2      ARG  75 119.747   3.428  11.755
  595   2HD   ARG  75           HD1      ARG  75 119.182   2.005  10.878
  596    HE   ARG  75           HE       ARG  75 121.224   1.020  12.465
  597   1HH1  ARG  75          HH21      ARG  75 118.375   2.902  12.955
  598   2HH1  ARG  75          HH22      ARG  75 118.103   2.313  14.561
  599   1HH2  ARG  75          HH11      ARG  75 120.882   0.240  14.560
  600   2HH2  ARG  75          HH12      ARG  75 119.521   0.806  15.469
  601    H    ASP  76           HN       ASP  76 121.841  -0.296   7.045
  602    HA   ASP  76           HA       ASP  76 123.164  -2.653   7.981
  603   1HB   ASP  76           HB2      ASP  76 121.926  -1.948   5.312
  604   2HB   ASP  76           HB1      ASP  76 122.551  -3.553   5.694
  605    H    CYS  77           HN       CYS  77 124.077  -0.261   5.482
  606    HA   CYS  77           HA       CYS  77 126.316  -1.776   4.512
  607   1HB   CYS  77           HB2      CYS  77 125.667   1.179   4.453
  608   2HB   CYS  77           HB1      CYS  77 127.078   0.485   3.655
  609    HG   CYS  77           HG       CYS  77 124.127  -0.199   2.873
  610    H    PHE  78           HN       PHE  78 126.007   0.704   7.086
  611    HA   PHE  78           HA       PHE  78 128.795   1.004   7.545
  612   1HB   PHE  78           HB2      PHE  78 127.111   2.491   8.564
  613   2HB   PHE  78           HB1      PHE  78 126.553   1.159   9.580
  614    HD1  PHE  78           HD2      PHE  78 127.934   0.296  11.412
  615    HD2  PHE  78           HD1      PHE  78 129.282   3.544   8.943
  616    HE1  PHE  78           HE2      PHE  78 129.729   0.797  13.048
  617    HE2  PHE  78           HE1      PHE  78 131.077   4.043  10.578
  618    HZ   PHE  78           HZ       PHE  78 131.302   2.670  12.632
  619    H    GLY  79           HN       GLY  79 126.523  -1.026   9.444
  620   1HA   GLY  79           HA2      GLY  79 128.540  -2.382  10.903
  621   2HA   GLY  79           HA1      GLY  79 126.915  -3.006  10.625
  622    H    CYS  80           HN       CYS  80 127.212  -2.959   7.701
  623    HA   CYS  80           HA       CYS  80 128.350  -5.602   7.384
  624   1HB   CYS  80           HB2      CYS  80 126.500  -4.708   5.964
  625   2HB   CYS  80           HB1      CYS  80 127.645  -3.585   5.232
  626    HG   CYS  80           HG       CYS  80 127.445  -5.862   3.818
  627    H    LEU  81           HN       LEU  81 129.455  -2.350   6.233
  628    HA   LEU  81           HA       LEU  81 131.954  -3.444   5.258
  629   1HB   LEU  81           HB2      LEU  81 131.222  -0.589   5.982
  630   2HB   LEU  81           HB1      LEU  81 132.660  -1.078   5.089
  631    HG   LEU  81           HG       LEU  81 129.799  -1.561   4.196
  632   1HD1  LEU  81          HD12      LEU  81 131.901   0.437   3.304
  633   2HD1  LEU  81          HD11      LEU  81 130.400   0.123   2.431
  634   3HD1  LEU  81          HD13      LEU  81 130.348   0.801   4.058
  635   1HD2  LEU  81          HD21      LEU  81 132.502  -2.321   3.088
  636   2HD2  LEU  81          HD23      LEU  81 131.018  -3.273   3.156
  637   3HD2  LEU  81          HD22      LEU  81 131.177  -1.983   1.972
  638    H    ARG  82           HN       ARG  82 130.948  -1.858   8.287
  639    HA   ARG  82           HA       ARG  82 133.536  -1.631   9.425
  640   1HB   ARG  82           HB2      ARG  82 131.621  -0.486  10.408
  641   2HB   ARG  82           HB1      ARG  82 130.852  -2.024  10.774
  642   1HG   ARG  82           HG2      ARG  82 131.900  -1.063  12.789
  643   2HG   ARG  82           HG1      ARG  82 132.681  -2.574  12.347
  644   1HD   ARG  82           HD2      ARG  82 134.570  -1.414  11.407
  645   2HD   ARG  82           HD1      ARG  82 133.742   0.140  11.512
  646    HE   ARG  82           HE       ARG  82 133.822  -0.755  14.131
  647   1HH1  ARG  82          HH21      ARG  82 136.100  -0.337  11.575
  648   2HH1  ARG  82          HH22      ARG  82 137.417   0.043  12.634
  649   1HH2  ARG  82          HH11      ARG  82 135.533  -0.268  15.525
  650   2HH2  ARG  82          HH12      ARG  82 137.098   0.082  14.868
  651    H    GLU  83           HN       GLU  83 131.215  -4.319   9.507
  652    HA   GLU  83           HA       GLU  83 132.800  -5.932  11.290
  653   1HB   GLU  83           HB2      GLU  83 130.474  -6.478   9.458
  654   2HB   GLU  83           HB1      GLU  83 131.321  -7.820  10.227
  655   1HG   GLU  83           HG2      GLU  83 129.317  -6.944  11.513
  656   2HG   GLU  83           HG1      GLU  83 130.824  -6.990  12.424
  657    H    TRP  84           HN       TRP  84 132.661  -5.730   7.711
  658    HA   TRP  84           HA       TRP  84 134.300  -8.014   7.226
  659   1HB   TRP  84           HB2      TRP  84 133.034  -6.717   5.462
  660   2HB   TRP  84           HB1      TRP  84 134.266  -5.460   5.591
  661    HD1  TRP  84           HD1      TRP  84 133.734  -9.041   4.409
  662    HE1  TRP  84           HE1      TRP  84 135.758  -9.763   2.985
  663    HE3  TRP  84           HE3      TRP  84 136.815  -5.039   5.160
  664    HZ2  TRP  84           HZ2      TRP  84 138.345  -8.777   2.265
  665    HZ3  TRP  84           HZ3      TRP  84 139.051  -4.957   4.099
  666    HH2  TRP  84           HH2      TRP  84 139.817  -6.819   2.658
  667    H    CYS  85           HN       CYS  85 135.106  -4.582   7.728
  668    HA   CYS  85           HA       CYS  85 137.929  -4.839   7.466
  669   1HB   CYS  85           HB2      CYS  85 136.200  -2.923   9.051
  670   2HB   CYS  85           HB1      CYS  85 137.954  -2.770   8.974
  671    HG   CYS  85           HG       CYS  85 136.049  -1.928   6.794
  672    H    ASP  86           HN       ASP  86 135.784  -5.253  10.253
  673    HA   ASP  86           HA       ASP  86 137.777  -5.598  12.248
  674   1HB   ASP  86           HB2      ASP  86 134.974  -6.712  11.999
  675   2HB   ASP  86           HB1      ASP  86 135.974  -6.937  13.435
  676    H    ALA  87           HN       ALA  87 136.425  -7.897   9.909
  677    HA   ALA  87           HA       ALA  87 137.885 -10.143  11.146
  678   1HB   ALA  87           HB1      ALA  87 135.591 -10.324  10.010
  679   2HB   ALA  87           HB3      ALA  87 136.459 -10.179   8.480
  680   3HB   ALA  87           HB2      ALA  87 136.792 -11.533   9.558
  681    H    PHE  88           HN       PHE  88 138.168  -8.064   8.293
  682    HA   PHE  88           HA       PHE  88 140.660  -9.527   7.511
  683   1HB   PHE  88           HB2      PHE  88 138.909  -7.569   6.004
  684   2HB   PHE  88           HB1      PHE  88 140.420  -8.231   5.377
  685    HD1  PHE  88           HD2      PHE  88 140.658 -10.707   5.048
  686    HD2  PHE  88           HD1      PHE  88 136.901  -8.882   6.044
  687    HE1  PHE  88           HE2      PHE  88 139.469 -12.763   4.338
  688    HE2  PHE  88           HE1      PHE  88 135.711 -10.939   5.337
  689    HZ   PHE  88           HZ       PHE  88 136.998 -12.878   4.486
  690    H    LEU  89           HN       LEU  89 139.939  -6.139   6.794
  691    HA   LEU  89           HA       LEU  89 142.587  -5.398   7.864
  692   1HB   LEU  89           HB2      LEU  89 141.954  -4.452   5.714
  693   2HB   LEU  89           HB1      LEU  89 140.453  -3.824   6.386
  694    HG   LEU  89           HG       LEU  89 141.674  -2.277   7.815
  695   1HD1  LEU  89          HD13      LEU  89 144.068  -3.820   6.817
  696   2HD1  LEU  89          HD12      LEU  89 144.248  -2.161   7.382
  697   3HD1  LEU  89          HD11      LEU  89 143.636  -3.401   8.474
  698   1HD2  LEU  89          HD21      LEU  89 141.278  -1.796   5.311
  699   2HD2  LEU  89          HD23      LEU  89 142.472  -0.797   6.139
  700   3HD2  LEU  89          HD22      LEU  89 142.999  -2.122   5.101
  701   1H    MET   1           HT3      MET   1 169.600  -4.410  -3.204
  702   2H    MET   1           HT2      MET   1 170.844  -4.863  -4.269
  703   3H    MET   1           HT1      MET   1 169.856  -3.529  -4.630
  704    HA   MET   1           HA       MET   1 168.439  -4.816  -5.711
  705   1HB   MET   1           HB2      MET   1 170.337  -6.989  -4.784
  706   2HB   MET   1           HB1      MET   1 169.014  -7.278  -5.912
  707   1HG   MET   1           HG2      MET   1 169.944  -5.585  -7.447
  708   2HG   MET   1           HG1      MET   1 171.270  -5.293  -6.323
  709   1HE   MET   1           HE1      MET   1 172.820  -6.832  -5.507
  710   2HE   MET   1           HE3      MET   1 172.090  -8.433  -5.334
  711   3HE   MET   1           HE2      MET   1 173.496  -8.210  -6.369
  712    H    THR   2           HN       THR   2 169.290  -6.744  -2.807
  713    HA   THR   2           HA       THR   2 166.640  -7.764  -2.435
  714    HB   THR   2           HB       THR   2 168.773  -7.364  -0.318
  715    HG1  THR   2           HG1      THR   2 169.233  -9.600  -0.946
  716   1HG2  THR   2          HG23      THR   2 166.528  -7.968   0.522
  717   2HG2  THR   2          HG22      THR   2 166.500  -9.355  -0.566
  718   3HG2  THR   2          HG21      THR   2 167.674  -9.290   0.748
  719    H    THR   3           HN       THR   3 164.904  -6.937  -1.299
  720    HA   THR   3           HA       THR   3 164.930  -4.086  -0.693
  721    HB   THR   3           HB       THR   3 162.564  -4.444  -0.078
  722    HG1  THR   3           HG1      THR   3 162.870  -6.512   0.859
  723   1HG2  THR   3          HG22      THR   3 163.533  -5.797  -2.605
  724   2HG2  THR   3          HG21      THR   3 161.832  -5.451  -2.285
  725   3HG2  THR   3          HG23      THR   3 162.991  -4.128  -2.419
  726    H    SER   4           HN       SER   4 164.004  -3.343   1.483
  727    HA   SER   4           HA       SER   4 165.716  -4.304   3.601
  728   1HB   SER   4           HB2      SER   4 164.618  -2.643   4.980
  729   2HB   SER   4           HB1      SER   4 164.872  -1.943   3.384
  730    HG   SER   4           HG       SER   4 162.746  -1.589   4.127
  731    H    GLN   5           HN       GLN   5 164.873  -5.056   5.710
  732    HA   GLN   5           HA       GLN   5 163.268  -7.413   5.424
  733   1HB   GLN   5           HB2      GLN   5 164.187  -5.861   7.862
  734   2HB   GLN   5           HB1      GLN   5 163.356  -7.416   7.951
  735   1HG   GLN   5           HG2      GLN   5 165.125  -8.447   6.576
  736   2HG   GLN   5           HG1      GLN   5 165.961  -6.897   6.488
  737   1HE2  GLN   5          HE22      GLN   5 166.079  -7.331  10.353
  738   2HE2  GLN   5          HE21      GLN   5 164.932  -6.481   9.436
  739    H    LYS   6           HN       LYS   6 162.425  -4.088   6.006
  740    HA   LYS   6           HA       LYS   6 159.967  -4.466   7.408
  741   1HB   LYS   6           HB2      LYS   6 160.773  -2.296   5.451
  742   2HB   LYS   6           HB1      LYS   6 159.401  -2.210   6.551
  743   1HG   LYS   6           HG2      LYS   6 162.210  -2.687   7.555
  744   2HG   LYS   6           HG1      LYS   6 161.588  -1.062   7.297
  745   1HD   LYS   6           HD2      LYS   6 159.633  -1.694   8.805
  746   2HD   LYS   6           HD1      LYS   6 160.532  -3.156   9.212
  747   1HE   LYS   6           HE2      LYS   6 162.403  -1.829  10.035
  748   2HE   LYS   6           HE1      LYS   6 161.602  -0.341   9.536
  749   1HZ   LYS   6           HZ2      LYS   6 160.382  -2.249  11.444
  750   2HZ   LYS   6           HZ1      LYS   6 161.374  -0.963  11.945
  751   3HZ   LYS   6           HZ3      LYS   6 159.922  -0.644  11.130
  752    H    HIS   7           HN       HIS   7 160.802  -4.487   3.962
  753    HA   HIS   7           HA       HIS   7 158.166  -4.457   2.920
  754   1HB   HIS   7           HB2      HIS   7 160.110  -4.171   1.475
  755   2HB   HIS   7           HB1      HIS   7 160.664  -5.802   1.847
  756    HD2  HIS   7           HD2      HIS   7 159.421  -7.837   0.364
  757    HE1  HIS   7           HE1      HIS   7 156.708  -5.369  -1.725
  758    HE2  HIS   7           HE2      HIS   7 157.634  -7.720  -1.531
  759    H    ARG   8           HN       ARG   8 160.219  -7.303   3.656
  760    HA   ARG   8           HA       ARG   8 158.141  -9.194   3.049
  761   1HB   ARG   8           HB2      ARG   8 160.728  -9.397   4.617
  762   2HB   ARG   8           HB1      ARG   8 159.680 -10.782   4.298
  763   1HG   ARG   8           HG2      ARG   8 159.884 -10.385   1.870
  764   2HG   ARG   8           HG1      ARG   8 160.931  -9.001   2.185
  765   1HD   ARG   8           HD2      ARG   8 161.518 -11.863   3.000
  766   2HD   ARG   8           HD1      ARG   8 162.256 -11.017   1.641
  767    HE   ARG   8           HE       ARG   8 162.758  -9.373   3.829
  768   1HH1  ARG   8          HH21      ARG   8 163.277 -12.674   2.974
  769   2HH1  ARG   8          HH22      ARG   8 164.706 -12.835   3.938
  770   1HH2  ARG   8          HH11      ARG   8 164.621  -9.568   5.092
  771   2HH2  ARG   8          HH12      ARG   8 165.467 -11.078   5.137
  772    H    ASP   9           HN       ASP   9 159.120  -7.466   5.931
  773    HA   ASP   9           HA       ASP   9 157.556  -9.072   7.770
  774   1HB   ASP   9           HB2      ASP   9 158.764  -6.317   7.993
  775   2HB   ASP   9           HB1      ASP   9 157.899  -7.097   9.311
  776    H    PHE  10           HN       PHE  10 156.978  -6.040   5.987
  777    HA   PHE  10           HA       PHE  10 154.481  -5.457   7.290
  778   1HB   PHE  10           HB2      PHE  10 155.884  -3.837   5.946
  779   2HB   PHE  10           HB1      PHE  10 155.306  -4.646   4.490
  780    HD1  PHE  10           HD1      PHE  10 154.366  -2.531   7.356
  781    HD2  PHE  10           HD2      PHE  10 152.981  -4.443   3.766
  782    HE1  PHE  10           HE1      PHE  10 152.297  -1.162   7.425
  783    HE2  PHE  10           HE2      PHE  10 150.910  -3.076   3.836
  784    HZ   PHE  10           HZ       PHE  10 150.570  -1.434   5.666
  785    H    VAL  11           HN       VAL  11 155.275  -7.265   4.319
  786    HA   VAL  11           HA       VAL  11 152.431  -7.748   3.753
  787    HB   VAL  11           HB       VAL  11 153.272  -9.091   1.882
  788   1HG1  VAL  11          HG11      VAL  11 154.820  -6.513   2.288
  789   2HG1  VAL  11          HG13      VAL  11 154.571  -7.315   0.738
  790   3HG1  VAL  11          HG12      VAL  11 153.195  -6.645   1.615
  791   1HG2  VAL  11          HG22      VAL  11 155.897  -8.710   3.329
  792   2HG2  VAL  11          HG21      VAL  11 155.146 -10.222   2.822
  793   3HG2  VAL  11          HG23      VAL  11 155.832  -9.131   1.618
  794    H    ALA  12           HN       ALA  12 153.953  -8.783   6.275
  795    HA   ALA  12           HA       ALA  12 153.132 -11.664   6.005
  796   1HB   ALA  12           HB1      ALA  12 155.576 -11.365   6.280
  797   2HB   ALA  12           HB3      ALA  12 155.285 -10.489   7.782
  798   3HB   ALA  12           HB2      ALA  12 154.854 -12.194   7.659
  799    H    GLU  13           HN       GLU  13 152.336  -8.739   7.497
  800    HA   GLU  13           HA       GLU  13 150.597 -10.177   9.379
  801   1HB   GLU  13           HB2      GLU  13 151.361  -8.710  11.311
  802   2HB   GLU  13           HB1      GLU  13 152.504  -9.960  10.817
  803   1HG   GLU  13           HG2      GLU  13 153.741  -8.322   9.479
  804   2HG   GLU  13           HG1      GLU  13 152.589  -7.064   9.920
  805    HA   PRO  14           HA       PRO  14 147.639  -6.993   8.388
  806   1HB   PRO  14           HB2      PRO  14 147.446  -6.567  11.360
  807   2HB   PRO  14           HB1      PRO  14 146.148  -6.767  10.165
  808   1HG   PRO  14           HG2      PRO  14 146.915  -8.763  11.800
  809   2HG   PRO  14           HG1      PRO  14 146.326  -9.055  10.153
  810   1HD   PRO  14           HD2      PRO  14 149.080  -9.335  11.215
  811   2HD   PRO  14           HD1      PRO  14 148.357 -10.037   9.751
  812    H    MET  15           HN       MET  15 147.393  -4.602   8.533
  813    HA   MET  15           HA       MET  15 149.991  -3.295   9.119
  814   1HB   MET  15           HB2      MET  15 148.816  -1.304   8.018
  815   2HB   MET  15           HB1      MET  15 149.127  -2.705   6.994
  816   1HG   MET  15           HG2      MET  15 146.864  -3.421   7.097
  817   2HG   MET  15           HG1      MET  15 146.511  -2.361   8.461
  818   1HE   MET  15           HE2      MET  15 148.226  -2.125   4.956
  819   2HE   MET  15           HE1      MET  15 146.630  -2.811   4.665
  820   3HE   MET  15           HE3      MET  15 147.038  -1.206   4.041
  821    H    GLY  16           HN       GLY  16 146.812  -3.579  10.456
  822   1HA   GLY  16           HA2      GLY  16 145.800  -2.554  12.312
  823   2HA   GLY  16           HA1      GLY  16 147.446  -2.403  12.928
  824    H    GLU  17           HN       GLU  17 147.371  -0.324  13.737
  825    HA   GLU  17           HA       GLU  17 146.450   1.880  11.939
  826   1HB   GLU  17           HB2      GLU  17 146.927   1.734  14.928
  827   2HB   GLU  17           HB1      GLU  17 146.556   3.233  14.074
  828   1HG   GLU  17           HG2      GLU  17 144.446   2.258  13.260
  829   2HG   GLU  17           HG1      GLU  17 144.814   0.750  14.100
  830    H    LYS  18           HN       LYS  18 149.076   0.538  11.624
  831    HA   LYS  18           HA       LYS  18 151.176   2.048  12.781
  832   1HB   LYS  18           HB2      LYS  18 150.969   0.531  10.170
  833   2HB   LYS  18           HB1      LYS  18 152.472   1.285  10.699
  834   1HG   LYS  18           HG2      LYS  18 152.318  -0.005  12.835
  835   2HG   LYS  18           HG1      LYS  18 150.891  -0.823  12.197
  836   1HD   LYS  18           HD2      LYS  18 152.352  -1.495  10.201
  837   2HD   LYS  18           HD1      LYS  18 153.728  -0.960  11.165
  838   1HE   LYS  18           HE2      LYS  18 152.946  -2.502  13.000
  839   2HE   LYS  18           HE1      LYS  18 151.740  -3.130  11.878
  840   1HZ   LYS  18           HZ2      LYS  18 154.223  -3.099  10.588
  841   2HZ   LYS  18           HZ1      LYS  18 154.430  -3.847  12.099
  842   3HZ   LYS  18           HZ3      LYS  18 153.274  -4.443  11.011
  843    HA   PRO  19           HA       PRO  19 150.808   5.964  10.737
  844   1HB   PRO  19           HB2      PRO  19 153.443   6.777  10.638
  845   2HB   PRO  19           HB1      PRO  19 152.464   6.786  12.118
  846   1HG   PRO  19           HG2      PRO  19 154.474   4.779  11.196
  847   2HG   PRO  19           HG1      PRO  19 154.194   5.430  12.822
  848   1HD   PRO  19           HD2      PRO  19 153.279   2.978  12.062
  849   2HD   PRO  19           HD1      PRO  19 152.416   3.989  13.241
  850    H    VAL  20           HN       VAL  20 151.226   7.082   8.735
  851    HA   VAL  20           HA       VAL  20 151.337   5.468   6.433
  852    HB   VAL  20           HB       VAL  20 150.429   7.725   6.365
  853   1HG1  VAL  20          HG12      VAL  20 152.130   8.638   8.020
  854   2HG1  VAL  20          HG11      VAL  20 153.265   8.741   6.675
  855   3HG1  VAL  20          HG13      VAL  20 151.780   9.690   6.650
  856   1HG2  VAL  20          HG23      VAL  20 151.594   6.654   4.318
  857   2HG2  VAL  20          HG22      VAL  20 151.295   8.390   4.261
  858   3HG2  VAL  20          HG21      VAL  20 152.909   7.786   4.636
  859    H    GLY  21           HN       GLY  21 153.955   7.263   8.023
  860   1HA   GLY  21           HA2      GLY  21 155.971   6.767   6.081
  861   2HA   GLY  21           HA1      GLY  21 156.276   7.150   7.772
  862    H    SER  22           HN       SER  22 154.364   4.490   7.966
  863    HA   SER  22           HA       SER  22 156.681   2.762   8.463
  864   1HB   SER  22           HB2      SER  22 154.657   2.748   9.935
  865   2HB   SER  22           HB1      SER  22 153.723   2.102   8.589
  866    HG   SER  22           HG       SER  22 155.299   0.813  10.319
  867    H    LEU  23           HN       LEU  23 154.436   3.340   5.888
  868    HA   LEU  23           HA       LEU  23 154.597   0.767   4.617
  869   1HB   LEU  23           HB2      LEU  23 154.096   3.506   3.420
  870   2HB   LEU  23           HB1      LEU  23 153.842   1.977   2.579
  871    HG   LEU  23           HG       LEU  23 152.489   2.721   5.189
  872   1HD1  LEU  23          HD12      LEU  23 151.433   2.839   2.347
  873   2HD1  LEU  23          HD11      LEU  23 150.477   3.113   3.804
  874   3HD1  LEU  23          HD13      LEU  23 151.777   4.225   3.382
  875   1HD2  LEU  23          HD21      LEU  23 152.361   0.358   3.319
  876   2HD2  LEU  23          HD23      LEU  23 152.360   0.388   5.082
  877   3HD2  LEU  23          HD22      LEU  23 150.906   0.829   4.193
  878    H    ALA  24           HN       ALA  24 156.022  -0.019   3.140
  879    HA   ALA  24           HA       ALA  24 158.719   0.956   3.183
  880   1HB   ALA  24           HB2      ALA  24 157.791  -1.421   2.608
  881   2HB   ALA  24           HB1      ALA  24 157.674  -0.796   0.963
  882   3HB   ALA  24           HB3      ALA  24 159.239  -0.849   1.779
  883    H    GLY  25           HN       GLY  25 159.768   2.367   1.877
  884   1HA   GLY  25           HA2      GLY  25 160.154   3.473  -0.280
  885   2HA   GLY  25           HA1      GLY  25 158.432   3.335  -0.624
  886    H    ILE  26           HN       ILE  26 157.905   4.215   2.283
  887    HA   ILE  26           HA       ILE  26 158.108   7.145   1.717
  888    HB   ILE  26           HB       ILE  26 156.560   5.784   3.937
  889   1HG1  ILE  26          HG12      ILE  26 155.711   4.868   1.862
  890   2HG1  ILE  26          HG11      ILE  26 154.574   6.097   2.412
  891   1HG2  ILE  26          HG23      ILE  26 157.040   8.230   4.119
  892   2HG2  ILE  26          HG22      ILE  26 156.222   8.473   2.574
  893   3HG2  ILE  26          HG21      ILE  26 155.317   7.881   3.969
  894   1HD1  ILE  26          HD12      ILE  26 155.897   7.729   0.903
  895   2HD1  ILE  26          HD11      ILE  26 156.591   6.282   0.174
  896   3HD1  ILE  26          HD13      ILE  26 154.852   6.554   0.107
  897    H    GLY  27           HN       GLY  27 159.794   8.218   2.720
  898   1HA   GLY  27           HA2      GLY  27 161.097   6.933   5.053
  899   2HA   GLY  27           HA1      GLY  27 161.734   8.292   4.126
  900    H    GLU  28           HN       GLU  28 161.884   8.741   6.719
  901    HA   GLU  28           HA       GLU  28 159.592   9.656   8.103
  902   1HB   GLU  28           HB2      GLU  28 162.477  10.564   8.260
  903   2HB   GLU  28           HB1      GLU  28 161.227  11.108   9.381
  904   1HG   GLU  28           HG2      GLU  28 160.770   8.758  10.003
  905   2HG   GLU  28           HG1      GLU  28 162.039   8.226   8.899
  906    H    VAL  29           HN       VAL  29 161.724  11.400   5.844
  907    HA   VAL  29           HA       VAL  29 160.477  13.963   6.219
  908    HB   VAL  29           HB       VAL  29 162.019  12.798   3.884
  909   1HG1  VAL  29          HG13      VAL  29 160.902  15.560   4.366
  910   2HG1  VAL  29          HG12      VAL  29 162.323  15.314   3.350
  911   3HG1  VAL  29          HG11      VAL  29 160.787  14.565   2.915
  912   1HG2  VAL  29          HG22      VAL  29 162.748  14.588   6.215
  913   2HG2  VAL  29          HG21      VAL  29 163.396  12.991   5.845
  914   3HG2  VAL  29          HG23      VAL  29 163.791  14.364   4.811
  915    H    LEU  30           HN       LEU  30 159.974  11.391   3.827
  916    HA   LEU  30           HA       LEU  30 157.891  12.726   2.380
  917   1HB   LEU  30           HB2      LEU  30 158.395   9.754   2.714
  918   2HB   LEU  30           HB1      LEU  30 157.378  10.486   1.474
  919    HG   LEU  30           HG       LEU  30 160.351  10.991   1.823
  920   1HD1  LEU  30          HD11      LEU  30 158.758   9.274  -0.093
  921   2HD1  LEU  30          HD13      LEU  30 160.418   9.772  -0.418
  922   3HD1  LEU  30          HD12      LEU  30 160.058   8.769   0.987
  923   1HD2  LEU  30          HD23      LEU  30 158.242  12.095  -0.033
  924   2HD2  LEU  30          HD22      LEU  30 159.545  12.945   0.799
  925   3HD2  LEU  30          HD21      LEU  30 159.905  11.941  -0.600
  926    H    GLY  31           HN       GLY  31 157.873  10.588   5.186
  927   1HA   GLY  31           HA2      GLY  31 155.063  10.151   5.333
  928   2HA   GLY  31           HA1      GLY  31 156.158  10.112   6.716
  929    H    LYS  32           HN       LYS  32 157.090  12.802   6.549
  930    HA   LYS  32           HA       LYS  32 155.046  14.140   8.032
  931   1HB   LYS  32           HB2      LYS  32 157.500  14.603   8.196
  932   2HB   LYS  32           HB1      LYS  32 157.420  15.383   6.616
  933   1HG   LYS  32           HG2      LYS  32 155.767  16.994   7.490
  934   2HG   LYS  32           HG1      LYS  32 155.850  16.217   9.072
  935   1HD   LYS  32           HD2      LYS  32 158.246  16.755   9.229
  936   2HD   LYS  32           HD1      LYS  32 158.188  17.513   7.637
  937   1HE   LYS  32           HE2      LYS  32 156.559  19.161   8.469
  938   2HE   LYS  32           HE1      LYS  32 156.584  18.395  10.057
  939   1HZ   LYS  32           HZ3      LYS  32 159.078  18.803   9.973
  940   2HZ   LYS  32           HZ2      LYS  32 158.751  19.871   8.693
  941   3HZ   LYS  32           HZ1      LYS  32 158.081  20.152  10.228
  942    H    LYS  33           HN       LYS  33 156.009  14.451   4.592
  943    HA   LYS  33           HA       LYS  33 154.259  16.674   4.080
  944   1HB   LYS  33           HB2      LYS  33 155.417  14.568   2.242
  945   2HB   LYS  33           HB1      LYS  33 154.465  15.936   1.666
  946   1HG   LYS  33           HG2      LYS  33 156.060  17.494   2.714
  947   2HG   LYS  33           HG1      LYS  33 157.019  16.129   3.289
  948   1HD   LYS  33           HD2      LYS  33 157.390  15.404   0.958
  949   2HD   LYS  33           HD1      LYS  33 156.436  16.770   0.380
  950   1HE   LYS  33           HE2      LYS  33 159.085  16.847   1.838
  951   2HE   LYS  33           HE1      LYS  33 158.720  17.460   0.224
  952   1HZ   LYS  33           HZ3      LYS  33 157.142  19.023   1.297
  953   2HZ   LYS  33           HZ2      LYS  33 157.721  18.515   2.811
  954   3HZ   LYS  33           HZ1      LYS  33 158.763  19.293   1.719
  955    H    LEU  34           HN       LEU  34 153.803  13.165   3.529
  956    HA   LEU  34           HA       LEU  34 151.131  13.392   2.558
  957   1HB   LEU  34           HB2      LEU  34 152.558  11.144   4.004
  958   2HB   LEU  34           HB1      LEU  34 150.943  10.979   3.334
  959    HG   LEU  34           HG       LEU  34 153.203  11.967   1.598
  960   1HD1  LEU  34          HD11      LEU  34 152.490   9.089   2.233
  961   2HD1  LEU  34          HD13      LEU  34 153.483   9.580   0.861
  962   3HD1  LEU  34          HD12      LEU  34 154.041   9.882   2.507
  963   1HD2  LEU  34          HD23      LEU  34 150.567  10.530   1.103
  964   2HD2  LEU  34          HD22      LEU  34 150.989  12.171   0.621
  965   3HD2  LEU  34          HD21      LEU  34 151.777  10.799  -0.148
  966    H    GLU  35           HN       GLU  35 152.448  13.099   5.820
  967    HA   GLU  35           HA       GLU  35 149.978  12.789   7.210
  968   1HB   GLU  35           HB2      GLU  35 152.181  12.491   8.285
  969   2HB   GLU  35           HB1      GLU  35 152.494  14.219   8.125
  970   1HG   GLU  35           HG2      GLU  35 150.577  14.731   9.567
  971   2HG   GLU  35           HG1      GLU  35 150.186  13.014   9.684
  972    H    GLU  36           HN       GLU  36 151.731  15.773   6.332
  973    HA   GLU  36           HA       GLU  36 149.822  17.564   7.507
  974   1HB   GLU  36           HB2      GLU  36 152.113  18.255   6.833
  975   2HB   GLU  36           HB1      GLU  36 151.668  18.036   5.141
  976   1HG   GLU  36           HG2      GLU  36 149.917  19.755   5.368
  977   2HG   GLU  36           HG1      GLU  36 150.335  19.965   7.067
  978    H    ARG  37           HN       ARG  37 149.768  15.633   4.662
  979    HA   ARG  37           HA       ARG  37 147.691  17.289   3.358
  980   1HB   ARG  37           HB2      ARG  37 149.045  14.699   2.584
  981   2HB   ARG  37           HB1      ARG  37 147.754  15.436   1.632
  982   1HG   ARG  37           HG2      ARG  37 149.075  17.507   1.459
  983   2HG   ARG  37           HG1      ARG  37 150.375  16.766   2.385
  984   1HD   ARG  37           HD2      ARG  37 150.332  14.914   0.572
  985   2HD   ARG  37           HD1      ARG  37 149.408  16.064  -0.390
  986    HE   ARG  37           HE       ARG  37 152.242  16.072  -0.032
  987   1HH1  ARG  37          HH21      ARG  37 149.561  18.250  -0.018
  988   2HH1  ARG  37          HH22      ARG  37 150.551  19.663  -0.132
  989   1HH2  ARG  37          HH11      ARG  37 153.530  17.902  -0.202
  990   2HH2  ARG  37          HH12      ARG  37 152.790  19.468  -0.245
  991    H    GLY  38           HN       GLY  38 147.609  15.147   5.880
  992   1HA   GLY  38           HA2      GLY  38 145.452  14.635   6.885
  993   2HA   GLY  38           HA1      GLY  38 144.747  14.502   5.282
  994    H    PHE  39           HN       PHE  39 147.716  12.903   5.249
  995    HA   PHE  39           HA       PHE  39 146.330  10.275   5.683
  996   1HB   PHE  39           HB2      PHE  39 148.904  10.922   4.236
  997   2HB   PHE  39           HB1      PHE  39 148.177   9.326   4.352
  998    HD1  PHE  39           HD2      PHE  39 146.081   8.816   3.160
  999    HD2  PHE  39           HD1      PHE  39 147.995  12.634   2.792
 1000    HE1  PHE  39           HE2      PHE  39 144.676   9.326   1.179
 1001    HE2  PHE  39           HE1      PHE  39 146.599  13.150   0.813
 1002    HZ   PHE  39           HZ       PHE  39 144.934  11.496   0.004
 1003    H    ASP  40           HN       ASP  40 146.643  10.810   8.052
 1004    HA   ASP  40           HA       ASP  40 149.391  10.785   9.060
 1005   1HB   ASP  40           HB2      ASP  40 148.382  10.917  11.261
 1006   2HB   ASP  40           HB1      ASP  40 147.537  12.031  10.186
 1007    H    LYS  41           HN       LYS  41 147.218   8.359   8.062
 1008    HA   LYS  41           HA       LYS  41 148.857   6.307   9.498
 1009   1HB   LYS  41           HB2      LYS  41 145.839   6.407   9.286
 1010   2HB   LYS  41           HB1      LYS  41 146.744   4.982   9.807
 1011   1HG   LYS  41           HG2      LYS  41 147.765   6.282  11.632
 1012   2HG   LYS  41           HG1      LYS  41 146.875   7.715  11.118
 1013   1HD   LYS  41           HD2      LYS  41 144.747   6.388  11.454
 1014   2HD   LYS  41           HD1      LYS  41 145.736   5.135  12.208
 1015   1HE   LYS  41           HE2      LYS  41 145.645   8.024  13.114
 1016   2HE   LYS  41           HE1      LYS  41 144.744   6.712  13.872
 1017   1HZ   LYS  41           HZ2      LYS  41 147.028   5.590  14.036
 1018   2HZ   LYS  41           HZ1      LYS  41 147.659   7.147  13.784
 1019   3HZ   LYS  41           HZ3      LYS  41 146.667   6.843  15.126
 1020    H    ALA  42           HN       ALA  42 148.905   4.244   8.435
 1021    HA   ALA  42           HA       ALA  42 149.247   4.445   5.611
 1022   1HB   ALA  42           HB3      ALA  42 149.106   2.062   7.461
 1023   2HB   ALA  42           HB2      ALA  42 149.531   1.944   5.753
 1024   3HB   ALA  42           HB1      ALA  42 150.552   2.869   6.854
 1025    H    TYR  43           HN       TYR  43 146.559   2.954   7.480
 1026    HA   TYR  43           HA       TYR  43 145.362   1.726   5.222
 1027   1HB   TYR  43           HB2      TYR  43 143.354   1.454   6.491
 1028   2HB   TYR  43           HB1      TYR  43 144.715   1.239   7.581
 1029    HD1  TYR  43           HD1      TYR  43 142.228   3.789   6.407
 1030    HD2  TYR  43           HD2      TYR  43 144.871   2.519   9.549
 1031    HE1  TYR  43           HE1      TYR  43 141.286   5.526   7.898
 1032    HE2  TYR  43           HE2      TYR  43 143.923   4.254  11.040
 1033    HH   TYR  43           HH       TYR  43 141.069   5.854  10.424
 1034    H    VAL  44           HN       VAL  44 145.439   5.107   5.982
 1035    HA   VAL  44           HA       VAL  44 143.051   5.725   4.379
 1036    HB   VAL  44           HB       VAL  44 145.317   7.562   5.251
 1037   1HG1  VAL  44          HG12      VAL  44 143.812   8.321   3.327
 1038   2HG1  VAL  44          HG11      VAL  44 142.475   8.273   4.473
 1039   3HG1  VAL  44          HG13      VAL  44 143.824   9.375   4.738
 1040   1HG2  VAL  44          HG22      VAL  44 142.660   6.861   6.534
 1041   2HG2  VAL  44          HG21      VAL  44 144.272   6.651   7.221
 1042   3HG2  VAL  44          HG23      VAL  44 143.616   8.271   6.993
 1043    H    VAL  45           HN       VAL  45 146.470   5.423   3.996
 1044    HA   VAL  45           HA       VAL  45 146.594   6.478   1.268
 1045    HB   VAL  45           HB       VAL  45 148.549   4.803   2.877
 1046   1HG1  VAL  45          HG11      VAL  45 148.740   6.034   0.121
 1047   2HG1  VAL  45          HG13      VAL  45 150.168   5.613   1.068
 1048   3HG1  VAL  45          HG12      VAL  45 149.031   4.357   0.582
 1049   1HG2  VAL  45          HG22      VAL  45 148.309   7.750   2.234
 1050   2HG2  VAL  45          HG21      VAL  45 148.368   6.989   3.824
 1051   3HG2  VAL  45          HG23      VAL  45 149.811   7.029   2.812
 1052    H    LEU  46           HN       LEU  46 146.362   3.290   2.801
 1053    HA   LEU  46           HA       LEU  46 146.626   1.712   0.439
 1054   1HB   LEU  46           HB2      LEU  46 146.623   0.737   2.734
 1055   2HB   LEU  46           HB1      LEU  46 144.925   1.172   2.903
 1056    HG   LEU  46           HG       LEU  46 144.449  -0.261   0.862
 1057   1HD1  LEU  46          HD13      LEU  46 147.384  -0.830   1.202
 1058   2HD1  LEU  46          HD12      LEU  46 146.317  -2.053   0.516
 1059   3HD1  LEU  46          HD11      LEU  46 146.480  -0.486  -0.273
 1060   1HD2  LEU  46          HD22      LEU  46 144.764  -1.044   3.556
 1061   2HD2  LEU  46          HD21      LEU  46 143.886  -1.904   2.299
 1062   3HD2  LEU  46          HD23      LEU  46 145.567  -2.307   2.625
 1063    H    GLY  47           HN       GLY  47 143.897   3.368   1.932
 1064   1HA   GLY  47           HA2      GLY  47 141.822   2.357   0.259
 1065   2HA   GLY  47           HA1      GLY  47 141.773   3.917   1.080
 1066    H    GLN  48           HN       GLN  48 144.040   5.123  -0.187
 1067    HA   GLN  48           HA       GLN  48 142.846   6.144  -2.569
 1068   1HB   GLN  48           HB2      GLN  48 144.688   7.225  -1.177
 1069   2HB   GLN  48           HB1      GLN  48 145.813   6.107  -1.947
 1070   1HG   GLN  48           HG2      GLN  48 145.937   8.044  -3.294
 1071   2HG   GLN  48           HG1      GLN  48 144.848   6.985  -4.187
 1072   1HE2  GLN  48          HE22      GLN  48 142.267   9.228  -2.201
 1073   2HE2  GLN  48          HE21      GLN  48 143.009   7.820  -1.608
 1074    H    PHE  49           HN       PHE  49 145.276   3.616  -2.032
 1075    HA   PHE  49           HA       PHE  49 145.888   3.037  -4.757
 1076   1HB   PHE  49           HB2      PHE  49 147.171   2.175  -2.818
 1077   2HB   PHE  49           HB1      PHE  49 145.797   1.178  -2.355
 1078    HD1  PHE  49           HD1      PHE  49 147.940   1.882  -5.350
 1079    HD2  PHE  49           HD2      PHE  49 145.772  -1.050  -3.079
 1080    HE1  PHE  49           HE1      PHE  49 148.775   0.099  -6.856
 1081    HE2  PHE  49           HE2      PHE  49 146.602  -2.833  -4.590
 1082    HZ   PHE  49           HZ       PHE  49 148.105  -2.259  -6.477
 1083    H    LEU  50           HN       LEU  50 143.365   1.897  -2.583
 1084    HA   LEU  50           HA       LEU  50 142.205   0.005  -4.450
 1085   1HB   LEU  50           HB2      LEU  50 140.896   1.459  -2.127
 1086   2HB   LEU  50           HB1      LEU  50 140.231   0.055  -2.956
 1087    HG   LEU  50           HG       LEU  50 142.874   0.114  -1.467
 1088   1HD1  LEU  50          HD11      LEU  50 140.700   0.251  -0.109
 1089   2HD1  LEU  50          HD13      LEU  50 140.354  -1.372  -0.706
 1090   3HD1  LEU  50          HD12      LEU  50 141.786  -1.082   0.281
 1091   1HD2  LEU  50          HD22      LEU  50 141.447  -1.968  -3.114
 1092   2HD2  LEU  50          HD21      LEU  50 143.165  -1.574  -3.060
 1093   3HD2  LEU  50          HD23      LEU  50 142.429  -2.483  -1.743
 1094    H    VAL  51           HN       VAL  51 141.624   3.417  -3.729
 1095    HA   VAL  51           HA       VAL  51 139.333   3.752  -5.400
 1096    HB   VAL  51           HB       VAL  51 141.461   5.698  -4.475
 1097   1HG1  VAL  51          HG12      VAL  51 138.956   6.138  -6.109
 1098   2HG1  VAL  51          HG11      VAL  51 139.653   7.419  -5.116
 1099   3HG1  VAL  51          HG13      VAL  51 140.589   6.719  -6.436
 1100   1HG2  VAL  51          HG22      VAL  51 139.891   4.597  -2.813
 1101   2HG2  VAL  51          HG21      VAL  51 139.801   6.358  -2.858
 1102   3HG2  VAL  51          HG23      VAL  51 138.559   5.391  -3.655
 1103    H    LEU  52           HN       LEU  52 142.776   3.703  -6.132
 1104    HA   LEU  52           HA       LEU  52 142.318   4.678  -8.889
 1105   1HB   LEU  52           HB2      LEU  52 144.839   3.666  -7.544
 1106   2HB   LEU  52           HB1      LEU  52 144.761   4.424  -9.133
 1107    HG   LEU  52           HG       LEU  52 143.892   5.749  -6.543
 1108   1HD1  LEU  52          HD12      LEU  52 146.408   5.275  -6.900
 1109   2HD1  LEU  52          HD11      LEU  52 146.311   6.454  -8.209
 1110   3HD1  LEU  52          HD13      LEU  52 145.941   6.938  -6.555
 1111   1HD2  LEU  52          HD22      LEU  52 143.918   6.587  -9.441
 1112   2HD2  LEU  52          HD21      LEU  52 142.678   6.854  -8.215
 1113   3HD2  LEU  52          HD23      LEU  52 144.159   7.807  -8.192
 1114    H    LYS  53           HN       LYS  53 141.402   1.917  -7.668
 1115    HA   LYS  53           HA       LYS  53 141.260  -0.292  -8.441
 1116   1HB   LYS  53           HB2      LYS  53 141.706   1.162 -11.062
 1117   2HB   LYS  53           HB1      LYS  53 141.055  -0.471 -10.899
 1118   1HG   LYS  53           HG2      LYS  53 139.176   0.409  -9.566
 1119   2HG   LYS  53           HG1      LYS  53 139.821   2.041  -9.731
 1120   1HD   LYS  53           HD2      LYS  53 139.586   1.889 -12.181
 1121   2HD   LYS  53           HD1      LYS  53 138.936   0.257 -12.017
 1122   1HE   LYS  53           HE2      LYS  53 137.017   1.638 -12.195
 1123   2HE   LYS  53           HE1      LYS  53 137.164   1.316 -10.467
 1124   1HZ   LYS  53           HZ3      LYS  53 138.678   3.598 -11.325
 1125   2HZ   LYS  53           HZ2      LYS  53 137.012   3.771 -11.609
 1126   3HZ   LYS  53           HZ1      LYS  53 137.579   3.448 -10.041
 1127    H    LYS  54           HN       LYS  54 143.914   0.626  -7.652
 1128    HA   LYS  54           HA       LYS  54 146.104  -0.158  -7.649
 1129   1HB   LYS  54           HB2      LYS  54 145.060  -2.430  -9.355
 1130   2HB   LYS  54           HB1      LYS  54 146.467  -2.438  -8.293
 1131   1HG   LYS  54           HG2      LYS  54 144.885  -1.945  -6.370
 1132   2HG   LYS  54           HG1      LYS  54 143.558  -2.257  -7.483
 1133   1HD   LYS  54           HD2      LYS  54 144.485  -4.514  -7.935
 1134   2HD   LYS  54           HD1      LYS  54 145.764  -4.205  -6.759
 1135   1HE   LYS  54           HE2      LYS  54 144.016  -5.454  -5.642
 1136   2HE   LYS  54           HE1      LYS  54 143.979  -3.800  -5.031
 1137   1HZ   LYS  54           HZ2      LYS  54 142.264  -4.789  -7.240
 1138   2HZ   LYS  54           HZ1      LYS  54 141.768  -4.707  -5.617
 1139   3HZ   LYS  54           HZ3      LYS  54 142.161  -3.286  -6.455
 1140    H    ASP  55           HN       ASP  55 144.959   1.446 -10.066
 1141    HA   ASP  55           HA       ASP  55 146.499   0.605 -12.360
 1142   1HB   ASP  55           HB2      ASP  55 145.273   3.227 -11.498
 1143   2HB   ASP  55           HB1      ASP  55 146.221   3.110 -12.982
 1144    H    GLU  56           HN       GLU  56 148.713   0.501 -12.346
 1145    HA   GLU  56           HA       GLU  56 150.341   1.703 -10.332
 1146   1HB   GLU  56           HB2      GLU  56 150.923  -0.351 -11.603
 1147   2HB   GLU  56           HB1      GLU  56 151.198   0.645 -13.031
 1148   1HG   GLU  56           HG2      GLU  56 152.969   1.866 -11.908
 1149   2HG   GLU  56           HG1      GLU  56 152.634   1.032 -10.392
 1150    H    ASP  57           HN       ASP  57 149.750   2.717 -13.711
 1151    HA   ASP  57           HA       ASP  57 151.729   4.817 -13.662
 1152   1HB   ASP  57           HB2      ASP  57 149.271   4.384 -15.383
 1153   2HB   ASP  57           HB1      ASP  57 150.419   5.698 -15.645
 1154    H    LEU  58           HN       LEU  58 148.288   4.713 -12.984
 1155    HA   LEU  58           HA       LEU  58 148.044   7.580 -12.549
 1156   1HB   LEU  58           HB2      LEU  58 146.315   5.289 -11.580
 1157   2HB   LEU  58           HB1      LEU  58 145.900   6.987 -11.388
 1158    HG   LEU  58           HG       LEU  58 146.404   5.622 -14.050
 1159   1HD1  LEU  58          HD11      LEU  58 144.354   4.799 -12.961
 1160   2HD1  LEU  58          HD13      LEU  58 143.810   6.458 -12.713
 1161   3HD1  LEU  58          HD12      LEU  58 143.955   5.811 -14.348
 1162   1HD2  LEU  58          HD23      LEU  58 145.757   8.443 -13.212
 1163   2HD2  LEU  58          HD22      LEU  58 146.829   7.873 -14.491
 1164   3HD2  LEU  58          HD21      LEU  58 145.087   7.841 -14.728
 1165    H    PHE  59           HN       PHE  59 148.698   4.797 -10.480
 1166    HA   PHE  59           HA       PHE  59 148.618   6.204  -7.985
 1167   1HB   PHE  59           HB2      PHE  59 148.582   3.764  -8.060
 1168   2HB   PHE  59           HB1      PHE  59 150.181   3.737  -8.804
 1169    HD1  PHE  59           HD1      PHE  59 148.473   5.249  -5.812
 1170    HD2  PHE  59           HD2      PHE  59 152.004   3.366  -7.382
 1171    HE1  PHE  59           HE1      PHE  59 149.503   5.300  -3.558
 1172    HE2  PHE  59           HE2      PHE  59 153.033   3.421  -5.126
 1173    HZ   PHE  59           HZ       PHE  59 151.783   4.387  -3.214
 1174    H    ARG  60           HN       ARG  60 151.325   5.458 -10.191
 1175    HA   ARG  60           HA       ARG  60 153.357   6.647  -8.613
 1176   1HB   ARG  60           HB2      ARG  60 153.117   6.252 -11.596
 1177   2HB   ARG  60           HB1      ARG  60 154.560   6.933 -10.848
 1178   1HG   ARG  60           HG2      ARG  60 154.767   4.905  -9.433
 1179   2HG   ARG  60           HG1      ARG  60 153.354   4.217 -10.235
 1180   1HD   ARG  60           HD2      ARG  60 154.502   4.281 -12.392
 1181   2HD   ARG  60           HD1      ARG  60 155.890   5.078 -11.658
 1182    HE   ARG  60           HE       ARG  60 155.587   2.713 -10.211
 1183   1HH1  ARG  60          HH21      ARG  60 155.915   3.630 -13.517
 1184   2HH1  ARG  60          HH22      ARG  60 156.764   2.188 -13.971
 1185   1HH2  ARG  60          HH11      ARG  60 156.697   0.829 -10.784
 1186   2HH2  ARG  60          HH12      ARG  60 157.204   0.604 -12.424
 1187    H    GLU  61           HN       GLU  61 151.362   8.167 -11.200
 1188    HA   GLU  61           HA       GLU  61 152.677  10.707 -11.025
 1189   1HB   GLU  61           HB2      GLU  61 149.872   9.947 -11.885
 1190   2HB   GLU  61           HB1      GLU  61 150.522  11.582 -12.028
 1191   1HG   GLU  61           HG2      GLU  61 151.863   9.146 -13.230
 1192   2HG   GLU  61           HG1      GLU  61 150.747  10.180 -14.122
 1193    H    TRP  62           HN       TRP  62 149.974   9.266  -9.244
 1194    HA   TRP  62           HA       TRP  62 149.173  11.631  -7.858
 1195   1HB   TRP  62           HB2      TRP  62 147.712   9.726  -7.816
 1196   2HB   TRP  62           HB1      TRP  62 148.978   8.694  -7.152
 1197    HD1  TRP  62           HD1      TRP  62 146.623  11.560  -6.164
 1198    HE1  TRP  62           HE1      TRP  62 146.462  11.641  -3.592
 1199    HE3  TRP  62           HE3      TRP  62 150.169   8.085  -4.947
 1200    HZ2  TRP  62           HZ2      TRP  62 147.685  10.397  -1.313
 1201    HZ3  TRP  62           HZ3      TRP  62 150.641   7.551  -2.576
 1202    HH2  TRP  62           HH2      TRP  62 149.408   8.702  -0.761
 1203    H    LEU  63           HN       LEU  63 151.479   9.065  -6.937
 1204    HA   LEU  63           HA       LEU  63 152.107  10.236  -4.394
 1205   1HB   LEU  63           HB2      LEU  63 152.540   7.867  -4.921
 1206   2HB   LEU  63           HB1      LEU  63 153.726   8.350  -6.130
 1207    HG   LEU  63           HG       LEU  63 155.082   9.424  -4.362
 1208   1HD1  LEU  63          HD13      LEU  63 152.746   8.579  -2.665
 1209   2HD1  LEU  63          HD12      LEU  63 154.353   8.652  -1.944
 1210   3HD1  LEU  63          HD11      LEU  63 153.642  10.098  -2.654
 1211   1HD2  LEU  63          HD23      LEU  63 154.295   6.529  -3.967
 1212   2HD2  LEU  63          HD22      LEU  63 155.657   7.158  -4.895
 1213   3HD2  LEU  63          HD21      LEU  63 155.663   7.269  -3.135
 1214    H    LYS  64           HN       LYS  64 153.773  10.344  -7.537
 1215    HA   LYS  64           HA       LYS  64 155.949  11.983  -6.709
 1216   1HB   LYS  64           HB2      LYS  64 155.891  10.780  -8.877
 1217   2HB   LYS  64           HB1      LYS  64 154.589  11.829  -9.423
 1218   1HG   LYS  64           HG2      LYS  64 156.572  12.721 -10.395
 1219   2HG   LYS  64           HG1      LYS  64 156.207  13.793  -9.052
 1220   1HD   LYS  64           HD2      LYS  64 157.891  12.751  -7.669
 1221   2HD   LYS  64           HD1      LYS  64 158.131  11.461  -8.847
 1222   1HE   LYS  64           HE2      LYS  64 158.564  14.354  -9.592
 1223   2HE   LYS  64           HE1      LYS  64 159.841  13.407  -8.829
 1224   1HZ   LYS  64           HZ2      LYS  64 158.519  12.074 -11.020
 1225   2HZ   LYS  64           HZ1      LYS  64 159.359  13.480 -11.473
 1226   3HZ   LYS  64           HZ3      LYS  64 160.176  12.224 -10.679
 1227    H    ASP  65           HN       ASP  65 152.830  12.858  -8.158
 1228    HA   ASP  65           HA       ASP  65 153.279  15.698  -8.023
 1229   1HB   ASP  65           HB2      ASP  65 151.580  14.569  -9.497
 1230   2HB   ASP  65           HB1      ASP  65 150.621  14.242  -8.054
 1231    H    THR  66           HN       THR  66 151.961  13.327  -5.781
 1232    HA   THR  66           HA       THR  66 150.838  15.293  -3.992
 1233    HB   THR  66           HB       THR  66 151.518  12.372  -3.587
 1234    HG1  THR  66           HG1      THR  66 149.059  13.723  -3.997
 1235   1HG2  THR  66          HG21      THR  66 150.057  14.360  -1.838
 1236   2HG2  THR  66          HG23      THR  66 149.882  12.616  -1.656
 1237   3HG2  THR  66          HG22      THR  66 151.454  13.373  -1.408
 1238    H    CYS  67           HN       CYS  67 153.999  13.540  -3.997
 1239    HA   CYS  67           HA       CYS  67 154.836  15.442  -1.818
 1240   1HB   CYS  67           HB2      CYS  67 156.001  13.659  -0.687
 1241   2HB   CYS  67           HB1      CYS  67 154.325  13.168  -0.925
 1242    HG   CYS  67           HG       CYS  67 155.192  11.218  -2.165
 1243    H    GLY  68           HN       GLY  68 155.851  13.511  -4.607
 1244   1HA   GLY  68           HA2      GLY  68 157.542  14.495  -6.111
 1245   2HA   GLY  68           HA1      GLY  68 158.365  15.150  -4.698
 1246    H    ALA  69           HN       ALA  69 157.124  11.954  -4.298
 1247    HA   ALA  69           HA       ALA  69 159.578  10.770  -3.645
 1248   1HB   ALA  69           HB1      ALA  69 157.254   9.759  -3.364
 1249   2HB   ALA  69           HB3      ALA  69 157.338   9.304  -5.066
 1250   3HB   ALA  69           HB2      ALA  69 158.497   8.638  -3.917
 1251    H    ASN  70           HN       ASN  70 161.057   9.405  -4.899
 1252    HA   ASN  70           HA       ASN  70 161.321  10.353  -7.683
 1253   1HB   ASN  70           HB2      ASN  70 163.122   8.470  -6.133
 1254   2HB   ASN  70           HB1      ASN  70 163.522   9.360  -7.601
 1255   1HD2  ASN  70          HD22      ASN  70 163.124  12.504  -5.462
 1256   2HD2  ASN  70          HD21      ASN  70 162.116  11.839  -6.653
 1257    H    ALA  71           HN       ALA  71 162.066   8.588  -9.290
 1258    HA   ALA  71           HA       ALA  71 159.927   6.776  -9.732
 1259   1HB   ALA  71           HB1      ALA  71 161.565   7.638 -11.457
 1260   2HB   ALA  71           HB3      ALA  71 162.736   6.483 -10.821
 1261   3HB   ALA  71           HB2      ALA  71 161.239   5.907 -11.551
 1262    H    LYS  72           HN       LYS  72 163.042   6.293  -8.096
 1263    HA   LYS  72           HA       LYS  72 162.747   3.414  -7.946
 1264   1HB   LYS  72           HB2      LYS  72 164.941   4.652  -7.684
 1265   2HB   LYS  72           HB1      LYS  72 164.385   5.162  -6.088
 1266   1HG   LYS  72           HG2      LYS  72 164.112   2.799  -5.423
 1267   2HG   LYS  72           HG1      LYS  72 164.673   2.287  -7.015
 1268   1HD   LYS  72           HD2      LYS  72 166.838   3.399  -6.615
 1269   2HD   LYS  72           HD1      LYS  72 166.282   3.911  -5.021
 1270   1HE   LYS  72           HE2      LYS  72 167.611   1.902  -4.743
 1271   2HE   LYS  72           HE1      LYS  72 165.923   1.490  -4.442
 1272   1HZ   LYS  72           HZ3      LYS  72 166.861   1.249  -7.189
 1273   2HZ   LYS  72           HZ2      LYS  72 167.465   0.110  -6.082
 1274   3HZ   LYS  72           HZ1      LYS  72 165.789   0.264  -6.318
 1275    H    GLN  73           HN       GLN  73 161.942   6.106  -5.799
 1276    HA   GLN  73           HA       GLN  73 161.134   4.513  -3.560
 1277   1HB   GLN  73           HB2      GLN  73 160.435   7.328  -4.428
 1278   2HB   GLN  73           HB1      GLN  73 159.901   6.626  -2.901
 1279   1HG   GLN  73           HG2      GLN  73 162.204   6.274  -2.199
 1280   2HG   GLN  73           HG1      GLN  73 162.799   6.822  -3.766
 1281   1HE2  GLN  73          HE22      GLN  73 162.446   9.588  -1.019
 1282   2HE2  GLN  73          HE21      GLN  73 162.802   7.946  -0.773
 1283    H    SER  74           HN       SER  74 159.325   5.814  -6.354
 1284    HA   SER  74           HA       SER  74 156.752   5.050  -5.375
 1285   1HB   SER  74           HB2      SER  74 155.958   5.654  -7.494
 1286   2HB   SER  74           HB1      SER  74 157.431   6.611  -7.362
 1287    HG   SER  74           HG       SER  74 157.063   4.132  -8.693
 1288    H    ARG  75           HN       ARG  75 159.179   3.323  -7.354
 1289    HA   ARG  75           HA       ARG  75 157.522   1.116  -8.040
 1290   1HB   ARG  75           HB2      ARG  75 160.516   1.327  -7.650
 1291   2HB   ARG  75           HB1      ARG  75 159.726  -0.146  -8.214
 1292   1HG   ARG  75           HG2      ARG  75 158.742   1.100 -10.103
 1293   2HG   ARG  75           HG1      ARG  75 159.533   2.574  -9.545
 1294   1HD   ARG  75           HD2      ARG  75 160.878   1.578 -11.315
 1295   2HD   ARG  75           HD1      ARG  75 161.742   1.425  -9.785
 1296    HE   ARG  75           HE       ARG  75 160.330  -0.946  -9.971
 1297   1HH1  ARG  75          HH21      ARG  75 162.486   0.835 -11.989
 1298   2HH1  ARG  75          HH22      ARG  75 163.133  -0.572 -12.766
 1299   1HH2  ARG  75          HH11      ARG  75 161.164  -2.792 -10.975
 1300   2HH2  ARG  75          HH12      ARG  75 162.384  -2.625 -12.192
 1301    H    ASP  76           HN       ASP  76 159.465   1.734  -5.113
 1302    HA   ASP  76           HA       ASP  76 159.078  -0.869  -3.988
 1303   1HB   ASP  76           HB2      ASP  76 159.680   1.817  -2.730
 1304   2HB   ASP  76           HB1      ASP  76 159.644   0.308  -1.817
 1305    H    CYS  77           HN       CYS  77 157.152   2.136  -3.731
 1306    HA   CYS  77           HA       CYS  77 155.393   1.116  -1.701
 1307   1HB   CYS  77           HB2      CYS  77 155.078   3.296  -3.778
 1308   2HB   CYS  77           HB1      CYS  77 153.863   2.954  -2.545
 1309    HG   CYS  77           HG       CYS  77 156.756   3.961  -1.908
 1310    H    PHE  78           HN       PHE  78 155.239   1.065  -5.286
 1311    HA   PHE  78           HA       PHE  78 152.579   0.080  -5.453
 1312   1HB   PHE  78           HB2      PHE  78 153.832   0.874  -7.425
 1313   2HB   PHE  78           HB1      PHE  78 154.901  -0.525  -7.307
 1314    HD1  PHE  78           HD2      PHE  78 154.104  -2.778  -7.836
 1315    HD2  PHE  78           HD1      PHE  78 151.504   0.628  -8.132
 1316    HE1  PHE  78           HE2      PHE  78 152.468  -4.138  -9.112
 1317    HE2  PHE  78           HE1      PHE  78 149.868  -0.731  -9.406
 1318    HZ   PHE  78           HZ       PHE  78 150.349  -3.115  -9.895
 1319    H    GLY  79           HN       GLY  79 155.595  -1.852  -5.707
 1320   1HA   GLY  79           HA2      GLY  79 154.308  -4.372  -5.550
 1321   2HA   GLY  79           HA1      GLY  79 155.997  -4.083  -5.135
 1322    H    CYS  80           HN       CYS  80 155.327  -2.133  -3.041
 1323    HA   CYS  80           HA       CYS  80 155.041  -4.000  -0.848
 1324   1HB   CYS  80           HB2      CYS  80 156.323  -1.861  -0.694
 1325   2HB   CYS  80           HB1      CYS  80 154.801  -0.977  -0.796
 1326    HG   CYS  80           HG       CYS  80 155.522  -1.425   1.754
 1327    H    LEU  81           HN       LEU  81 152.839  -1.419  -2.117
 1328    HA   LEU  81           HA       LEU  81 150.702  -2.239  -0.342
 1329   1HB   LEU  81           HB2      LEU  81 150.593  -0.642  -2.920
 1330   2HB   LEU  81           HB1      LEU  81 149.278  -0.791  -1.757
 1331    HG   LEU  81           HG       LEU  81 152.010   0.396  -1.164
 1332   1HD1  LEU  81          HD12      LEU  81 149.292   1.665  -1.627
 1333   2HD1  LEU  81          HD11      LEU  81 150.691   2.528  -0.988
 1334   3HD1  LEU  81          HD13      LEU  81 150.735   1.864  -2.621
 1335   1HD2  LEU  81          HD21      LEU  81 149.562  -0.179   0.504
 1336   2HD2  LEU  81          HD23      LEU  81 151.265  -0.388   0.915
 1337   3HD2  LEU  81          HD22      LEU  81 150.557   1.223   0.893
 1338    H    ARG  82           HN       ARG  82 151.541  -2.975  -3.728
 1339    HA   ARG  82           HA       ARG  82 149.176  -4.413  -4.355
 1340   1HB   ARG  82           HB2      ARG  82 150.747  -3.746  -6.097
 1341   2HB   ARG  82           HB1      ARG  82 151.999  -4.766  -5.401
 1342   1HG   ARG  82           HG2      ARG  82 150.971  -5.853  -7.361
 1343   2HG   ARG  82           HG1      ARG  82 150.649  -6.779  -5.904
 1344   1HD   ARG  82           HD2      ARG  82 148.389  -5.959  -5.783
 1345   2HD   ARG  82           HD1      ARG  82 148.698  -4.758  -7.039
 1346    HE   ARG  82           HE       ARG  82 149.237  -7.176  -8.278
 1347   1HH1  ARG  82          HH21      ARG  82 146.638  -5.847  -6.443
 1348   2HH1  ARG  82          HH22      ARG  82 145.413  -6.736  -7.283
 1349   1HH2  ARG  82          HH11      ARG  82 147.651  -8.347  -9.386
 1350   2HH2  ARG  82          HH12      ARG  82 145.986  -8.151  -8.949
 1351    H    GLU  83           HN       GLU  83 152.214  -5.508  -2.871
 1352    HA   GLU  83           HA       GLU  83 151.457  -8.288  -2.826
 1353   1HB   GLU  83           HB2      GLU  83 153.581  -6.655  -1.454
 1354   2HB   GLU  83           HB1      GLU  83 153.302  -8.323  -0.959
 1355   1HG   GLU  83           HG2      GLU  83 155.079  -8.026  -2.743
 1356   2HG   GLU  83           HG1      GLU  83 153.788  -9.150  -3.162
 1357    H    TRP  84           HN       TRP  84 151.068  -5.647  -0.428
 1358    HA   TRP  84           HA       TRP  84 150.177  -7.321   1.704
 1359   1HB   TRP  84           HB2      TRP  84 150.737  -4.863   1.906
 1360   2HB   TRP  84           HB1      TRP  84 149.201  -4.511   1.109
 1361    HD1  TRP  84           HD1      TRP  84 150.668  -5.874   4.346
 1362    HE1  TRP  84           HE1      TRP  84 148.808  -5.994   6.129
 1363    HE3  TRP  84           HE3      TRP  84 146.610  -4.730   1.465
 1364    HZ2  TRP  84           HZ2      TRP  84 145.976  -5.653   6.306
 1365    HZ3  TRP  84           HZ3      TRP  84 144.346  -4.639   2.465
 1366    HH2  TRP  84           HH2      TRP  84 144.025  -5.100   4.877
 1367    H    CYS  85           HN       CYS  85 148.412  -5.669  -0.908
 1368    HA   CYS  85           HA       CYS  85 145.798  -6.529  -0.171
 1369   1HB   CYS  85           HB2      CYS  85 147.029  -5.831  -2.848
 1370   2HB   CYS  85           HB1      CYS  85 145.319  -6.222  -2.667
 1371    HG   CYS  85           HG       CYS  85 146.573  -3.578  -1.943
 1372    H    ASP  86           HN       ASP  86 148.301  -8.055  -2.158
 1373    HA   ASP  86           HA       ASP  86 146.787 -10.274  -3.079
 1374   1HB   ASP  86           HB2      ASP  86 149.741  -9.961  -2.506
 1375   2HB   ASP  86           HB1      ASP  86 149.053 -11.409  -3.243
 1376    H    ALA  87           HN       ALA  87 148.481  -9.748  -0.007
 1377    HA   ALA  87           HA       ALA  87 147.966 -12.525   0.845
 1378   1HB   ALA  87           HB1      ALA  87 150.036 -11.151   1.479
 1379   2HB   ALA  87           HB3      ALA  87 148.979 -10.272   2.587
 1380   3HB   ALA  87           HB2      ALA  87 149.225 -12.006   2.791
 1381    H    PHE  88           HN       PHE  88 146.689  -9.285   1.492
 1382    HA   PHE  88           HA       PHE  88 144.699 -10.481   3.383
 1383   1HB   PHE  88           HB2      PHE  88 145.540  -7.615   2.879
 1384   2HB   PHE  88           HB1      PHE  88 144.245  -8.088   3.981
 1385    HD1  PHE  88           HD2      PHE  88 144.752  -9.553   5.951
 1386    HD2  PHE  88           HD1      PHE  88 147.848  -7.882   3.489
 1387    HE1  PHE  88           HE2      PHE  88 146.423 -10.043   7.716
 1388    HE2  PHE  88           HE1      PHE  88 149.519  -8.375   5.251
 1389    HZ   PHE  88           HZ       PHE  88 148.804  -9.457   7.365
 1390    H    LEU  89           HN       LEU  89 144.226  -7.545   1.466
 1391    HA   LEU  89           HA       LEU  89 141.640  -8.620   0.542
 1392   1HB   LEU  89           HB2      LEU  89 141.666  -6.322   1.340
 1393   2HB   LEU  89           HB1      LEU  89 142.968  -5.908   0.232
 1394    HG   LEU  89           HG       LEU  89 141.517  -6.256  -1.693
 1395   1HD1  LEU  89          HD13      LEU  89 139.619  -7.323   0.399
 1396   2HD1  LEU  89          HD12      LEU  89 139.003  -6.684  -1.124
 1397   3HD1  LEU  89          HD11      LEU  89 140.106  -8.058  -1.127
 1398   1HD2  LEU  89          HD21      LEU  89 141.420  -4.094  -0.285
 1399   2HD2  LEU  89          HD23      LEU  89 140.089  -4.381  -1.407
 1400   3HD2  LEU  89          HD22      LEU  89 139.876  -4.700   0.314
   
  No H/Q in entry =        1400
  Start of MODEL   19
    1   1H    MET   1           HT2      MET   1 115.770 -11.905   8.620
    2   2H    MET   1           HT1      MET   1 114.839 -13.228   9.141
    3   3H    MET   1           HT3      MET   1 114.251 -11.649   9.338
    4    HA   MET   1           HA       MET   1 114.995 -12.025  11.441
    5   1HB   MET   1           HB2      MET   1 115.832 -14.310  10.848
    6   2HB   MET   1           HB1      MET   1 117.309 -13.577  10.237
    7   1HG   MET   1           HG2      MET   1 117.676 -14.362  12.523
    8   2HG   MET   1           HG1      MET   1 117.739 -12.602  12.484
    9   1HE   MET   1           HE3      MET   1 115.691 -15.650  12.801
   10   2HE   MET   1           HE2      MET   1 114.507 -15.375  14.076
   11   3HE   MET   1           HE1      MET   1 114.191 -14.781  12.448
   12    H    THR   2           HN       THR   2 115.252  -9.680  10.927
   13    HA   THR   2           HA       THR   2 116.516  -7.707  10.823
   14    HB   THR   2           HB       THR   2 118.665  -9.416  12.113
   15    HG1  THR   2           HG1      THR   2 117.570  -9.268  13.936
   16   1HG2  THR   2          HG21      THR   2 119.112  -6.995  11.334
   17   2HG2  THR   2          HG23      THR   2 118.001  -6.516  12.615
   18   3HG2  THR   2          HG22      THR   2 119.483  -7.382  13.013
   19    H    THR   3           HN       THR   3 119.651  -9.025  10.724
   20    HA   THR   3           HA       THR   3 120.052  -8.077   8.016
   21    HB   THR   3           HB       THR   3 122.352  -8.994   8.312
   22    HG1  THR   3           HG1      THR   3 122.162 -10.732   9.559
   23   1HG2  THR   3          HG22      THR   3 121.556  -6.752   9.246
   24   2HG2  THR   3          HG21      THR   3 121.459  -7.555  10.814
   25   3HG2  THR   3          HG23      THR   3 123.009  -7.427   9.983
   26    H    SER   4           HN       SER   4 120.552  -9.344   6.166
   27    HA   SER   4           HA       SER   4 119.152 -11.910   6.044
   28   1HB   SER   4           HB2      SER   4 119.768 -11.841   3.651
   29   2HB   SER   4           HB1      SER   4 119.045 -10.318   4.162
   30    HG   SER   4           HG       SER   4 121.005 -10.088   2.928
   31    H    GLN   5           HN       GLN   5 120.345 -13.734   4.833
   32    HA   GLN   5           HA       GLN   5 122.528 -14.643   6.444
   33   1HB   GLN   5           HB2      GLN   5 121.450 -15.588   3.774
   34   2HB   GLN   5           HB1      GLN   5 122.716 -16.436   4.662
   35   1HG   GLN   5           HG2      GLN   5 121.212 -16.677   6.598
   36   2HG   GLN   5           HG1      GLN   5 119.944 -15.816   5.725
   37   1HE2  GLN   5          HE22      GLN   5 119.730 -19.630   5.301
   38   2HE2  GLN   5          HE21      GLN   5 120.035 -18.702   6.689
   39    H    LYS   6           HN       LYS   6 122.424 -12.756   3.492
   40    HA   LYS   6           HA       LYS   6 125.047 -13.284   2.533
   41   1HB   LYS   6           HB2      LYS   6 123.292 -10.826   2.339
   42   2HB   LYS   6           HB1      LYS   6 124.829 -10.986   1.490
   43   1HG   LYS   6           HG2      LYS   6 124.006 -13.024   0.369
   44   2HG   LYS   6           HG1      LYS   6 122.465 -12.866   1.214
   45   1HD   LYS   6           HD2      LYS   6 122.097 -10.672   0.142
   46   2HD   LYS   6           HD1      LYS   6 123.636 -10.832  -0.708
   47   1HE   LYS   6           HE2      LYS   6 121.318 -12.771  -0.963
   48   2HE   LYS   6           HE1      LYS   6 121.698 -11.500  -2.126
   49   1HZ   LYS   6           HZ3      LYS   6 123.601 -13.631  -1.321
   50   2HZ   LYS   6           HZ2      LYS   6 122.613 -13.716  -2.700
   51   3HZ   LYS   6           HZ1      LYS   6 123.795 -12.502  -2.573
   52    H    HIS   7           HN       HIS   7 123.844 -11.078   5.024
   53    HA   HIS   7           HA       HIS   7 126.207  -9.548   5.373
   54   1HB   HIS   7           HB2      HIS   7 124.163  -8.841   6.432
   55   2HB   HIS   7           HB1      HIS   7 124.039 -10.349   7.331
   56    HD2  HIS   7           HD2      HIS   7 125.530 -10.434   9.705
   57    HE1  HIS   7           HE1      HIS   7 127.319  -6.626   9.328
   58    HE2  HIS   7           HE2      HIS   7 126.963  -8.600  10.882
   59    H    ARG   8           HN       ARG   8 125.224 -12.557   7.077
   60    HA   ARG   8           HA       ARG   8 127.669 -12.722   8.580
   61   1HB   ARG   8           HB2      ARG   8 125.580 -14.808   7.870
   62   2HB   ARG   8           HB1      ARG   8 126.918 -15.104   8.976
   63   1HG   ARG   8           HG2      ARG   8 125.038 -12.783   9.402
   64   2HG   ARG   8           HG1      ARG   8 124.618 -14.389   9.971
   65   1HD   ARG   8           HD2      ARG   8 127.038 -12.756  10.774
   66   2HD   ARG   8           HD1      ARG   8 125.671 -13.170  11.793
   67    HE   ARG   8           HE       ARG   8 128.025 -14.763  11.328
   68   1HH1  ARG   8          HH21      ARG   8 124.593 -15.066  11.606
   69   2HH1  ARG   8          HH22      ARG   8 124.652 -16.771  11.907
   70   1HH2  ARG   8          HH11      ARG   8 128.102 -16.961  11.743
   71   2HH2  ARG   8          HH12      ARG   8 126.629 -17.839  11.988
   72    H    ASP   9           HN       ASP   9 126.656 -13.867   5.428
   73    HA   ASP   9           HA       ASP   9 128.878 -15.690   5.046
   74   1HB   ASP   9           HB2      ASP   9 126.985 -14.359   3.108
   75   2HB   ASP   9           HB1      ASP   9 128.218 -15.512   2.612
   76    H    PHE  10           HN       PHE  10 128.288 -12.288   4.220
   77    HA   PHE  10           HA       PHE  10 130.635 -11.952   2.599
   78   1HB   PHE  10           HB2      PHE  10 128.608 -10.436   2.695
   79   2HB   PHE  10           HB1      PHE  10 129.207  -9.846   4.244
   80    HD1  PHE  10           HD2      PHE  10 131.287  -8.523   4.373
   81    HD2  PHE  10           HD1      PHE  10 129.716  -9.878   0.611
   82    HE1  PHE  10           HE2      PHE  10 132.772  -6.932   3.177
   83    HE2  PHE  10           HE1      PHE  10 131.197  -8.286  -0.583
   84    HZ   PHE  10           HZ       PHE  10 132.724  -6.812   0.701
   85    H    VAL  11           HN       VAL  11 130.014 -11.474   6.073
   86    HA   VAL  11           HA       VAL  11 132.737 -10.486   6.540
   87    HB   VAL  11           HB       VAL  11 132.052 -10.461   8.906
   88   1HG1  VAL  11          HG13      VAL  11 129.922  -9.442   6.997
   89   2HG1  VAL  11          HG12      VAL  11 130.128  -8.905   8.662
   90   3HG1  VAL  11          HG11      VAL  11 131.385  -8.579   7.469
   91   1HG2  VAL  11          HG21      VAL  11 129.736 -12.047   7.790
   92   2HG2  VAL  11          HG23      VAL  11 130.748 -12.408   9.188
   93   3HG2  VAL  11          HG22      VAL  11 129.553 -11.115   9.276
   94    H    ALA  12           HN       ALA  12 132.011 -13.374   5.552
   95    HA   ALA  12           HA       ALA  12 133.656 -14.839   7.601
   96   1HB   ALA  12           HB3      ALA  12 131.366 -15.783   5.869
   97   2HB   ALA  12           HB2      ALA  12 132.454 -16.888   6.709
   98   3HB   ALA  12           HB1      ALA  12 131.453 -15.766   7.630
   99    H    GLU  13           HN       GLU  13 133.713 -13.624   4.460
  100    HA   GLU  13           HA       GLU  13 136.055 -15.288   3.846
  101   1HB   GLU  13           HB2      GLU  13 135.181 -15.870   1.559
  102   2HB   GLU  13           HB1      GLU  13 134.329 -16.679   2.873
  103   1HG   GLU  13           HG2      GLU  13 132.513 -15.076   2.758
  104   2HG   GLU  13           HG1      GLU  13 133.385 -14.112   1.568
  105    HA   PRO  14           HA       PRO  14 137.688 -11.505   2.162
  106   1HB   PRO  14           HB2      PRO  14 138.149 -13.074  -0.364
  107   2HB   PRO  14           HB1      PRO  14 139.263 -12.005   0.517
  108   1HG   PRO  14           HG2      PRO  14 139.425 -14.683   0.686
  109   2HG   PRO  14           HG1      PRO  14 139.815 -13.624   2.053
  110   1HD   PRO  14           HD2      PRO  14 137.473 -15.416   1.700
  111   2HD   PRO  14           HD1      PRO  14 138.166 -14.740   3.191
  112    H    MET  15           HN       MET  15 137.135  -9.862   0.498
  113    HA   MET  15           HA       MET  15 134.369 -10.232  -0.505
  114   1HB   MET  15           HB2      MET  15 134.729  -7.757  -1.183
  115   2HB   MET  15           HB1      MET  15 134.649  -8.131   0.541
  116   1HG   MET  15           HG2      MET  15 137.018  -8.020   0.776
  117   2HG   MET  15           HG1      MET  15 137.264  -8.021  -0.968
  118   1HE   MET  15           HE2      MET  15 135.639  -6.538   1.946
  119   2HE   MET  15           HE1      MET  15 136.094  -4.836   1.939
  120   3HE   MET  15           HE3      MET  15 134.604  -5.362   1.146
  121    H    GLY  16           HN       GLY  16 137.634 -10.223  -1.651
  122   1HA   GLY  16           HA2      GLY  16 138.543 -10.420  -3.799
  123   2HA   GLY  16           HA1      GLY  16 137.090 -11.350  -4.146
  124    H    GLU  17           HN       GLU  17 136.516 -10.584  -6.133
  125    HA   GLU  17           HA       GLU  17 136.308  -7.623  -6.537
  126   1HB   GLU  17           HB2      GLU  17 136.416  -9.884  -8.557
  127   2HB   GLU  17           HB1      GLU  17 136.354  -8.163  -8.940
  128   1HG   GLU  17           HG2      GLU  17 138.481  -7.814  -7.742
  129   2HG   GLU  17           HG1      GLU  17 138.549  -9.533  -7.356
  130    H    LYS  18           HN       LYS  18 134.273  -9.209  -5.126
  131    HA   LYS  18           HA       LYS  18 132.069  -9.880  -6.786
  132   1HB   LYS  18           HB2      LYS  18 132.190  -8.854  -3.938
  133   2HB   LYS  18           HB1      LYS  18 130.691  -9.394  -4.694
  134   1HG   LYS  18           HG2      LYS  18 131.659 -11.605  -5.102
  135   2HG   LYS  18           HG1      LYS  18 133.200 -11.073  -4.424
  136   1HD   LYS  18           HD2      LYS  18 132.114 -10.664  -2.251
  137   2HD   LYS  18           HD1      LYS  18 130.566 -11.178  -2.923
  138   1HE   LYS  18           HE2      LYS  18 131.445 -13.090  -1.792
  139   2HE   LYS  18           HE1      LYS  18 131.711 -13.386  -3.511
  140   1HZ   LYS  18           HZ1      LYS  18 133.890 -11.943  -2.496
  141   2HZ   LYS  18           HZ3      LYS  18 133.612 -13.264  -1.471
  142   3HZ   LYS  18           HZ2      LYS  18 133.871 -13.519  -3.129
  143    HA   PRO  19           HA       PRO  19 130.724  -5.926  -8.275
  144   1HB   PRO  19           HB2      PRO  19 127.971  -6.291  -8.369
  145   2HB   PRO  19           HB1      PRO  19 129.106  -6.933  -9.574
  146   1HG   PRO  19           HG2      PRO  19 127.822  -8.314  -7.263
  147   2HG   PRO  19           HG1      PRO  19 128.144  -8.915  -8.899
  148   1HD   PRO  19           HD2      PRO  19 129.707  -9.595  -6.780
  149   2HD   PRO  19           HD1      PRO  19 130.364  -9.429  -8.422
  150    H    VAL  20           HN       VAL  20 129.787  -3.950  -7.588
  151    HA   VAL  20           HA       VAL  20 129.834  -3.402  -4.838
  152    HB   VAL  20           HB       VAL  20 130.030  -1.611  -6.435
  153   1HG1  VAL  20          HG11      VAL  20 128.577  -2.651  -8.177
  154   2HG1  VAL  20          HG13      VAL  20 127.162  -2.202  -7.225
  155   3HG1  VAL  20          HG12      VAL  20 128.199  -0.951  -7.905
  156   1HG2  VAL  20          HG21      VAL  20 128.853  -1.197  -4.193
  157   2HG2  VAL  20          HG23      VAL  20 128.589   0.013  -5.448
  158   3HG2  VAL  20          HG22      VAL  20 127.346  -1.190  -5.107
  159    H    GLY  21           HN       GLY  21 127.046  -4.208  -6.877
  160   1HA   GLY  21           HA2      GLY  21 125.031  -3.757  -4.912
  161   2HA   GLY  21           HA1      GLY  21 124.849  -4.799  -6.321
  162    H    SER  22           HN       SER  22 127.499  -6.042  -4.828
  163    HA   SER  22           HA       SER  22 125.913  -8.209  -3.643
  164   1HB   SER  22           HB2      SER  22 127.930  -8.787  -4.896
  165   2HB   SER  22           HB1      SER  22 128.910  -7.771  -3.840
  166    HG   SER  22           HG       SER  22 128.534  -9.158  -2.167
  167    H    LEU  23           HN       LEU  23 127.584  -5.354  -2.572
  168    HA   LEU  23           HA       LEU  23 128.082  -6.128   0.135
  169   1HB   LEU  23           HB2      LEU  23 127.541  -3.422  -1.115
  170   2HB   LEU  23           HB1      LEU  23 127.991  -3.626   0.574
  171    HG   LEU  23           HG       LEU  23 129.653  -4.702  -1.724
  172   1HD1  LEU  23          HD11      LEU  23 129.837  -2.069  -0.234
  173   2HD1  LEU  23          HD13      LEU  23 131.141  -2.723  -1.225
  174   3HD1  LEU  23          HD12      LEU  23 129.598  -2.299  -1.966
  175   1HD2  LEU  23          HD21      LEU  23 130.022  -4.455   1.268
  176   2HD2  LEU  23          HD23      LEU  23 130.339  -5.840   0.225
  177   3HD2  LEU  23          HD22      LEU  23 131.429  -4.461   0.206
  178    H    ALA  24           HN       ALA  24 126.801  -6.133   1.919
  179    HA   ALA  24           HA       ALA  24 123.983  -6.445   1.606
  180   1HB   ALA  24           HB1      ALA  24 125.718  -5.925   4.030
  181   2HB   ALA  24           HB3      ALA  24 123.980  -6.202   4.147
  182   3HB   ALA  24           HB2      ALA  24 125.031  -7.461   3.499
  183    H    GLY  25           HN       GLY  25 122.299  -5.045   1.830
  184   1HA   GLY  25           HA2      GLY  25 121.201  -3.017   2.516
  185   2HA   GLY  25           HA1      GLY  25 122.774  -2.272   2.786
  186    H    ILE  26           HN       ILE  26 123.429  -3.570  -0.029
  187    HA   ILE  26           HA       ILE  26 122.418  -1.212  -1.581
  188    HB   ILE  26           HB       ILE  26 124.593  -3.194  -2.325
  189   1HG1  ILE  26          HG12      ILE  26 125.308  -2.035  -0.317
  190   2HG1  ILE  26          HG11      ILE  26 126.151  -1.317  -1.689
  191   1HG2  ILE  26          HG22      ILE  26 123.867  -0.447  -3.390
  192   2HG2  ILE  26          HG21      ILE  26 125.223  -1.434  -3.939
  193   3HG2  ILE  26          HG23      ILE  26 123.568  -1.982  -4.209
  194   1HD1  ILE  26          HD13      ILE  26 124.168   0.385  -1.716
  195   2HD1  ILE  26          HD12      ILE  26 123.875  -0.185  -0.072
  196   3HD1  ILE  26          HD11      ILE  26 125.417   0.562  -0.486
  197    H    GLY  27           HN       GLY  27 120.601  -1.666  -2.809
  198   1HA   GLY  27           HA2      GLY  27 120.084  -4.484  -3.577
  199   2HA   GLY  27           HA1      GLY  27 118.934  -3.150  -3.673
  200    H    GLU  28           HN       GLU  28 118.959  -4.543  -5.889
  201    HA   GLU  28           HA       GLU  28 120.974  -4.084  -7.815
  202   1HB   GLU  28           HB2      GLU  28 117.987  -4.482  -8.119
  203   2HB   GLU  28           HB1      GLU  28 119.097  -4.442  -9.489
  204   1HG   GLU  28           HG2      GLU  28 120.371  -6.313  -8.527
  205   2HG   GLU  28           HG1      GLU  28 119.282  -6.354  -7.139
  206    H    VAL  29           HN       VAL  29 118.160  -2.046  -6.973
  207    HA   VAL  29           HA       VAL  29 118.589  -0.146  -9.089
  208    HB   VAL  29           HB       VAL  29 117.205   0.097  -6.404
  209   1HG1  VAL  29          HG11      VAL  29 117.471   2.080  -8.671
  210   2HG1  VAL  29          HG13      VAL  29 116.151   2.157  -7.507
  211   3HG1  VAL  29          HG12      VAL  29 117.817   2.335  -6.960
  212   1HG2  VAL  29          HG22      VAL  29 116.249  -0.277  -9.257
  213   2HG2  VAL  29          HG21      VAL  29 116.070  -1.407  -7.914
  214   3HG2  VAL  29          HG23      VAL  29 115.175   0.112  -7.910
  215    H    LEU  30           HN       LEU  30 119.582  -0.131  -5.666
  216    HA   LEU  30           HA       LEU  30 120.966   2.371  -5.811
  217   1HB   LEU  30           HB2      LEU  30 121.387   0.017  -3.947
  218   2HB   LEU  30           HB1      LEU  30 122.064   1.624  -3.705
  219    HG   LEU  30           HG       LEU  30 119.096   1.041  -3.945
  220   1HD1  LEU  30          HD13      LEU  30 120.168   0.043  -1.914
  221   2HD1  LEU  30          HD12      LEU  30 120.716   1.657  -1.458
  222   3HD1  LEU  30          HD11      LEU  30 118.990   1.300  -1.535
  223   1HD2  LEU  30          HD22      LEU  30 120.742   3.527  -3.480
  224   2HD2  LEU  30          HD21      LEU  30 119.316   3.307  -4.495
  225   3HD2  LEU  30          HD23      LEU  30 119.144   3.405  -2.745
  226    H    GLY  31           HN       GLY  31 121.992  -0.966  -6.376
  227   1HA   GLY  31           HA2      GLY  31 124.791  -0.479  -6.546
  228   2HA   GLY  31           HA1      GLY  31 123.949  -1.790  -7.375
  229    H    LYS  32           HN       LYS  32 122.215  -0.199  -8.989
  230    HA   LYS  32           HA       LYS  32 123.936   0.329 -11.208
  231   1HB   LYS  32           HB2      LYS  32 121.554  -0.248 -11.480
  232   2HB   LYS  32           HB1      LYS  32 121.100   1.286 -10.735
  233   1HG   LYS  32           HG2      LYS  32 122.049   2.549 -12.534
  234   2HG   LYS  32           HG1      LYS  32 122.852   1.126 -13.195
  235   1HD   LYS  32           HD2      LYS  32 120.872   1.608 -14.531
  236   2HD   LYS  32           HD1      LYS  32 120.613   0.112 -13.635
  237   1HE   LYS  32           HE2      LYS  32 119.713   2.754 -12.492
  238   2HE   LYS  32           HE1      LYS  32 118.708   1.885 -13.652
  239   1HZ   LYS  32           HZ3      LYS  32 119.484  -0.035 -11.884
  240   2HZ   LYS  32           HZ2      LYS  32 119.207   1.318 -10.893
  241   3HZ   LYS  32           HZ1      LYS  32 117.976   0.741 -11.911
  242    H    LYS  33           HN       LYS  33 122.462   2.554  -8.824
  243    HA   LYS  33           HA       LYS  33 123.331   4.938 -10.173
  244   1HB   LYS  33           HB2      LYS  33 122.637   4.394  -7.277
  245   2HB   LYS  33           HB1      LYS  33 123.013   6.004  -7.892
  246   1HG   LYS  33           HG2      LYS  33 121.173   5.806  -9.530
  247   2HG   LYS  33           HG1      LYS  33 120.796   4.198  -8.912
  248   1HD   LYS  33           HD2      LYS  33 120.329   5.161  -6.686
  249   2HD   LYS  33           HD1      LYS  33 120.698   6.770  -7.307
  250   1HE   LYS  33           HE2      LYS  33 118.845   6.670  -8.860
  251   2HE   LYS  33           HE1      LYS  33 118.538   4.980  -8.452
  252   1HZ   LYS  33           HZ3      LYS  33 118.568   6.566  -6.110
  253   2HZ   LYS  33           HZ2      LYS  33 117.473   7.221  -7.233
  254   3HZ   LYS  33           HZ1      LYS  33 117.317   5.606  -6.733
  255    H    LEU  34           HN       LEU  34 124.822   3.019  -7.548
  256    HA   LEU  34           HA       LEU  34 127.109   4.724  -7.237
  257   1HB   LEU  34           HB2      LEU  34 126.723   1.767  -6.690
  258   2HB   LEU  34           HB1      LEU  34 128.174   2.654  -6.242
  259    HG   LEU  34           HG       LEU  34 125.395   3.453  -5.339
  260   1HD1  LEU  34          HD12      LEU  34 126.020   1.200  -4.494
  261   2HD1  LEU  34          HD11      LEU  34 127.507   1.877  -3.834
  262   3HD1  LEU  34          HD13      LEU  34 125.944   2.393  -3.199
  263   1HD2  LEU  34          HD23      LEU  34 128.209   4.372  -4.708
  264   2HD2  LEU  34          HD22      LEU  34 126.782   5.339  -5.064
  265   3HD2  LEU  34          HD21      LEU  34 126.933   4.548  -3.503
  266    H    GLU  35           HN       GLU  35 126.427   1.955  -9.307
  267    HA   GLU  35           HA       GLU  35 129.035   1.646 -10.424
  268   1HB   GLU  35           HB2      GLU  35 127.234  -0.005 -10.751
  269   2HB   GLU  35           HB1      GLU  35 126.344   1.153 -11.740
  270   1HG   GLU  35           HG2      GLU  35 128.151   1.184 -13.388
  271   2HG   GLU  35           HG1      GLU  35 129.121   0.111 -12.378
  272    H    GLU  36           HN       GLU  36 126.311   3.681 -11.500
  273    HA   GLU  36           HA       GLU  36 127.662   4.748 -13.804
  274   1HB   GLU  36           HB2      GLU  36 125.209   4.905 -13.498
  275   2HB   GLU  36           HB1      GLU  36 125.452   5.975 -12.119
  276   1HG   GLU  36           HG2      GLU  36 126.553   7.627 -13.579
  277   2HG   GLU  36           HG1      GLU  36 126.342   6.553 -14.963
  278    H    ARG  37           HN       ARG  37 127.948   5.314 -10.428
  279    HA   ARG  37           HA       ARG  37 129.168   7.984 -10.771
  280   1HB   ARG  37           HB2      ARG  37 128.698   6.227  -8.355
  281   2HB   ARG  37           HB1      ARG  37 129.502   7.788  -8.266
  282   1HG   ARG  37           HG2      ARG  37 126.773   7.484  -9.534
  283   2HG   ARG  37           HG1      ARG  37 126.952   7.709  -7.797
  284   1HD   ARG  37           HD2      ARG  37 127.802   9.621  -9.992
  285   2HD   ARG  37           HD1      ARG  37 126.595   9.884  -8.742
  286    HE   ARG  37           HE       ARG  37 128.923   9.421  -7.315
  287   1HH1  ARG  37          HH21      ARG  37 127.897  11.518  -9.852
  288   2HH1  ARG  37          HH22      ARG  37 128.987  12.793  -9.420
  289   1HH2  ARG  37          HH11      ARG  37 130.354  11.073  -6.737
  290   2HH2  ARG  37          HH12      ARG  37 130.379  12.540  -7.657
  291    H    GLY  38           HN       GLY  38 130.289   4.901 -11.265
  292   1HA   GLY  38           HA2      GLY  38 132.626   4.648 -11.965
  293   2HA   GLY  38           HA1      GLY  38 133.103   5.797 -10.724
  294    H    PHE  39           HN       PHE  39 130.827   3.697  -9.394
  295    HA   PHE  39           HA       PHE  39 133.024   2.066  -8.164
  296   1HB   PHE  39           HB2      PHE  39 130.207   2.632  -7.230
  297   2HB   PHE  39           HB1      PHE  39 131.382   1.649  -6.363
  298    HD1  PHE  39           HD2      PHE  39 133.369   2.671  -5.340
  299    HD2  PHE  39           HD1      PHE  39 130.431   5.037  -7.376
  300    HE1  PHE  39           HE2      PHE  39 134.348   4.729  -4.358
  301    HE2  PHE  39           HE1      PHE  39 131.404   7.097  -6.399
  302    HZ   PHE  39           HZ       PHE  39 133.366   6.943  -4.889
  303    H    ASP  40           HN       ASP  40 132.924   0.756 -10.228
  304    HA   ASP  40           HA       ASP  40 130.526  -0.874 -10.647
  305   1HB   ASP  40           HB2      ASP  40 131.877  -1.965 -12.402
  306   2HB   ASP  40           HB1      ASP  40 131.959  -0.208 -12.547
  307    H    LYS  41           HN       LYS  41 133.268  -1.036  -8.607
  308    HA   LYS  41           HA       LYS  41 132.683  -3.919  -8.016
  309   1HB   LYS  41           HB2      LYS  41 135.398  -2.563  -8.029
  310   2HB   LYS  41           HB1      LYS  41 135.089  -4.224  -7.531
  311   1HG   LYS  41           HG2      LYS  41 134.299  -3.235 -10.272
  312   2HG   LYS  41           HG1      LYS  41 135.924  -3.835  -9.950
  313   1HD   LYS  41           HD2      LYS  41 134.860  -5.958  -9.058
  314   2HD   LYS  41           HD1      LYS  41 133.317  -5.359  -9.665
  315   1HE   LYS  41           HE2      LYS  41 135.791  -5.726 -11.371
  316   2HE   LYS  41           HE1      LYS  41 134.463  -6.881 -11.278
  317   1HZ   LYS  41           HZ2      LYS  41 132.980  -4.975 -11.915
  318   2HZ   LYS  41           HZ1      LYS  41 134.387  -4.098 -12.288
  319   3HZ   LYS  41           HZ3      LYS  41 134.030  -5.525 -13.132
  320    H    ALA  42           HN       ALA  42 132.902  -4.509  -5.835
  321    HA   ALA  42           HA       ALA  42 132.083  -2.540  -3.940
  322   1HB   ALA  42           HB2      ALA  42 133.182  -5.334  -3.590
  323   2HB   ALA  42           HB1      ALA  42 132.552  -4.364  -2.258
  324   3HB   ALA  42           HB3      ALA  42 131.490  -4.839  -3.584
  325    H    TYR  43           HN       TYR  43 135.303  -3.976  -4.549
  326    HA   TYR  43           HA       TYR  43 136.551  -2.880  -2.256
  327   1HB   TYR  43           HB2      TYR  43 138.682  -3.246  -3.358
  328   2HB   TYR  43           HB1      TYR  43 137.609  -4.603  -3.680
  329    HD1  TYR  43           HD1      TYR  43 138.911  -1.421  -5.117
  330    HD2  TYR  43           HD2      TYR  43 137.062  -5.215  -5.902
  331    HE1  TYR  43           HE1      TYR  43 139.256  -1.087  -7.545
  332    HE2  TYR  43           HE2      TYR  43 137.402  -4.878  -8.335
  333    HH   TYR  43           HH       TYR  43 138.518  -3.637  -9.876
  334    H    VAL  44           HN       VAL  44 135.494  -1.209  -5.116
  335    HA   VAL  44           HA       VAL  44 137.318   1.063  -4.683
  336    HB   VAL  44           HB       VAL  44 134.755   0.953  -6.319
  337   1HG1  VAL  44          HG13      VAL  44 135.603   3.238  -5.673
  338   2HG1  VAL  44          HG12      VAL  44 137.119   2.848  -6.481
  339   3HG1  VAL  44          HG11      VAL  44 135.625   2.943  -7.409
  340   1HG2  VAL  44          HG22      VAL  44 137.648   0.575  -7.157
  341   2HG2  VAL  44          HG21      VAL  44 136.424  -0.691  -7.098
  342   3HG2  VAL  44          HG23      VAL  44 136.262   0.634  -8.249
  343    H    VAL  45           HN       VAL  45 134.131   0.019  -3.808
  344    HA   VAL  45           HA       VAL  45 133.277   2.529  -2.575
  345    HB   VAL  45           HB       VAL  45 132.231  -0.301  -2.195
  346   1HG1  VAL  45          HG11      VAL  45 131.052   2.411  -1.524
  347   2HG1  VAL  45          HG13      VAL  45 130.168   0.888  -1.436
  348   3HG1  VAL  45          HG12      VAL  45 131.548   1.170  -0.375
  349   1HG2  VAL  45          HG21      VAL  45 131.407   1.940  -4.059
  350   2HG2  VAL  45          HG23      VAL  45 132.042   0.360  -4.522
  351   3HG2  VAL  45          HG22      VAL  45 130.445   0.488  -3.783
  352    H    LEU  46           HN       LEU  46 134.806  -0.476  -1.573
  353    HA   LEU  46           HA       LEU  46 134.746  -0.081   1.254
  354   1HB   LEU  46           HB2      LEU  46 135.461  -2.206   0.141
  355   2HB   LEU  46           HB1      LEU  46 136.900  -1.388  -0.451
  356    HG   LEU  46           HG       LEU  46 137.457  -0.874   1.990
  357   1HD1  LEU  46          HD12      LEU  46 135.120  -2.737   2.351
  358   2HD1  LEU  46          HD11      LEU  46 136.397  -2.637   3.561
  359   3HD1  LEU  46          HD13      LEU  46 135.451  -1.206   3.162
  360   1HD2  LEU  46          HD22      LEU  46 137.543  -3.550   0.665
  361   2HD2  LEU  46          HD21      LEU  46 138.862  -2.499   1.165
  362   3HD2  LEU  46          HD23      LEU  46 138.012  -3.473   2.362
  363    H    GLY  47           HN       GLY  47 136.886   1.013  -1.309
  364   1HA   GLY  47           HA2      GLY  47 138.945   2.196   0.227
  365   2HA   GLY  47           HA1      GLY  47 138.476   2.733  -1.383
  366    H    GLN  48           HN       GLN  48 135.840   3.627  -0.881
  367    HA   GLN  48           HA       GLN  48 136.333   6.232   0.172
  368   1HB   GLN  48           HB2      GLN  48 134.443   5.622  -1.369
  369   2HB   GLN  48           HB1      GLN  48 133.658   4.811  -0.015
  370   1HG   GLN  48           HG2      GLN  48 132.742   7.061  -0.231
  371   2HG   GLN  48           HG1      GLN  48 133.697   6.970   1.248
  372   1HE2  GLN  48          HE22      GLN  48 135.573   9.758   0.205
  373   2HE2  GLN  48          HE21      GLN  48 134.737   8.969   1.456
  374    H    PHE  49           HN       PHE  49 134.843   3.354   1.643
  375    HA   PHE  49           HA       PHE  49 134.158   4.521   4.152
  376   1HB   PHE  49           HB2      PHE  49 133.379   2.291   3.403
  377   2HB   PHE  49           HB1      PHE  49 135.025   1.677   3.529
  378    HD1  PHE  49           HD1      PHE  49 132.496   3.527   5.597
  379    HD2  PHE  49           HD2      PHE  49 135.632   0.590   5.516
  380    HE1  PHE  49           HE1      PHE  49 132.097   3.034   7.993
  381    HE2  PHE  49           HE2      PHE  49 135.233   0.101   7.914
  382    HZ   PHE  49           HZ       PHE  49 133.466   1.323   9.153
  383    H    LEU  50           HN       LEU  50 137.120   3.034   2.960
  384    HA   LEU  50           HA       LEU  50 138.559   3.212   5.468
  385   1HB   LEU  50           HB2      LEU  50 139.560   3.060   2.607
  386   2HB   LEU  50           HB1      LEU  50 140.596   2.910   4.026
  387    HG   LEU  50           HG       LEU  50 138.204   1.119   3.495
  388   1HD1  LEU  50          HD11      LEU  50 141.118   0.824   2.761
  389   2HD1  LEU  50          HD13      LEU  50 140.083  -0.587   2.983
  390   3HD1  LEU  50          HD12      LEU  50 139.698   0.602   1.742
  391   1HD2  LEU  50          HD21      LEU  50 140.396   1.200   5.570
  392   2HD2  LEU  50          HD23      LEU  50 138.665   0.939   5.788
  393   3HD2  LEU  50          HD22      LEU  50 139.667  -0.343   5.124
  394    H    VAL  51           HN       VAL  51 138.256   5.345   2.661
  395    HA   VAL  51           HA       VAL  51 140.170   7.293   3.533
  396    HB   VAL  51           HB       VAL  51 137.809   7.457   1.646
  397   1HG1  VAL  51          HG11      VAL  51 139.892   9.538   2.358
  398   2HG1  VAL  51          HG13      VAL  51 138.968   9.585   0.858
  399   3HG1  VAL  51          HG12      VAL  51 138.138   9.710   2.406
  400   1HG2  VAL  51          HG22      VAL  51 139.855   6.035   1.112
  401   2HG2  VAL  51          HG21      VAL  51 139.478   7.291  -0.068
  402   3HG2  VAL  51          HG23      VAL  51 140.785   7.534   1.092
  403    H    LEU  52           HN       LEU  52 136.827   6.735   4.435
  404    HA   LEU  52           HA       LEU  52 136.585   9.419   5.658
  405   1HB   LEU  52           HB2      LEU  52 134.705   7.053   5.508
  406   2HB   LEU  52           HB1      LEU  52 134.318   8.540   6.368
  407    HG   LEU  52           HG       LEU  52 135.072   8.409   3.431
  408   1HD1  LEU  52          HD13      LEU  52 132.399   8.487   4.839
  409   2HD1  LEU  52          HD12      LEU  52 132.591   8.982   3.157
  410   3HD1  LEU  52          HD11      LEU  52 132.959   7.324   3.635
  411   1HD2  LEU  52          HD22      LEU  52 134.413  10.630   5.343
  412   2HD2  LEU  52          HD21      LEU  52 135.517  10.617   3.971
  413   3HD2  LEU  52          HD23      LEU  52 133.783  10.765   3.703
  414    H    LYS  53           HN       LYS  53 138.397   7.017   6.657
  415    HA   LYS  53           HA       LYS  53 139.046   6.176   8.752
  416   1HB   LYS  53           HB2      LYS  53 137.839   8.825   9.602
  417   2HB   LYS  53           HB1      LYS  53 138.929   7.841  10.579
  418   1HG   LYS  53           HG2      LYS  53 140.671   8.039   8.844
  419   2HG   LYS  53           HG1      LYS  53 139.586   9.026   7.866
  420   1HD   LYS  53           HD2      LYS  53 139.493  10.711   9.668
  421   2HD   LYS  53           HD1      LYS  53 140.583   9.725  10.644
  422   1HE   LYS  53           HE2      LYS  53 141.838  11.493   9.482
  423   2HE   LYS  53           HE1      LYS  53 142.310   9.903   8.881
  424   1HZ   LYS  53           HZ1      LYS  53 140.718  10.209   7.050
  425   2HZ   LYS  53           HZ3      LYS  53 140.406  11.784   7.597
  426   3HZ   LYS  53           HZ2      LYS  53 141.957  11.372   7.040
  427    H    LYS  54           HN       LYS  54 136.415   5.322   7.870
  428    HA   LYS  54           HA       LYS  54 134.558   4.167   8.682
  429   1HB   LYS  54           HB2      LYS  54 136.070   4.324  11.311
  430   2HB   LYS  54           HB1      LYS  54 134.713   3.260  10.965
  431   1HG   LYS  54           HG2      LYS  54 136.007   2.176   9.171
  432   2HG   LYS  54           HG1      LYS  54 137.368   3.244   9.505
  433   1HD   LYS  54           HD2      LYS  54 137.484   2.357  11.817
  434   2HD   LYS  54           HD1      LYS  54 136.153   1.260  11.449
  435   1HE   LYS  54           HE2      LYS  54 138.810   1.307   9.988
  436   2HE   LYS  54           HE1      LYS  54 138.369   0.149  11.241
  437   1HZ   LYS  54           HZ2      LYS  54 136.393  -0.398   9.811
  438   2HZ   LYS  54           HZ1      LYS  54 137.136   0.495   8.571
  439   3HZ   LYS  54           HZ3      LYS  54 137.902  -0.884   9.197
  440    H    ASP  55           HN       ASP  55 134.761   7.277   8.985
  441    HA   ASP  55           HA       ASP  55 133.177   7.874  11.335
  442   1HB   ASP  55           HB2      ASP  55 133.734   9.373   8.769
  443   2HB   ASP  55           HB1      ASP  55 132.632  10.014   9.988
  444    H    GLU  56           HN       GLU  56 131.182   7.064  11.613
  445    HA   GLU  56           HA       GLU  56 129.580   5.910   9.562
  446   1HB   GLU  56           HB2      GLU  56 129.520   5.354  11.997
  447   2HB   GLU  56           HB1      GLU  56 128.682   6.879  12.281
  448   1HG   GLU  56           HG2      GLU  56 126.847   6.181  10.827
  449   2HG   GLU  56           HG1      GLU  56 127.697   4.682  10.438
  450    H    ASP  57           HN       ASP  57 129.331   9.132  11.100
  451    HA   ASP  57           HA       ASP  57 126.848   9.789   9.767
  452   1HB   ASP  57           HB2      ASP  57 128.965  11.514  11.072
  453   2HB   ASP  57           HB1      ASP  57 127.468  12.164  10.402
  454    H    LEU  58           HN       LEU  58 130.246  10.350   9.021
  455    HA   LEU  58           HA       LEU  58 129.670  11.961   6.675
  456   1HB   LEU  58           HB2      LEU  58 132.158  10.365   7.367
  457   2HB   LEU  58           HB1      LEU  58 132.044  11.547   6.066
  458    HG   LEU  58           HG       LEU  58 131.594  12.145   9.009
  459   1HD1  LEU  58          HD13      LEU  58 133.940  12.591   7.153
  460   2HD1  LEU  58          HD12      LEU  58 133.739  13.489   8.656
  461   3HD1  LEU  58          HD11      LEU  58 133.927  11.737   8.695
  462   1HD2  LEU  58          HD21      LEU  58 131.363  13.767   6.480
  463   2HD2  LEU  58          HD23      LEU  58 130.344  13.790   7.919
  464   3HD2  LEU  58          HD22      LEU  58 131.925  14.565   7.949
  465    H    PHE  59           HN       PHE  59 130.225   8.494   7.215
  466    HA   PHE  59           HA       PHE  59 130.230   7.748   4.442
  467   1HB   PHE  59           HB2      PHE  59 130.967   6.199   6.216
  468   2HB   PHE  59           HB1      PHE  59 129.319   6.134   6.843
  469    HD1  PHE  59           HD1      PHE  59 131.132   5.750   3.575
  470    HD2  PHE  59           HD2      PHE  59 127.960   4.362   6.123
  471    HE1  PHE  59           HE1      PHE  59 130.591   3.972   1.933
  472    HE2  PHE  59           HE2      PHE  59 127.421   2.583   4.478
  473    HZ   PHE  59           HZ       PHE  59 128.735   2.388   2.384
  474    H    ARG  60           HN       ARG  60 127.592   7.899   6.847
  475    HA   ARG  60           HA       ARG  60 125.524   6.969   5.144
  476   1HB   ARG  60           HB2      ARG  60 125.454   8.872   7.494
  477   2HB   ARG  60           HB1      ARG  60 124.001   8.271   6.698
  478   1HG   ARG  60           HG2      ARG  60 124.571   5.987   7.242
  479   2HG   ARG  60           HG1      ARG  60 126.143   6.474   7.864
  480   1HD   ARG  60           HD2      ARG  60 124.460   6.078   9.674
  481   2HD   ARG  60           HD1      ARG  60 125.091   7.727   9.670
  482    HE   ARG  60           HE       ARG  60 122.823   7.907   8.101
  483   1HH1  ARG  60          HH21      ARG  60 123.570   6.637  11.220
  484   2HH1  ARG  60          HH22      ARG  60 122.022   7.019  11.893
  485   1HH2  ARG  60          HH11      ARG  60 120.798   8.418   8.964
  486   2HH2  ARG  60          HH12      ARG  60 120.453   8.029  10.617
  487    H    GLU  61           HN       GLU  61 126.600  10.352   5.726
  488    HA   GLU  61           HA       GLU  61 124.622  11.510   4.004
  489   1HB   GLU  61           HB2      GLU  61 126.025  12.777   5.666
  490   2HB   GLU  61           HB1      GLU  61 127.403  12.569   4.588
  491   1HG   GLU  61           HG2      GLU  61 126.431  14.739   4.141
  492   2HG   GLU  61           HG1      GLU  61 126.057  13.690   2.774
  493    H    TRP  62           HN       TRP  62 127.890  10.233   3.438
  494    HA   TRP  62           HA       TRP  62 128.152  11.104   0.747
  495   1HB   TRP  62           HB2      TRP  62 130.088  10.240   1.884
  496   2HB   TRP  62           HB1      TRP  62 129.290   8.700   2.196
  497    HD1  TRP  62           HD1      TRP  62 130.780  10.768  -0.679
  498    HE1  TRP  62           HE1      TRP  62 131.286   9.184  -2.655
  499    HE3  TRP  62           HE3      TRP  62 128.737   6.433   1.106
  500    HZ2  TRP  62           HZ2      TRP  62 130.893   6.441  -3.373
  501    HZ3  TRP  62           HZ3      TRP  62 128.826   4.356  -0.242
  502    HH2  TRP  62           HH2      TRP  62 129.899   4.357  -2.476
  503    H    LEU  63           HN       LEU  63 126.902   7.994   2.007
  504    HA   LEU  63           HA       LEU  63 126.309   6.962  -0.606
  505   1HB   LEU  63           HB2      LEU  63 126.578   5.506   1.369
  506   2HB   LEU  63           HB1      LEU  63 125.135   6.216   2.089
  507    HG   LEU  63           HG       LEU  63 123.801   5.395   0.152
  508   1HD1  LEU  63          HD12      LEU  63 126.510   4.401  -0.706
  509   2HD1  LEU  63          HD11      LEU  63 125.062   3.517  -1.184
  510   3HD1  LEU  63          HD13      LEU  63 125.264   5.198  -1.666
  511   1HD2  LEU  63          HD22      LEU  63 124.010   4.056   2.223
  512   2HD2  LEU  63          HD21      LEU  63 123.846   3.024   0.802
  513   3HD2  LEU  63          HD23      LEU  63 125.427   3.253   1.549
  514    H    LYS  64           HN       LYS  64 124.248   8.465   1.873
  515    HA   LYS  64           HA       LYS  64 121.822   8.345   0.358
  516   1HB   LYS  64           HB2      LYS  64 121.926   8.867   2.804
  517   2HB   LYS  64           HB1      LYS  64 122.593  10.452   2.399
  518   1HG   LYS  64           HG2      LYS  64 120.571  10.970   1.078
  519   2HG   LYS  64           HG1      LYS  64 119.903   9.387   1.481
  520   1HD   LYS  64           HD2      LYS  64 119.982   9.977   3.881
  521   2HD   LYS  64           HD1      LYS  64 120.612  11.569   3.461
  522   1HE   LYS  64           HE2      LYS  64 118.594  12.175   2.329
  523   2HE   LYS  64           HE1      LYS  64 117.996  10.516   2.366
  524   1HZ   LYS  64           HZ3      LYS  64 118.632  11.506   4.972
  525   2HZ   LYS  64           HZ2      LYS  64 117.456  12.459   4.199
  526   3HZ   LYS  64           HZ1      LYS  64 117.200  10.791   4.407
  527    H    ASP  65           HN       ASP  65 124.236  10.923   0.688
  528    HA   ASP  65           HA       ASP  65 122.949  12.724  -1.150
  529   1HB   ASP  65           HB2      ASP  65 124.654  13.406   0.551
  530   2HB   ASP  65           HB1      ASP  65 125.885  12.588  -0.411
  531    H    THR  66           HN       THR  66 125.224  10.072  -1.535
  532    HA   THR  66           HA       THR  66 125.895  10.777  -4.275
  533    HB   THR  66           HB       THR  66 126.354   8.238  -2.688
  534    HG1  THR  66           HG1      THR  66 128.460   9.786  -3.470
  535   1HG2  THR  66          HG23      THR  66 127.277   9.103  -5.435
  536   2HG2  THR  66          HG22      THR  66 128.077   7.830  -4.513
  537   3HG2  THR  66          HG21      THR  66 126.395   7.638  -5.007
  538    H    CYS  67           HN       CYS  67 123.509   8.566  -2.770
  539    HA   CYS  67           HA       CYS  67 122.452   8.069  -5.543
  540   1HB   CYS  67           HB2      CYS  67 122.041   5.761  -4.977
  541   2HB   CYS  67           HB1      CYS  67 123.736   6.118  -4.646
  542    HG   CYS  67           HG       CYS  67 122.480   4.866  -2.586
  543    H    GLY  68           HN       GLY  68 121.692   8.445  -2.110
  544   1HA   GLY  68           HA2      GLY  68 119.592   9.578  -1.497
  545   2HA   GLY  68           HA1      GLY  68 118.812   8.801  -2.874
  546    H    ALA  69           HN       ALA  69 121.002   6.795  -1.148
  547    HA   ALA  69           HA       ALA  69 119.130   4.796  -0.528
  548   1HB   ALA  69           HB3      ALA  69 121.602   4.496  -0.421
  549   2HB   ALA  69           HB2      ALA  69 121.633   5.470   1.051
  550   3HB   ALA  69           HB1      ALA  69 120.797   3.917   1.038
  551    H    ASN  70           HN       ASN  70 118.071   4.230   1.516
  552    HA   ASN  70           HA       ASN  70 117.231   6.640   3.006
  553   1HB   ASN  70           HB2      ASN  70 116.278   3.764   3.152
  554   2HB   ASN  70           HB1      ASN  70 115.541   5.132   3.989
  555   1HD2  ASN  70          HD22      ASN  70 114.701   6.623   0.647
  556   2HD2  ASN  70          HD21      ASN  70 115.696   7.100   1.937
  557    H    ALA  71           HN       ALA  71 116.923   6.272   5.441
  558    HA   ALA  71           HA       ALA  71 119.458   5.975   6.670
  559   1HB   ALA  71           HB3      ALA  71 117.349   7.175   7.537
  560   2HB   ALA  71           HB2      ALA  71 116.846   5.593   8.134
  561   3HB   ALA  71           HB1      ALA  71 118.339   6.324   8.724
  562    H    LYS  72           HN       LYS  72 116.870   3.589   6.187
  563    HA   LYS  72           HA       LYS  72 118.042   1.648   7.992
  564   1HB   LYS  72           HB2      LYS  72 116.032   1.392   5.743
  565   2HB   LYS  72           HB1      LYS  72 116.521   0.040   6.767
  566   1HG   LYS  72           HG2      LYS  72 115.693   1.125   8.742
  567   2HG   LYS  72           HG1      LYS  72 115.446   2.641   7.876
  568   1HD   LYS  72           HD2      LYS  72 113.313   1.430   8.195
  569   2HD   LYS  72           HD1      LYS  72 113.716   1.586   6.487
  570   1HE   LYS  72           HE2      LYS  72 114.559  -0.866   8.023
  571   2HE   LYS  72           HE1      LYS  72 112.924  -0.736   7.376
  572   1HZ   LYS  72           HZ1      LYS  72 114.623   0.077   5.354
  573   2HZ   LYS  72           HZ3      LYS  72 115.332  -1.318   6.011
  574   3HZ   LYS  72           HZ2      LYS  72 113.734  -1.370   5.434
  575    H    GLN  73           HN       GLN  73 118.250   2.187   4.495
  576    HA   GLN  73           HA       GLN  73 119.769  -0.183   3.949
  577   1HB   GLN  73           HB2      GLN  73 119.564   2.424   2.419
  578   2HB   GLN  73           HB1      GLN  73 120.284   0.941   1.792
  579   1HG   GLN  73           HG2      GLN  73 117.436   1.129   2.811
  580   2HG   GLN  73           HG1      GLN  73 117.880   1.271   1.109
  581   1HE2  GLN  73          HE22      GLN  73 119.153  -2.232   1.163
  582   2HE2  GLN  73          HE21      GLN  73 119.820  -0.710   0.819
  583    H    SER  74           HN       SER  74 120.716   3.139   4.794
  584    HA   SER  74           HA       SER  74 123.504   2.756   4.249
  585   1HB   SER  74           HB2      SER  74 123.823   4.840   5.362
  586   2HB   SER  74           HB1      SER  74 122.264   4.964   4.555
  587    HG   SER  74           HG       SER  74 122.057   3.862   7.028
  588    H    ARG  75           HN       ARG  75 121.513   2.260   7.172
  589    HA   ARG  75           HA       ARG  75 123.679   1.816   8.965
  590   1HB   ARG  75           HB2      ARG  75 120.839   0.775   8.958
  591   2HB   ARG  75           HB1      ARG  75 121.973   0.459  10.274
  592   1HG   ARG  75           HG2      ARG  75 122.292   2.884  10.591
  593   2HG   ARG  75           HG1      ARG  75 121.160   3.207   9.281
  594   1HD   ARG  75           HD2      ARG  75 119.373   2.056  10.539
  595   2HD   ARG  75           HD1      ARG  75 120.507   1.735  11.851
  596    HE   ARG  75           HE       ARG  75 120.619   4.490  11.523
  597   1HH1  ARG  75          HH21      ARG  75 118.166   2.119  12.016
  598   2HH1  ARG  75          HH22      ARG  75 117.122   3.186  12.894
  599   1HH2  ARG  75          HH11      ARG  75 119.272   5.900  12.664
  600   2HH2  ARG  75          HH12      ARG  75 117.749   5.329  13.260
  601    H    ASP  76           HN       ASP  76 122.019  -0.430   6.737
  602    HA   ASP  76           HA       ASP  76 123.324  -2.775   7.735
  603   1HB   ASP  76           HB2      ASP  76 122.102  -2.129   5.043
  604   2HB   ASP  76           HB1      ASP  76 122.716  -3.726   5.465
  605    H    CYS  77           HN       CYS  77 124.257  -0.474   5.151
  606    HA   CYS  77           HA       CYS  77 126.516  -2.040   4.291
  607   1HB   CYS  77           HB2      CYS  77 125.785   0.879   3.991
  608   2HB   CYS  77           HB1      CYS  77 127.250   0.187   3.292
  609    HG   CYS  77           HG       CYS  77 125.595  -1.527   2.003
  610    H    PHE  78           HN       PHE  78 126.155   0.621   6.669
  611    HA   PHE  78           HA       PHE  78 128.939   0.985   7.122
  612   1HB   PHE  78           HB2      PHE  78 127.244   2.541   7.980
  613   2HB   PHE  78           HB1      PHE  78 126.643   1.301   9.079
  614    HD1  PHE  78           HD1      PHE  78 129.480   3.549   8.314
  615    HD2  PHE  78           HD2      PHE  78 127.856   0.689  11.077
  616    HE1  PHE  78           HE1      PHE  78 131.178   4.210   9.998
  617    HE2  PHE  78           HE2      PHE  78 129.553   1.348  12.759
  618    HZ   PHE  78           HZ       PHE  78 131.216   3.109  12.219
  619    H    GLY  79           HN       GLY  79 126.672  -0.903   9.164
  620   1HA   GLY  79           HA2      GLY  79 128.691  -2.130  10.734
  621   2HA   GLY  79           HA1      GLY  79 127.067  -2.779  10.507
  622    H    CYS  80           HN       CYS  80 127.379  -2.995   7.585
  623    HA   CYS  80           HA       CYS  80 128.511  -5.661   7.507
  624   1HB   CYS  80           HB2      CYS  80 126.694  -4.970   5.989
  625   2HB   CYS  80           HB1      CYS  80 127.768  -3.795   5.232
  626    HG   CYS  80           HG       CYS  80 127.887  -6.854   4.826
  627    H    LEU  81           HN       LEU  81 129.627  -2.512   6.144
  628    HA   LEU  81           HA       LEU  81 132.113  -3.640   5.195
  629   1HB   LEU  81           HB2      LEU  81 131.318  -0.776   5.806
  630   2HB   LEU  81           HB1      LEU  81 132.795  -1.248   4.966
  631    HG   LEU  81           HG       LEU  81 129.993  -1.939   4.029
  632   1HD1  LEU  81          HD11      LEU  81 131.903   0.259   3.201
  633   2HD1  LEU  81          HD13      LEU  81 130.512  -0.232   2.235
  634   3HD1  LEU  81          HD12      LEU  81 130.271   0.445   3.844
  635   1HD2  LEU  81          HD23      LEU  81 132.770  -2.477   2.987
  636   2HD2  LEU  81          HD22      LEU  81 131.362  -3.540   3.016
  637   3HD2  LEU  81          HD21      LEU  81 131.457  -2.243   1.833
  638    H    ARG  82           HN       ARG  82 131.141  -1.933   8.166
  639    HA   ARG  82           HA       ARG  82 133.744  -1.641   9.276
  640   1HB   ARG  82           HB2      ARG  82 131.682  -0.553  10.176
  641   2HB   ARG  82           HB1      ARG  82 131.165  -2.124  10.792
  642   1HG   ARG  82           HG2      ARG  82 133.194  -2.271  12.173
  643   2HG   ARG  82           HG1      ARG  82 133.754  -0.724  11.537
  644   1HD   ARG  82           HD2      ARG  82 132.724  -0.267  13.659
  645   2HD   ARG  82           HD1      ARG  82 131.609   0.296  12.419
  646    HE   ARG  82           HE       ARG  82 130.838  -2.340  12.954
  647   1HH1  ARG  82          HH21      ARG  82 131.281   0.612  14.678
  648   2HH1  ARG  82          HH22      ARG  82 130.103   0.238  15.892
  649   1HH2  ARG  82          HH11      ARG  82 129.302  -2.851  14.536
  650   2HH2  ARG  82          HH12      ARG  82 128.983  -1.722  15.810
  651    H    GLU  83           HN       GLU  83 131.448  -4.338   9.449
  652    HA   GLU  83           HA       GLU  83 133.055  -5.879  11.280
  653   1HB   GLU  83           HB2      GLU  83 130.777  -6.618   9.435
  654   2HB   GLU  83           HB1      GLU  83 131.600  -7.809  10.443
  655   1HG   GLU  83           HG2      GLU  83 131.074  -6.483  12.452
  656   2HG   GLU  83           HG1      GLU  83 130.252  -5.285  11.456
  657    H    TRP  84           HN       TRP  84 132.902  -5.777   7.699
  658    HA   TRP  84           HA       TRP  84 134.549  -8.080   7.301
  659   1HB   TRP  84           HB2      TRP  84 133.273  -6.998   5.465
  660   2HB   TRP  84           HB1      TRP  84 134.349  -5.602   5.563
  661    HD1  TRP  84           HD1      TRP  84 134.239  -9.246   4.484
  662    HE1  TRP  84           HE1      TRP  84 136.342  -9.790   3.104
  663    HE3  TRP  84           HE3      TRP  84 136.867  -4.912   5.138
  664    HZ2  TRP  84           HZ2      TRP  84 138.814  -8.553   2.369
  665    HZ3  TRP  84           HZ3      TRP  84 139.094  -4.626   4.085
  666    HH2  TRP  84           HH2      TRP  84 140.070  -6.442   2.702
  667    H    CYS  85           HN       CYS  85 135.338  -4.621   7.696
  668    HA   CYS  85           HA       CYS  85 138.142  -4.851   7.300
  669   1HB   CYS  85           HB2      CYS  85 136.478  -2.937   8.949
  670   2HB   CYS  85           HB1      CYS  85 138.225  -2.771   8.782
  671    HG   CYS  85           HG       CYS  85 136.616  -1.513   6.864
  672    H    ASP  86           HN       ASP  86 136.171  -5.255  10.216
  673    HA   ASP  86           HA       ASP  86 138.283  -5.510  12.089
  674   1HB   ASP  86           HB2      ASP  86 135.519  -6.744  12.017
  675   2HB   ASP  86           HB1      ASP  86 136.604  -6.894  13.398
  676    H    ALA  87           HN       ALA  87 136.988  -7.802   9.753
  677    HA   ALA  87           HA       ALA  87 138.586 -10.013  10.927
  678   1HB   ALA  87           HB1      ALA  87 136.208 -10.283  10.002
  679   2HB   ALA  87           HB3      ALA  87 136.936 -10.138   8.403
  680   3HB   ALA  87           HB2      ALA  87 137.407 -11.459   9.469
  681    H    PHE  88           HN       PHE  88 138.571  -7.929   8.060
  682    HA   PHE  88           HA       PHE  88 141.026  -9.336   7.067
  683   1HB   PHE  88           HB2      PHE  88 139.018  -7.582   5.639
  684   2HB   PHE  88           HB1      PHE  88 140.485  -8.228   4.898
  685    HD1  PHE  88           HD2      PHE  88 140.808 -10.703   4.713
  686    HD2  PHE  88           HD1      PHE  88 137.098  -8.975   6.017
  687    HE1  PHE  88           HE2      PHE  88 139.655 -12.855   4.287
  688    HE2  PHE  88           HE1      PHE  88 135.945 -11.129   5.594
  689    HZ   PHE  88           HZ       PHE  88 137.224 -13.065   4.726
  690    H    LEU  89           HN       LEU  89 140.299  -6.626   8.841
  691    HA   LEU  89           HA       LEU  89 142.857  -5.349   8.011
  692   1HB   LEU  89           HB2      LEU  89 140.914  -4.222   6.809
  693   2HB   LEU  89           HB1      LEU  89 140.311  -3.748   8.395
  694    HG   LEU  89           HG       LEU  89 142.707  -2.759   8.758
  695   1HD1  LEU  89          HD11      LEU  89 142.605  -3.066   5.740
  696   2HD1  LEU  89          HD13      LEU  89 143.658  -1.915   6.560
  697   3HD1  LEU  89          HD12      LEU  89 143.860  -3.642   6.841
  698   1HD2  LEU  89          HD22      LEU  89 140.756  -1.515   6.801
  699   2HD2  LEU  89          HD21      LEU  89 140.689  -1.380   8.556
  700   3HD2  LEU  89          HD23      LEU  89 142.019  -0.636   7.665
  701   1H    MET   1           HT2      MET   1 168.984  -5.138   0.765
  702   2H    MET   1           HT1      MET   1 170.341  -6.077   1.165
  703   3H    MET   1           HT3      MET   1 170.415  -4.999  -0.141
  704    HA   MET   1           HA       MET   1 170.081  -6.924  -1.279
  705   1HB   MET   1           HB2      MET   1 169.950  -8.271   0.829
  706   2HB   MET   1           HB1      MET   1 168.256  -7.820   0.975
  707   1HG   MET   1           HG2      MET   1 168.424 -10.025  -0.071
  708   2HG   MET   1           HG1      MET   1 167.800  -8.861  -1.235
  709   1HE   MET   1           HE3      MET   1 170.733 -10.451   0.329
  710   2HE   MET   1           HE2      MET   1 171.908 -10.789  -0.940
  711   3HE   MET   1           HE1      MET   1 171.828  -9.179  -0.229
  712    H    THR   2           HN       THR   2 169.033  -5.113  -2.481
  713    HA   THR   2           HA       THR   2 167.206  -4.134  -3.578
  714    HB   THR   2           HB       THR   2 165.875  -6.802  -3.020
  715    HG1  THR   2           HG1      THR   2 167.072  -7.629  -4.575
  716   1HG2  THR   2          HG21      THR   2 164.594  -4.816  -4.059
  717   2HG2  THR   2          HG23      THR   2 165.638  -5.044  -5.463
  718   3HG2  THR   2          HG22      THR   2 164.565  -6.342  -4.940
  719    H    THR   3           HN       THR   3 164.663  -5.890  -2.156
  720    HA   THR   3           HA       THR   3 163.673  -3.521  -0.813
  721    HB   THR   3           HB       THR   3 161.832  -5.029  -0.068
  722    HG1  THR   3           HG1      THR   3 162.712  -6.971   0.206
  723   1HG2  THR   3          HG22      THR   3 161.976  -3.962  -2.383
  724   2HG2  THR   3          HG21      THR   3 162.508  -5.540  -2.968
  725   3HG2  THR   3          HG23      THR   3 160.910  -5.360  -2.242
  726    H    SER   4           HN       SER   4 163.387  -3.229   1.448
  727    HA   SER   4           HA       SER   4 165.506  -4.398   3.094
  728   1HB   SER   4           HB2      SER   4 164.627  -2.892   4.845
  729   2HB   SER   4           HB1      SER   4 164.876  -2.024   3.334
  730    HG   SER   4           HG       SER   4 162.816  -1.629   4.346
  731    H    GLN   5           HN       GLN   5 164.816  -5.121   5.381
  732    HA   GLN   5           HA       GLN   5 163.242  -7.503   5.164
  733   1HB   GLN   5           HB2      GLN   5 164.244  -5.948   7.566
  734   2HB   GLN   5           HB1      GLN   5 163.425  -7.505   7.690
  735   1HG   GLN   5           HG2      GLN   5 165.142  -8.537   6.259
  736   2HG   GLN   5           HG1      GLN   5 165.960  -6.981   6.113
  737   1HE2  GLN   5          HE22      GLN   5 167.331  -9.116   8.998
  738   2HE2  GLN   5          HE21      GLN   5 166.918  -9.558   7.412
  739    H    LYS   6           HN       LYS   6 162.392  -4.197   5.961
  740    HA   LYS   6           HA       LYS   6 159.980  -4.685   7.382
  741   1HB   LYS   6           HB2      LYS   6 160.829  -2.404   5.584
  742   2HB   LYS   6           HB1      LYS   6 159.334  -2.392   6.519
  743   1HG   LYS   6           HG2      LYS   6 160.628  -2.702   8.600
  744   2HG   LYS   6           HG1      LYS   6 162.125  -2.708   7.666
  745   1HD   LYS   6           HD2      LYS   6 161.649  -0.420   6.876
  746   2HD   LYS   6           HD1      LYS   6 160.152  -0.408   7.813
  747   1HE   LYS   6           HE2      LYS   6 162.921  -0.789   8.991
  748   2HE   LYS   6           HE1      LYS   6 162.021   0.728   9.006
  749   1HZ   LYS   6           HZ3      LYS   6 161.005  -1.808  10.162
  750   2HZ   LYS   6           HZ2      LYS   6 161.801  -0.610  11.065
  751   3HZ   LYS   6           HZ1      LYS   6 160.318  -0.266  10.313
  752    H    HIS   7           HN       HIS   7 160.705  -4.588   3.919
  753    HA   HIS   7           HA       HIS   7 158.036  -4.554   2.960
  754   1HB   HIS   7           HB2      HIS   7 159.858  -4.195   1.428
  755   2HB   HIS   7           HB1      HIS   7 160.559  -5.768   1.801
  756    HD2  HIS   7           HD2      HIS   7 159.458  -7.920   0.374
  757    HE1  HIS   7           HE1      HIS   7 156.523  -5.709  -1.708
  758    HE2  HIS   7           HE2      HIS   7 157.664  -7.967  -1.517
  759    H    ARG   8           HN       ARG   8 160.118  -7.400   3.666
  760    HA   ARG   8           HA       ARG   8 158.045  -9.299   3.054
  761   1HB   ARG   8           HB2      ARG   8 160.591  -9.532   4.694
  762   2HB   ARG   8           HB1      ARG   8 159.555 -10.902   4.296
  763   1HG   ARG   8           HG2      ARG   8 160.637  -9.094   2.135
  764   2HG   ARG   8           HG1      ARG   8 161.609 -10.413   2.769
  765   1HD   ARG   8           HD2      ARG   8 158.907 -10.636   1.419
  766   2HD   ARG   8           HD1      ARG   8 160.444 -11.190   0.780
  767    HE   ARG   8           HE       ARG   8 158.678 -12.638   2.536
  768   1HH1  ARG   8          HH21      ARG   8 162.037 -11.975   2.060
  769   2HH1  ARG   8          HH22      ARG   8 162.557 -13.319   3.017
  770   1HH2  ARG   8          HH11      ARG   8 159.350 -14.387   3.758
  771   2HH2  ARG   8          HH12      ARG   8 161.044 -14.684   3.972
  772    H    ASP   9           HN       ASP   9 158.990  -7.561   5.946
  773    HA   ASP   9           HA       ASP   9 157.437  -9.176   7.784
  774   1HB   ASP   9           HB2      ASP   9 158.565  -6.382   7.987
  775   2HB   ASP   9           HB1      ASP   9 157.715  -7.176   9.306
  776    H    PHE  10           HN       PHE  10 156.819  -6.188   5.969
  777    HA   PHE  10           HA       PHE  10 154.309  -5.573   7.221
  778   1HB   PHE  10           HB2      PHE  10 155.747  -4.025   5.826
  779   2HB   PHE  10           HB1      PHE  10 155.176  -4.889   4.401
  780    HD1  PHE  10           HD2      PHE  10 152.812  -4.752   3.700
  781    HD2  PHE  10           HD1      PHE  10 154.284  -2.559   7.089
  782    HE1  PHE  10           HE2      PHE  10 150.771  -3.341   3.676
  783    HE2  PHE  10           HE1      PHE  10 152.246  -1.147   7.063
  784    HZ   PHE  10           HZ       PHE  10 150.490  -1.537   5.355
  785    H    VAL  11           HN       VAL  11 155.147  -7.466   4.324
  786    HA   VAL  11           HA       VAL  11 152.326  -7.981   3.702
  787    HB   VAL  11           HB       VAL  11 153.240  -9.385   1.897
  788   1HG1  VAL  11          HG13      VAL  11 154.703  -6.748   2.258
  789   2HG1  VAL  11          HG12      VAL  11 154.526  -7.610   0.729
  790   3HG1  VAL  11          HG11      VAL  11 153.104  -6.954   1.542
  791   1HG2  VAL  11          HG21      VAL  11 155.794  -8.942   3.449
  792   2HG2  VAL  11          HG23      VAL  11 155.121 -10.456   2.845
  793   3HG2  VAL  11          HG22      VAL  11 155.844  -9.303   1.723
  794    H    ALA  12           HN       ALA  12 153.802  -8.964   6.286
  795    HA   ALA  12           HA       ALA  12 152.966 -11.846   6.058
  796   1HB   ALA  12           HB3      ALA  12 155.221 -10.569   7.612
  797   2HB   ALA  12           HB2      ALA  12 154.645 -12.204   7.933
  798   3HB   ALA  12           HB1      ALA  12 155.335 -11.804   6.361
  799    H    GLU  13           HN       GLU  13 152.167  -8.898   7.479
  800    HA   GLU  13           HA       GLU  13 150.414 -10.286   9.389
  801   1HB   GLU  13           HB2      GLU  13 151.157  -8.821  11.299
  802   2HB   GLU  13           HB1      GLU  13 152.368  -9.995  10.790
  803   1HG   GLU  13           HG2      GLU  13 153.553  -8.306   9.515
  804   2HG   GLU  13           HG1      GLU  13 152.287  -7.122   9.833
  805    HA   PRO  14           HA       PRO  14 147.480  -7.145   8.234
  806   1HB   PRO  14           HB2      PRO  14 147.251  -6.573  11.181
  807   2HB   PRO  14           HB1      PRO  14 145.967  -6.821   9.982
  808   1HG   PRO  14           HG2      PRO  14 146.684  -8.743  11.714
  809   2HG   PRO  14           HG1      PRO  14 146.139  -9.110  10.067
  810   1HD   PRO  14           HD2      PRO  14 148.870  -9.324  11.214
  811   2HD   PRO  14           HD1      PRO  14 148.179 -10.123   9.784
  812    H    MET  15           HN       MET  15 147.284  -4.750   8.220
  813    HA   MET  15           HA       MET  15 149.887  -3.451   8.795
  814   1HB   MET  15           HB2      MET  15 148.684  -1.474   7.632
  815   2HB   MET  15           HB1      MET  15 149.079  -2.884   6.647
  816   1HG   MET  15           HG2      MET  15 146.842  -3.701   6.739
  817   2HG   MET  15           HG1      MET  15 146.408  -2.573   8.020
  818   1HE   MET  15           HE2      MET  15 147.806  -3.114   4.694
  819   2HE   MET  15           HE1      MET  15 146.836  -2.133   3.597
  820   3HE   MET  15           HE3      MET  15 148.315  -1.473   4.310
  821    H    GLY  16           HN       GLY  16 146.689  -3.667  10.073
  822   1HA   GLY  16           HA2      GLY  16 145.632  -2.584  11.865
  823   2HA   GLY  16           HA1      GLY  16 147.255  -2.509  12.549
  824    H    GLU  17           HN       GLU  17 147.313  -0.458  13.362
  825    HA   GLU  17           HA       GLU  17 146.525   1.825  11.589
  826   1HB   GLU  17           HB2      GLU  17 146.910   1.704  14.596
  827   2HB   GLU  17           HB1      GLU  17 146.374   3.116  13.682
  828   1HG   GLU  17           HG2      GLU  17 144.402   1.862  12.889
  829   2HG   GLU  17           HG1      GLU  17 144.933   0.451  13.807
  830    H    LYS  18           HN       LYS  18 149.118   0.435  11.375
  831    HA   LYS  18           HA       LYS  18 151.204   1.823  12.708
  832   1HB   LYS  18           HB2      LYS  18 151.103   0.493   9.990
  833   2HB   LYS  18           HB1      LYS  18 152.593   1.122  10.689
  834   1HG   LYS  18           HG2      LYS  18 152.336  -0.346  12.629
  835   2HG   LYS  18           HG1      LYS  18 150.797  -0.939  12.000
  836   1HD   LYS  18           HD2      LYS  18 151.943  -1.833  10.013
  837   2HD   LYS  18           HD1      LYS  18 153.484  -1.233  10.625
  838   1HE   LYS  18           HE2      LYS  18 153.397  -3.535  11.250
  839   2HE   LYS  18           HE1      LYS  18 153.041  -2.625  12.718
  840   1HZ   LYS  18           HZ1      LYS  18 150.649  -3.049  11.323
  841   2HZ   LYS  18           HZ3      LYS  18 151.451  -4.538  11.450
  842   3HZ   LYS  18           HZ2      LYS  18 151.099  -3.642  12.851
  843    HA   PRO  19           HA       PRO  19 151.041   5.853  10.868
  844   1HB   PRO  19           HB2      PRO  19 153.735   6.523  10.793
  845   2HB   PRO  19           HB1      PRO  19 152.731   6.587  12.255
  846   1HG   PRO  19           HG2      PRO  19 154.647   4.478  11.369
  847   2HG   PRO  19           HG1      PRO  19 154.345   5.118  12.996
  848   1HD   PRO  19           HD2      PRO  19 153.337   2.729  12.175
  849   2HD   PRO  19           HD1      PRO  19 152.475   3.771  13.326
  850    H    VAL  20           HN       VAL  20 151.377   6.961   8.888
  851    HA   VAL  20           HA       VAL  20 151.480   5.405   6.555
  852    HB   VAL  20           HB       VAL  20 150.541   7.621   6.497
  853   1HG1  VAL  20          HG11      VAL  20 152.034   8.588   8.248
  854   2HG1  VAL  20          HG13      VAL  20 153.334   8.663   7.058
  855   3HG1  VAL  20          HG12      VAL  20 151.879   9.631   6.835
  856   1HG2  VAL  20          HG21      VAL  20 151.775   6.708   4.445
  857   2HG2  VAL  20          HG23      VAL  20 151.499   8.450   4.475
  858   3HG2  VAL  20          HG22      VAL  20 153.089   7.801   4.877
  859    H    GLY  21           HN       GLY  21 154.114   7.141   8.168
  860   1HA   GLY  21           HA2      GLY  21 156.105   6.700   6.172
  861   2HA   GLY  21           HA1      GLY  21 156.436   7.048   7.865
  862    H    SER  22           HN       SER  22 154.512   4.383   8.018
  863    HA   SER  22           HA       SER  22 156.835   2.636   8.440
  864   1HB   SER  22           HB2      SER  22 154.975   2.504  10.018
  865   2HB   SER  22           HB1      SER  22 153.854   2.141   8.708
  866    HG   SER  22           HG       SER  22 154.843   0.191   8.415
  867    H    LEU  23           HN       LEU  23 154.478   3.254   5.958
  868    HA   LEU  23           HA       LEU  23 154.570   0.726   4.625
  869   1HB   LEU  23           HB2      LEU  23 154.075   3.530   3.588
  870   2HB   LEU  23           HB1      LEU  23 153.914   2.091   2.584
  871    HG   LEU  23           HG       LEU  23 152.425   2.464   5.202
  872   1HD1  LEU  23          HD11      LEU  23 151.587   3.098   2.357
  873   2HD1  LEU  23          HD13      LEU  23 150.455   2.961   3.703
  874   3HD1  LEU  23          HD12      LEU  23 151.687   4.221   3.715
  875   1HD2  LEU  23          HD21      LEU  23 152.348   0.446   2.951
  876   2HD2  LEU  23          HD23      LEU  23 152.365   0.163   4.689
  877   3HD2  LEU  23          HD22      LEU  23 150.902   0.745   3.909
  878    H    ALA  24           HN       ALA  24 155.992  -0.118   3.172
  879    HA   ALA  24           HA       ALA  24 158.701   0.762   3.207
  880   1HB   ALA  24           HB1      ALA  24 157.187  -1.103   1.370
  881   2HB   ALA  24           HB3      ALA  24 158.924  -0.832   1.227
  882   3HB   ALA  24           HB2      ALA  24 158.260  -1.532   2.703
  883    H    GLY  25           HN       GLY  25 159.865   2.042   1.856
  884   1HA   GLY  25           HA2      GLY  25 160.344   3.234  -0.186
  885   2HA   GLY  25           HA1      GLY  25 158.658   3.054  -0.666
  886    H    ILE  26           HN       ILE  26 158.124   3.943   2.328
  887    HA   ILE  26           HA       ILE  26 158.146   6.870   1.676
  888    HB   ILE  26           HB       ILE  26 156.638   5.417   3.872
  889   1HG1  ILE  26          HG12      ILE  26 155.831   4.575   1.745
  890   2HG1  ILE  26          HG11      ILE  26 154.652   5.733   2.354
  891   1HG2  ILE  26          HG23      ILE  26 156.999   7.825   4.242
  892   2HG2  ILE  26          HG22      ILE  26 156.325   8.176   2.652
  893   3HG2  ILE  26          HG21      ILE  26 155.299   7.490   3.915
  894   1HD1  ILE  26          HD13      ILE  26 155.975   7.475   0.926
  895   2HD1  ILE  26          HD12      ILE  26 156.623   6.059   0.099
  896   3HD1  ILE  26          HD11      ILE  26 154.887   6.360   0.102
  897    H    GLY  27           HN       GLY  27 159.850   7.977   2.605
  898   1HA   GLY  27           HA2      GLY  27 161.144   6.819   5.011
  899   2HA   GLY  27           HA1      GLY  27 161.793   8.112   4.003
  900    H    GLU  28           HN       GLU  28 161.948   8.722   6.545
  901    HA   GLU  28           HA       GLU  28 159.682   9.733   7.889
  902   1HB   GLU  28           HB2      GLU  28 162.584  10.599   7.955
  903   2HB   GLU  28           HB1      GLU  28 161.364  11.227   9.064
  904   1HG   GLU  28           HG2      GLU  28 160.873   8.945   9.842
  905   2HG   GLU  28           HG1      GLU  28 162.071   8.297   8.722
  906    H    VAL  29           HN       VAL  29 161.784  11.351   5.492
  907    HA   VAL  29           HA       VAL  29 160.531  13.926   5.763
  908    HB   VAL  29           HB       VAL  29 162.067  12.654   3.480
  909   1HG1  VAL  29          HG11      VAL  29 160.923  15.439   3.777
  910   2HG1  VAL  29          HG13      VAL  29 162.279  15.087   2.704
  911   3HG1  VAL  29          HG12      VAL  29 160.716  14.318   2.431
  912   1HG2  VAL  29          HG22      VAL  29 162.754  14.673   5.634
  913   2HG2  VAL  29          HG21      VAL  29 163.436  13.060   5.428
  914   3HG2  VAL  29          HG23      VAL  29 163.797  14.326   4.254
  915    H    LEU  30           HN       LEU  30 159.995  11.274   3.449
  916    HA   LEU  30           HA       LEU  30 157.877  12.583   2.034
  917   1HB   LEU  30           HB2      LEU  30 158.445   9.625   2.377
  918   2HB   LEU  30           HB1      LEU  30 157.325  10.305   1.199
  919    HG   LEU  30           HG       LEU  30 160.276  10.999   1.347
  920   1HD1  LEU  30          HD13      LEU  30 159.826   8.612   0.734
  921   2HD1  LEU  30          HD12      LEU  30 158.847   9.183  -0.617
  922   3HD1  LEU  30          HD11      LEU  30 160.575   9.536  -0.569
  923   1HD2  LEU  30          HD22      LEU  30 157.993  11.798  -0.456
  924   2HD2  LEU  30          HD21      LEU  30 159.284  12.794   0.217
  925   3HD2  LEU  30          HD23      LEU  30 159.621  11.703  -1.124
  926    H    GLY  31           HN       GLY  31 157.905  10.472   4.871
  927   1HA   GLY  31           HA2      GLY  31 155.097  10.050   5.056
  928   2HA   GLY  31           HA1      GLY  31 156.208  10.020   6.427
  929    H    LYS  32           HN       LYS  32 157.146  12.712   6.244
  930    HA   LYS  32           HA       LYS  32 155.098  14.057   7.715
  931   1HB   LYS  32           HB2      LYS  32 157.489  14.600   7.963
  932   2HB   LYS  32           HB1      LYS  32 157.517  15.232   6.316
  933   1HG   LYS  32           HG2      LYS  32 156.012  17.009   6.870
  934   2HG   LYS  32           HG1      LYS  32 155.630  16.285   8.433
  935   1HD   LYS  32           HD2      LYS  32 157.184  18.130   8.774
  936   2HD   LYS  32           HD1      LYS  32 158.008  16.612   9.122
  937   1HE   LYS  32           HE2      LYS  32 158.148  17.831   6.367
  938   2HE   LYS  32           HE1      LYS  32 159.234  18.371   7.647
  939   1HZ   LYS  32           HZ3      LYS  32 159.325  15.656   7.811
  940   2HZ   LYS  32           HZ2      LYS  32 159.270  15.943   6.137
  941   3HZ   LYS  32           HZ1      LYS  32 160.492  16.650   7.082
  942    H    LYS  33           HN       LYS  33 156.063  14.331   4.279
  943    HA   LYS  33           HA       LYS  33 154.325  16.550   3.727
  944   1HB   LYS  33           HB2      LYS  33 155.489  14.407   1.934
  945   2HB   LYS  33           HB1      LYS  33 154.555  15.774   1.324
  946   1HG   LYS  33           HG2      LYS  33 156.156  17.337   2.368
  947   2HG   LYS  33           HG1      LYS  33 157.094  15.971   2.973
  948   1HD   LYS  33           HD2      LYS  33 157.488  15.211   0.660
  949   2HD   LYS  33           HD1      LYS  33 156.557  16.577   0.050
  950   1HE   LYS  33           HE2      LYS  33 158.151  18.153   0.964
  951   2HE   LYS  33           HE1      LYS  33 159.026  16.861   1.786
  952   1HZ   LYS  33           HZ3      LYS  33 158.761  16.277  -0.969
  953   2HZ   LYS  33           HZ2      LYS  33 159.457  17.814  -0.771
  954   3HZ   LYS  33           HZ1      LYS  33 160.174  16.455  -0.047
  955    H    LEU  34           HN       LEU  34 153.841  13.024   3.382
  956    HA   LEU  34           HA       LEU  34 151.182  13.227   2.318
  957   1HB   LEU  34           HB2      LEU  34 152.546  11.027   3.899
  958   2HB   LEU  34           HB1      LEU  34 150.954  10.857   3.176
  959    HG   LEU  34           HG       LEU  34 153.419  11.612   1.587
  960   1HD1  LEU  34          HD12      LEU  34 153.651   9.361   2.618
  961   2HD1  LEU  34          HD11      LEU  34 152.113   8.890   1.896
  962   3HD1  LEU  34          HD13      LEU  34 153.491   9.270   0.865
  963   1HD2  LEU  34          HD23      LEU  34 150.556  10.904   0.908
  964   2HD2  LEU  34          HD22      LEU  34 151.544  12.229   0.297
  965   3HD2  LEU  34          HD21      LEU  34 151.843  10.586  -0.254
  966    H    GLU  35           HN       GLU  35 152.459  13.050   5.599
  967    HA   GLU  35           HA       GLU  35 149.975  12.817   6.977
  968   1HB   GLU  35           HB2      GLU  35 152.154  12.513   8.085
  969   2HB   GLU  35           HB1      GLU  35 152.508  14.228   7.873
  970   1HG   GLU  35           HG2      GLU  35 150.601  14.829   9.284
  971   2HG   GLU  35           HG1      GLU  35 150.155  13.127   9.441
  972    H    GLU  36           HN       GLU  36 151.762  15.729   5.964
  973    HA   GLU  36           HA       GLU  36 149.883  17.605   7.070
  974   1HB   GLU  36           HB2      GLU  36 152.177  18.247   6.395
  975   2HB   GLU  36           HB1      GLU  36 151.769  17.924   4.710
  976   1HG   GLU  36           HG2      GLU  36 150.039  19.678   4.779
  977   2HG   GLU  36           HG1      GLU  36 150.417  19.992   6.474
  978    H    ARG  37           HN       ARG  37 149.832  15.561   4.313
  979    HA   ARG  37           HA       ARG  37 147.794  17.166   2.901
  980   1HB   ARG  37           HB2      ARG  37 149.080  14.494   2.311
  981   2HB   ARG  37           HB1      ARG  37 147.837  15.209   1.292
  982   1HG   ARG  37           HG2      ARG  37 150.349  16.725   2.017
  983   2HG   ARG  37           HG1      ARG  37 150.317  15.620   0.651
  984   1HD   ARG  37           HD2      ARG  37 148.650  18.126   1.029
  985   2HD   ARG  37           HD1      ARG  37 149.847  17.806  -0.216
  986    HE   ARG  37           HE       ARG  37 147.973  15.802  -0.587
  987   1HH1  ARG  37          HH21      ARG  37 147.971  19.241  -0.353
  988   2HH1  ARG  37          HH22      ARG  37 146.592  19.445  -1.383
  989   1HH2  ARG  37          HH11      ARG  37 146.166  16.049  -1.928
  990   2HH2  ARG  37          HH12      ARG  37 145.570  17.638  -2.271
  991    H    GLY  38           HN       GLY  38 147.653  15.145   5.536
  992   1HA   GLY  38           HA2      GLY  38 145.452  14.741   6.525
  993   2HA   GLY  38           HA1      GLY  38 144.791  14.492   4.918
  994    H    PHE  39           HN       PHE  39 147.757  12.901   5.097
  995    HA   PHE  39           HA       PHE  39 146.352  10.306   5.645
  996   1HB   PHE  39           HB2      PHE  39 148.931  10.899   4.188
  997   2HB   PHE  39           HB1      PHE  39 148.240   9.295   4.410
  998    HD1  PHE  39           HD2      PHE  39 146.165   8.649   3.260
  999    HD2  PHE  39           HD1      PHE  39 147.939  12.507   2.674
 1000    HE1  PHE  39           HE2      PHE  39 144.703   9.019   1.291
 1001    HE2  PHE  39           HE1      PHE  39 146.483  12.885   0.705
 1002    HZ   PHE  39           HZ       PHE  39 144.861  11.140   0.011
 1003    H    ASP  40           HN       ASP  40 146.617  10.896   7.998
 1004    HA   ASP  40           HA       ASP  40 149.342  10.859   9.077
 1005   1HB   ASP  40           HB2      ASP  40 148.211  10.942  11.269
 1006   2HB   ASP  40           HB1      ASP  40 147.563  12.169  10.180
 1007    H    LYS  41           HN       LYS  41 147.058   8.508   8.118
 1008    HA   LYS  41           HA       LYS  41 148.586   6.389   9.591
 1009   1HB   LYS  41           HB2      LYS  41 145.602   6.452   9.060
 1010   2HB   LYS  41           HB1      LYS  41 146.478   5.113   9.795
 1011   1HG   LYS  41           HG2      LYS  41 146.588   7.898  10.965
 1012   2HG   LYS  41           HG1      LYS  41 145.289   6.783  11.378
 1013   1HD   LYS  41           HD2      LYS  41 147.065   5.103  12.046
 1014   2HD   LYS  41           HD1      LYS  41 148.258   6.385  11.845
 1015   1HE   LYS  41           HE2      LYS  41 145.847   6.570  13.668
 1016   2HE   LYS  41           HE1      LYS  41 147.475   6.150  14.204
 1017   1HZ   LYS  41           HZ2      LYS  41 148.198   8.294  13.146
 1018   2HZ   LYS  41           HZ1      LYS  41 146.554   8.698  13.006
 1019   3HZ   LYS  41           HZ3      LYS  41 147.239   8.453  14.538
 1020    H    ALA  42           HN       ALA  42 148.818   4.427   8.472
 1021    HA   ALA  42           HA       ALA  42 149.190   4.664   5.651
 1022   1HB   ALA  42           HB2      ALA  42 149.087   2.250   7.470
 1023   2HB   ALA  42           HB1      ALA  42 149.530   2.166   5.764
 1024   3HB   ALA  42           HB3      ALA  42 150.522   3.094   6.888
 1025    H    TYR  43           HN       TYR  43 146.539   3.158   7.528
 1026    HA   TYR  43           HA       TYR  43 145.292   1.906   5.317
 1027   1HB   TYR  43           HB2      TYR  43 143.274   1.774   6.653
 1028   2HB   TYR  43           HB1      TYR  43 144.674   1.436   7.661
 1029    HD1  TYR  43           HD1      TYR  43 142.263   4.110   6.694
 1030    HD2  TYR  43           HD2      TYR  43 145.127   2.740   9.587
 1031    HE1  TYR  43           HE1      TYR  43 141.536   5.899   8.251
 1032    HE2  TYR  43           HE2      TYR  43 144.412   4.534  11.145
 1033    HH   TYR  43           HH       TYR  43 142.787   6.066  11.557
 1034    H    VAL  44           HN       VAL  44 145.410   5.300   6.073
 1035    HA   VAL  44           HA       VAL  44 143.033   5.929   4.454
 1036    HB   VAL  44           HB       VAL  44 145.289   7.771   5.338
 1037   1HG1  VAL  44          HG13      VAL  44 143.844   8.564   3.432
 1038   2HG1  VAL  44          HG12      VAL  44 142.445   8.403   4.490
 1039   3HG1  VAL  44          HG11      VAL  44 143.713   9.564   4.876
 1040   1HG2  VAL  44          HG22      VAL  44 142.587   7.214   6.610
 1041   2HG2  VAL  44          HG21      VAL  44 144.151   6.724   7.260
 1042   3HG2  VAL  44          HG23      VAL  44 143.743   8.434   7.149
 1043    H    VAL  45           HN       VAL  45 146.462   5.615   4.100
 1044    HA   VAL  45           HA       VAL  45 146.619   6.674   1.375
 1045    HB   VAL  45           HB       VAL  45 148.547   4.880   2.893
 1046   1HG1  VAL  45          HG11      VAL  45 148.874   6.558   0.388
 1047   2HG1  VAL  45          HG13      VAL  45 150.199   5.765   1.240
 1048   3HG1  VAL  45          HG12      VAL  45 148.934   4.797   0.483
 1049   1HG2  VAL  45          HG21      VAL  45 148.390   7.887   2.568
 1050   2HG2  VAL  45          HG23      VAL  45 148.244   6.976   4.071
 1051   3HG2  VAL  45          HG22      VAL  45 149.791   7.042   3.226
 1052    H    LEU  46           HN       LEU  46 146.249   3.545   2.937
 1053    HA   LEU  46           HA       LEU  46 146.515   1.871   0.638
 1054   1HB   LEU  46           HB2      LEU  46 146.381   1.027   2.990
 1055   2HB   LEU  46           HB1      LEU  46 144.699   1.530   3.055
 1056    HG   LEU  46           HG       LEU  46 144.297   0.012   1.040
 1057   1HD1  LEU  46          HD12      LEU  46 147.133  -0.742   1.725
 1058   2HD1  LEU  46          HD11      LEU  46 146.040  -1.904   0.976
 1059   3HD1  LEU  46          HD13      LEU  46 146.429  -0.401   0.145
 1060   1HD2  LEU  46          HD22      LEU  46 144.915  -0.857   3.832
 1061   2HD2  LEU  46          HD21      LEU  46 143.398  -0.914   2.945
 1062   3HD2  LEU  46          HD23      LEU  46 144.644  -2.119   2.633
 1063    H    GLY  47           HN       GLY  47 143.842   3.692   2.027
 1064   1HA   GLY  47           HA2      GLY  47 141.716   2.781   0.406
 1065   2HA   GLY  47           HA1      GLY  47 141.799   4.392   1.117
 1066    H    GLN  48           HN       GLN  48 144.042   5.445  -0.220
 1067    HA   GLN  48           HA       GLN  48 142.887   6.269  -2.693
 1068   1HB   GLN  48           HB2      GLN  48 144.681   7.512  -1.442
 1069   2HB   GLN  48           HB1      GLN  48 145.833   6.286  -1.968
 1070   1HG   GLN  48           HG2      GLN  48 145.956   8.192  -3.483
 1071   2HG   GLN  48           HG1      GLN  48 145.258   6.819  -4.342
 1072   1HE2  GLN  48          HE22      GLN  48 142.486   8.788  -5.238
 1073   2HE2  GLN  48          HE21      GLN  48 143.670   7.666  -5.709
 1074    H    PHE  49           HN       PHE  49 145.376   3.826  -1.981
 1075    HA   PHE  49           HA       PHE  49 145.943   3.068  -4.669
 1076   1HB   PHE  49           HB2      PHE  49 147.299   2.360  -2.718
 1077   2HB   PHE  49           HB1      PHE  49 145.960   1.367  -2.153
 1078    HD1  PHE  49           HD1      PHE  49 147.990   1.928  -5.260
 1079    HD2  PHE  49           HD2      PHE  49 145.963  -0.901  -2.741
 1080    HE1  PHE  49           HE1      PHE  49 148.800   0.072  -6.691
 1081    HE2  PHE  49           HE2      PHE  49 146.771  -2.757  -4.177
 1082    HZ   PHE  49           HZ       PHE  49 148.190  -2.270  -6.150
 1083    H    LEU  50           HN       LEU  50 143.482   2.001  -2.376
 1084    HA   LEU  50           HA       LEU  50 142.371  -0.050  -4.090
 1085   1HB   LEU  50           HB2      LEU  50 141.142   1.518  -1.799
 1086   2HB   LEU  50           HB1      LEU  50 140.380   0.125  -2.561
 1087    HG   LEU  50           HG       LEU  50 143.138   0.049  -1.294
 1088   1HD1  LEU  50          HD11      LEU  50 140.404  -0.538  -0.156
 1089   2HD1  LEU  50          HD13      LEU  50 141.855  -1.291   0.507
 1090   3HD1  LEU  50          HD12      LEU  50 141.687   0.462   0.527
 1091   1HD2  LEU  50          HD21      LEU  50 141.291  -2.003  -2.516
 1092   2HD2  LEU  50          HD23      LEU  50 143.027  -1.793  -2.745
 1093   3HD2  LEU  50          HD22      LEU  50 142.417  -2.481  -1.248
 1094    H    VAL  51           HN       VAL  51 141.636   3.376  -3.580
 1095    HA   VAL  51           HA       VAL  51 139.331   3.466  -5.275
 1096    HB   VAL  51           HB       VAL  51 141.281   5.600  -4.373
 1097   1HG1  VAL  51          HG11      VAL  51 138.743   5.833  -6.010
 1098   2HG1  VAL  51          HG13      VAL  51 139.421   7.183  -5.099
 1099   3HG1  VAL  51          HG12      VAL  51 140.345   6.454  -6.411
 1100   1HG2  VAL  51          HG22      VAL  51 139.745   4.407  -2.726
 1101   2HG2  VAL  51          HG21      VAL  51 139.564   6.160  -2.795
 1102   3HG2  VAL  51          HG23      VAL  51 138.391   5.120  -3.606
 1103    H    LEU  52           HN       LEU  52 142.755   3.500  -6.006
 1104    HA   LEU  52           HA       LEU  52 142.284   4.493  -8.758
 1105   1HB   LEU  52           HB2      LEU  52 144.784   3.624  -7.292
 1106   2HB   LEU  52           HB1      LEU  52 144.776   4.124  -8.983
 1107    HG   LEU  52           HG       LEU  52 143.766   5.832  -6.684
 1108   1HD1  LEU  52          HD13      LEU  52 146.420   5.730  -8.126
 1109   2HD1  LEU  52          HD12      LEU  52 145.887   7.157  -7.238
 1110   3HD1  LEU  52          HD11      LEU  52 146.121   5.628  -6.391
 1111   1HD2  LEU  52          HD22      LEU  52 143.904   6.171  -9.667
 1112   2HD2  LEU  52          HD21      LEU  52 142.707   6.772  -8.520
 1113   3HD2  LEU  52          HD23      LEU  52 144.262   7.586  -8.677
 1114    H    LYS  53           HN       LYS  53 141.447   1.684  -7.578
 1115    HA   LYS  53           HA       LYS  53 141.358  -0.519  -8.397
 1116   1HB   LYS  53           HB2      LYS  53 141.748   1.004 -10.992
 1117   2HB   LYS  53           HB1      LYS  53 141.153  -0.651 -10.862
 1118   1HG   LYS  53           HG2      LYS  53 139.244   0.139  -9.513
 1119   2HG   LYS  53           HG1      LYS  53 139.835   1.794  -9.642
 1120   1HD   LYS  53           HD2      LYS  53 139.599   1.686 -12.096
 1121   2HD   LYS  53           HD1      LYS  53 139.004   0.030 -11.966
 1122   1HE   LYS  53           HE2      LYS  53 137.122   1.604 -12.162
 1123   2HE   LYS  53           HE1      LYS  53 137.115   0.828 -10.579
 1124   1HZ   LYS  53           HZ1      LYS  53 138.304   2.782  -9.707
 1125   2HZ   LYS  53           HZ3      LYS  53 138.150   3.534 -11.219
 1126   3HZ   LYS  53           HZ2      LYS  53 136.763   3.166 -10.311
 1127    H    LYS  54           HN       LYS  54 143.994   0.332  -7.555
 1128    HA   LYS  54           HA       LYS  54 146.205  -0.416  -7.604
 1129   1HB   LYS  54           HB2      LYS  54 145.039  -2.590  -9.377
 1130   2HB   LYS  54           HB1      LYS  54 146.616  -2.632  -8.597
 1131   1HG   LYS  54           HG2      LYS  54 145.535  -2.502  -6.387
 1132   2HG   LYS  54           HG1      LYS  54 143.952  -2.449  -7.161
 1133   1HD   LYS  54           HD2      LYS  54 144.394  -4.662  -8.189
 1134   2HD   LYS  54           HD1      LYS  54 145.955  -4.718  -7.370
 1135   1HE   LYS  54           HE2      LYS  54 143.270  -4.505  -5.971
 1136   2HE   LYS  54           HE1      LYS  54 144.206  -5.989  -6.139
 1137   1HZ   LYS  54           HZ2      LYS  54 146.066  -4.751  -5.025
 1138   2HZ   LYS  54           HZ1      LYS  54 144.938  -3.537  -4.648
 1139   3HZ   LYS  54           HZ3      LYS  54 144.729  -5.106  -4.039
 1140    H    ASP  55           HN       ASP  55 145.058   1.345  -9.932
 1141    HA   ASP  55           HA       ASP  55 146.641   0.609 -12.240
 1142   1HB   ASP  55           HB2      ASP  55 145.337   3.188 -11.349
 1143   2HB   ASP  55           HB1      ASP  55 146.314   3.110 -12.818
 1144    H    GLU  56           HN       GLU  56 148.812   0.502 -12.175
 1145    HA   GLU  56           HA       GLU  56 150.440   1.646 -10.140
 1146   1HB   GLU  56           HB2      GLU  56 150.960  -0.375 -11.507
 1147   2HB   GLU  56           HB1      GLU  56 151.294   0.685 -12.876
 1148   1HG   GLU  56           HG2      GLU  56 153.075   1.796 -11.623
 1149   2HG   GLU  56           HG1      GLU  56 152.708   0.823 -10.197
 1150    H    ASP  57           HN       ASP  57 149.845   2.773 -13.488
 1151    HA   ASP  57           HA       ASP  57 151.805   4.894 -13.333
 1152   1HB   ASP  57           HB2      ASP  57 149.417   4.468 -15.145
 1153   2HB   ASP  57           HB1      ASP  57 150.539   5.818 -15.326
 1154    H    LEU  58           HN       LEU  58 148.348   4.727 -12.701
 1155    HA   LEU  58           HA       LEU  58 148.096   7.580 -12.210
 1156   1HB   LEU  58           HB2      LEU  58 146.343   5.292 -11.260
 1157   2HB   LEU  58           HB1      LEU  58 145.924   6.999 -11.154
 1158    HG   LEU  58           HG       LEU  58 146.501   5.501 -13.731
 1159   1HD1  LEU  58          HD13      LEU  58 143.935   6.353 -12.375
 1160   2HD1  LEU  58          HD12      LEU  58 144.014   5.969 -14.093
 1161   3HD1  LEU  58          HD11      LEU  58 144.401   4.734 -12.897
 1162   1HD2  LEU  58          HD21      LEU  58 145.906   8.381 -13.067
 1163   2HD2  LEU  58          HD23      LEU  58 147.027   7.717 -14.257
 1164   3HD2  LEU  58          HD22      LEU  58 145.297   7.716 -14.584
 1165    H    PHE  59           HN       PHE  59 148.747   4.766 -10.143
 1166    HA   PHE  59           HA       PHE  59 148.652   6.190  -7.650
 1167   1HB   PHE  59           HB2      PHE  59 148.654   3.722  -7.752
 1168   2HB   PHE  59           HB1      PHE  59 150.299   3.751  -8.391
 1169    HD1  PHE  59           HD1      PHE  59 148.336   5.203  -5.532
 1170    HD2  PHE  59           HD2      PHE  59 152.056   3.502  -6.854
 1171    HE1  PHE  59           HE1      PHE  59 149.220   5.336  -3.219
 1172    HE2  PHE  59           HE2      PHE  59 152.937   3.635  -4.539
 1173    HZ   PHE  59           HZ       PHE  59 151.520   4.553  -2.722
 1174    H    ARG  60           HN       ARG  60 151.363   5.438  -9.847
 1175    HA   ARG  60           HA       ARG  60 153.406   6.637  -8.289
 1176   1HB   ARG  60           HB2      ARG  60 153.141   6.285 -11.282
 1177   2HB   ARG  60           HB1      ARG  60 154.608   6.887 -10.508
 1178   1HG   ARG  60           HG2      ARG  60 154.861   4.838  -9.252
 1179   2HG   ARG  60           HG1      ARG  60 153.298   4.245  -9.805
 1180   1HD   ARG  60           HD2      ARG  60 155.221   3.255 -11.067
 1181   2HD   ARG  60           HD1      ARG  60 154.104   4.143 -12.103
 1182    HE   ARG  60           HE       ARG  60 155.995   6.041 -11.428
 1183   1HH1  ARG  60          HH21      ARG  60 156.063   2.827 -12.680
 1184   2HH1  ARG  60          HH22      ARG  60 157.477   3.089 -13.642
 1185   1HH2  ARG  60          HH11      ARG  60 157.839   6.402 -12.685
 1186   2HH2  ARG  60          HH12      ARG  60 158.481   5.112 -13.646
 1187    H    GLU  61           HN       GLU  61 151.399   8.122 -10.879
 1188    HA   GLU  61           HA       GLU  61 152.680  10.679 -10.715
 1189   1HB   GLU  61           HB2      GLU  61 151.152   9.930 -12.574
 1190   2HB   GLU  61           HB1      GLU  61 149.795  10.112 -11.464
 1191   1HG   GLU  61           HG2      GLU  61 149.967  12.143 -12.771
 1192   2HG   GLU  61           HG1      GLU  61 150.490  12.512 -11.127
 1193    H    TRP  62           HN       TRP  62 149.952   9.223  -8.969
 1194    HA   TRP  62           HA       TRP  62 149.106  11.574  -7.609
 1195   1HB   TRP  62           HB2      TRP  62 147.692   9.629  -7.554
 1196   2HB   TRP  62           HB1      TRP  62 148.969   8.649  -6.833
 1197    HD1  TRP  62           HD1      TRP  62 146.570  11.530  -5.987
 1198    HE1  TRP  62           HE1      TRP  62 146.360  11.697  -3.420
 1199    HE3  TRP  62           HE3      TRP  62 150.083   8.089  -4.580
 1200    HZ2  TRP  62           HZ2      TRP  62 147.524  10.523  -1.080
 1201    HZ3  TRP  62           HZ3      TRP  62 150.500   7.633  -2.182
 1202    HH2  TRP  62           HH2      TRP  62 149.229   8.843  -0.434
 1203    H    LEU  63           HN       LEU  63 151.424   9.053  -6.560
 1204    HA   LEU  63           HA       LEU  63 151.996  10.361  -4.067
 1205   1HB   LEU  63           HB2      LEU  63 152.439   7.963  -4.441
 1206   2HB   LEU  63           HB1      LEU  63 153.657   8.373  -5.646
 1207    HG   LEU  63           HG       LEU  63 154.944   9.583  -3.888
 1208   1HD1  LEU  63          HD12      LEU  63 152.608   8.689  -2.210
 1209   2HD1  LEU  63          HD11      LEU  63 154.195   8.885  -1.467
 1210   3HD1  LEU  63          HD13      LEU  63 153.414  10.257  -2.247
 1211   1HD2  LEU  63          HD22      LEU  63 155.420   7.211  -4.419
 1212   2HD2  LEU  63          HD21      LEU  63 155.727   7.565  -2.719
 1213   3HD2  LEU  63          HD23      LEU  63 154.258   6.715  -3.190
 1214    H    LYS  64           HN       LYS  64 153.761  10.262  -7.157
 1215    HA   LYS  64           HA       LYS  64 155.895  11.980  -6.341
 1216   1HB   LYS  64           HB2      LYS  64 155.916  10.602  -8.429
 1217   2HB   LYS  64           HB1      LYS  64 154.739  11.714  -9.132
 1218   1HG   LYS  64           HG2      LYS  64 156.322  13.587  -8.829
 1219   2HG   LYS  64           HG1      LYS  64 157.500  12.476  -8.131
 1220   1HD   LYS  64           HD2      LYS  64 157.521  11.183 -10.238
 1221   2HD   LYS  64           HD1      LYS  64 156.371  12.322 -10.938
 1222   1HE   LYS  64           HE2      LYS  64 157.942  14.122 -10.834
 1223   2HE   LYS  64           HE1      LYS  64 159.037  13.195  -9.810
 1224   1HZ   LYS  64           HZ3      LYS  64 158.428  11.852 -12.259
 1225   2HZ   LYS  64           HZ2      LYS  64 159.145  13.369 -12.525
 1226   3HZ   LYS  64           HZ1      LYS  64 159.936  12.208 -11.569
 1227    H    ASP  65           HN       ASP  65 152.844  12.700  -8.001
 1228    HA   ASP  65           HA       ASP  65 153.268  15.542  -8.102
 1229   1HB   ASP  65           HB2      ASP  65 151.646  14.294  -9.543
 1230   2HB   ASP  65           HB1      ASP  65 150.635  14.041  -8.120
 1231    H    THR  66           HN       THR  66 151.923  13.370  -5.690
 1232    HA   THR  66           HA       THR  66 150.745  15.516  -4.121
 1233    HB   THR  66           HB       THR  66 151.306  12.617  -3.448
 1234    HG1  THR  66           HG1      THR  66 148.743  13.534  -3.653
 1235   1HG2  THR  66          HG23      THR  66 149.840  14.796  -1.946
 1236   2HG2  THR  66          HG22      THR  66 149.603  13.079  -1.619
 1237   3HG2  THR  66          HG21      THR  66 151.188  13.813  -1.373
 1238    H    CYS  67           HN       CYS  67 153.864  13.766  -4.017
 1239    HA   CYS  67           HA       CYS  67 154.693  15.676  -1.847
 1240   1HB   CYS  67           HB2      CYS  67 155.882  13.900  -0.728
 1241   2HB   CYS  67           HB1      CYS  67 154.214  13.382  -0.967
 1242    HG   CYS  67           HG       CYS  67 156.028  11.526  -1.759
 1243    H    GLY  68           HN       GLY  68 155.700  13.781  -4.666
 1244   1HA   GLY  68           HA2      GLY  68 157.382  14.753  -6.176
 1245   2HA   GLY  68           HA1      GLY  68 158.200  15.435  -4.772
 1246    H    ALA  69           HN       ALA  69 156.976  12.250  -4.332
 1247    HA   ALA  69           HA       ALA  69 159.447  11.092  -3.661
 1248   1HB   ALA  69           HB3      ALA  69 157.227  10.063  -3.181
 1249   2HB   ALA  69           HB2      ALA  69 157.063   9.675  -4.895
 1250   3HB   ALA  69           HB1      ALA  69 158.340   8.922  -3.940
 1251    H    ASN  70           HN       ASN  70 160.858   9.629  -4.882
 1252    HA   ASN  70           HA       ASN  70 161.062  10.441  -7.718
 1253   1HB   ASN  70           HB2      ASN  70 162.889   8.751  -5.985
 1254   2HB   ASN  70           HB1      ASN  70 163.248   9.292  -7.627
 1255   1HD2  ASN  70          HD22      ASN  70 163.171  12.836  -6.386
 1256   2HD2  ASN  70          HD21      ASN  70 162.238  11.952  -7.495
 1257    H    ALA  71           HN       ALA  71 161.750   8.615  -9.250
 1258    HA   ALA  71           HA       ALA  71 159.606   6.792  -9.561
 1259   1HB   ALA  71           HB3      ALA  71 161.312   7.634 -11.302
 1260   2HB   ALA  71           HB2      ALA  71 162.352   6.333 -10.722
 1261   3HB   ALA  71           HB1      ALA  71 160.783   5.957 -11.433
 1262    H    LYS  72           HN       LYS  72 162.738   6.364  -7.949
 1263    HA   LYS  72           HA       LYS  72 162.468   3.483  -7.746
 1264   1HB   LYS  72           HB2      LYS  72 164.177   5.483  -6.248
 1265   2HB   LYS  72           HB1      LYS  72 164.268   3.739  -5.985
 1266   1HG   LYS  72           HG2      LYS  72 164.930   3.344  -8.259
 1267   2HG   LYS  72           HG1      LYS  72 164.582   5.012  -8.713
 1268   1HD   LYS  72           HD2      LYS  72 167.011   4.652  -8.416
 1269   2HD   LYS  72           HD1      LYS  72 166.383   5.808  -7.242
 1270   1HE   LYS  72           HE2      LYS  72 166.547   2.880  -6.544
 1271   2HE   LYS  72           HE1      LYS  72 167.971   3.913  -6.405
 1272   1HZ   LYS  72           HZ1      LYS  72 165.883   5.320  -5.271
 1273   2HZ   LYS  72           HZ3      LYS  72 165.730   3.736  -4.686
 1274   3HZ   LYS  72           HZ2      LYS  72 167.186   4.585  -4.466
 1275    H    GLN  73           HN       GLN  73 161.691   6.182  -5.586
 1276    HA   GLN  73           HA       GLN  73 160.951   4.539  -3.357
 1277   1HB   GLN  73           HB2      GLN  73 160.138   7.367  -4.081
 1278   2HB   GLN  73           HB1      GLN  73 159.858   6.608  -2.511
 1279   1HG   GLN  73           HG2      GLN  73 162.597   6.903  -3.776
 1280   2HG   GLN  73           HG1      GLN  73 161.935   8.032  -2.595
 1281   1HE2  GLN  73          HE22      GLN  73 161.860   5.313  -0.049
 1282   2HE2  GLN  73          HE21      GLN  73 160.712   6.349  -0.748
 1283    H    SER  74           HN       SER  74 159.109   5.840  -6.099
 1284    HA   SER  74           HA       SER  74 156.539   5.113  -5.054
 1285   1HB   SER  74           HB2      SER  74 155.707   5.615  -7.230
 1286   2HB   SER  74           HB1      SER  74 157.040   6.731  -6.961
 1287    HG   SER  74           HG       SER  74 157.874   4.366  -8.002
 1288    H    ARG  75           HN       ARG  75 158.916   3.382  -7.078
 1289    HA   ARG  75           HA       ARG  75 157.225   1.192  -7.750
 1290   1HB   ARG  75           HB2      ARG  75 160.227   1.380  -7.439
 1291   2HB   ARG  75           HB1      ARG  75 159.413  -0.079  -8.002
 1292   1HG   ARG  75           HG2      ARG  75 158.381   1.193  -9.840
 1293   2HG   ARG  75           HG1      ARG  75 159.191   2.656  -9.289
 1294   1HD   ARG  75           HD2      ARG  75 161.384   1.583  -9.653
 1295   2HD   ARG  75           HD1      ARG  75 160.573   0.120 -10.209
 1296    HE   ARG  75           HE       ARG  75 159.555   2.114 -11.847
 1297   1HH1  ARG  75          HH21      ARG  75 162.675   0.978 -10.919
 1298   2HH1  ARG  75          HH22      ARG  75 163.421   1.396 -12.426
 1299   1HH2  ARG  75          HH11      ARG  75 160.510   2.665 -13.819
 1300   2HH2  ARG  75          HH12      ARG  75 162.196   2.350 -14.067
 1301    H    ASP  76           HN       ASP  76 159.234   1.766  -4.853
 1302    HA   ASP  76           HA       ASP  76 158.875  -0.861  -3.775
 1303   1HB   ASP  76           HB2      ASP  76 159.500   1.796  -2.469
 1304   2HB   ASP  76           HB1      ASP  76 159.484   0.268  -1.591
 1305    H    CYS  77           HN       CYS  77 156.963   2.142  -3.376
 1306    HA   CYS  77           HA       CYS  77 155.233   1.014  -1.366
 1307   1HB   CYS  77           HB2      CYS  77 154.958   3.359  -3.255
 1308   2HB   CYS  77           HB1      CYS  77 153.719   2.940  -2.075
 1309    HG   CYS  77           HG       CYS  77 155.670   3.211  -0.215
 1310    H    PHE  78           HN       PHE  78 155.004   1.231  -4.938
 1311    HA   PHE  78           HA       PHE  78 152.326   0.300  -5.117
 1312   1HB   PHE  78           HB2      PHE  78 153.527   1.249  -7.037
 1313   2HB   PHE  78           HB1      PHE  78 154.614  -0.139  -7.056
 1314    HD1  PHE  78           HD1      PHE  78 151.140   0.993  -7.647
 1315    HD2  PHE  78           HD2      PHE  78 153.900  -2.291  -7.892
 1316    HE1  PHE  78           HE1      PHE  78 149.529  -0.254  -9.060
 1317    HE2  PHE  78           HE2      PHE  78 152.287  -3.538  -9.303
 1318    HZ   PHE  78           HZ       PHE  78 150.102  -2.523  -9.886
 1319    H    GLY  79           HN       GLY  79 155.297  -1.650  -5.595
 1320   1HA   GLY  79           HA2      GLY  79 153.967  -4.158  -5.592
 1321   2HA   GLY  79           HA1      GLY  79 155.674  -3.929  -5.218
 1322    H    CYS  80           HN       CYS  80 155.108  -2.149  -2.937
 1323    HA   CYS  80           HA       CYS  80 154.881  -4.189  -0.893
 1324   1HB   CYS  80           HB2      CYS  80 156.192  -2.129  -0.544
 1325   2HB   CYS  80           HB1      CYS  80 154.717  -1.168  -0.654
 1326    HG   CYS  80           HG       CYS  80 155.543  -2.922   1.750
 1327    H    LEU  81           HN       LEU  81 152.673  -1.529  -1.918
 1328    HA   LEU  81           HA       LEU  81 150.576  -2.372  -0.116
 1329   1HB   LEU  81           HB2      LEU  81 150.490  -0.674  -2.629
 1330   2HB   LEU  81           HB1      LEU  81 149.151  -0.854  -1.495
 1331    HG   LEU  81           HG       LEU  81 151.900   0.200  -0.754
 1332   1HD1  LEU  81          HD11      LEU  81 149.302   1.620  -1.394
 1333   2HD1  LEU  81          HD13      LEU  81 150.651   2.395  -0.562
 1334   3HD1  LEU  81          HD12      LEU  81 150.856   1.803  -2.210
 1335   1HD2  LEU  81          HD23      LEU  81 149.340  -0.293   0.761
 1336   2HD2  LEU  81          HD22      LEU  81 151.008  -0.576   1.263
 1337   3HD2  LEU  81          HD21      LEU  81 150.366   1.063   1.236
 1338    H    ARG  82           HN       ARG  82 151.301  -3.007  -3.540
 1339    HA   ARG  82           HA       ARG  82 148.886  -4.382  -4.169
 1340   1HB   ARG  82           HB2      ARG  82 150.588  -3.654  -5.849
 1341   2HB   ARG  82           HB1      ARG  82 151.644  -4.950  -5.289
 1342   1HG   ARG  82           HG2      ARG  82 149.941  -6.622  -5.885
 1343   2HG   ARG  82           HG1      ARG  82 148.849  -5.338  -6.407
 1344   1HD   ARG  82           HD2      ARG  82 149.917  -6.186  -8.386
 1345   2HD   ARG  82           HD1      ARG  82 150.647  -4.621  -8.044
 1346    HE   ARG  82           HE       ARG  82 152.269  -6.486  -6.732
 1347   1HH1  ARG  82          HH21      ARG  82 151.114  -5.873  -9.922
 1348   2HH1  ARG  82          HH22      ARG  82 152.482  -6.595 -10.700
 1349   1HH2  ARG  82          HH11      ARG  82 154.062  -7.442  -7.732
 1350   2HH2  ARG  82          HH12      ARG  82 154.149  -7.484  -9.461
 1351    H    GLU  83           HN       GLU  83 151.922  -5.557  -2.767
 1352    HA   GLU  83           HA       GLU  83 151.117  -8.326  -2.794
 1353   1HB   GLU  83           HB2      GLU  83 153.279  -6.841  -1.296
 1354   2HB   GLU  83           HB1      GLU  83 153.001  -8.570  -1.082
 1355   1HG   GLU  83           HG2      GLU  83 153.307  -8.927  -3.503
 1356   2HG   GLU  83           HG1      GLU  83 153.584  -7.203  -3.725
 1357    H    TRP  84           HN       TRP  84 150.809  -5.744  -0.328
 1358    HA   TRP  84           HA       TRP  84 149.945  -7.485   1.772
 1359   1HB   TRP  84           HB2      TRP  84 150.588  -5.116   2.160
 1360   2HB   TRP  84           HB1      TRP  84 149.144  -4.598   1.286
 1361    HD1  TRP  84           HD1      TRP  84 150.277  -6.210   4.539
 1362    HE1  TRP  84           HE1      TRP  84 148.310  -6.258   6.197
 1363    HE3  TRP  84           HE3      TRP  84 146.504  -4.628   1.476
 1364    HZ2  TRP  84           HZ2      TRP  84 145.505  -5.698   6.226
 1365    HZ3  TRP  84           HZ3      TRP  84 144.194  -4.398   2.350
 1366    HH2  TRP  84           HH2      TRP  84 143.690  -4.929   4.726
 1367    H    CYS  85           HN       CYS  85 148.153  -5.733  -0.767
 1368    HA   CYS  85           HA       CYS  85 145.539  -6.470   0.074
 1369   1HB   CYS  85           HB2      CYS  85 146.691  -5.841  -2.651
 1370   2HB   CYS  85           HB1      CYS  85 144.974  -6.157  -2.401
 1371    HG   CYS  85           HG       CYS  85 145.859  -3.514  -2.118
 1372    H    ASP  86           HN       ASP  86 147.864  -8.141  -2.016
 1373    HA   ASP  86           HA       ASP  86 146.176 -10.252  -2.878
 1374   1HB   ASP  86           HB2      ASP  86 149.160 -10.157  -2.374
 1375   2HB   ASP  86           HB1      ASP  86 148.349 -11.544  -3.105
 1376    H    ALA  87           HN       ALA  87 147.840  -9.739   0.180
 1377    HA   ALA  87           HA       ALA  87 147.183 -12.492   1.080
 1378   1HB   ALA  87           HB1      ALA  87 149.398 -11.298   1.589
 1379   2HB   ALA  87           HB3      ALA  87 148.479 -10.326   2.738
 1380   3HB   ALA  87           HB2      ALA  87 148.581 -12.072   2.947
 1381    H    PHE  88           HN       PHE  88 146.205  -9.144   1.705
 1382    HA   PHE  88           HA       PHE  88 144.220 -10.135   3.722
 1383   1HB   PHE  88           HB2      PHE  88 145.386  -7.385   3.252
 1384   2HB   PHE  88           HB1      PHE  88 144.123  -7.744   4.434
 1385    HD1  PHE  88           HD2      PHE  88 144.584  -9.340   6.307
 1386    HD2  PHE  88           HD1      PHE  88 147.679  -7.968   3.665
 1387    HE1  PHE  88           HE2      PHE  88 146.303 -10.100   7.924
 1388    HE2  PHE  88           HE1      PHE  88 149.397  -8.731   5.278
 1389    HZ   PHE  88           HZ       PHE  88 148.707  -9.792   7.409
 1390    H    LEU  89           HN       LEU  89 144.261  -9.348   0.496
 1391    HA   LEU  89           HA       LEU  89 141.345  -8.738   0.571
 1392   1HB   LEU  89           HB2      LEU  89 142.671  -6.571   0.385
 1393   2HB   LEU  89           HB1      LEU  89 143.276  -7.166  -1.156
 1394    HG   LEU  89           HG       LEU  89 140.752  -7.509  -1.754
 1395   1HD1  LEU  89          HD11      LEU  89 140.591  -5.586   0.589
 1396   2HD1  LEU  89          HD13      LEU  89 139.329  -5.733  -0.629
 1397   3HD1  LEU  89          HD12      LEU  89 139.726  -7.110   0.389
 1398   1HD2  LEU  89          HD22      LEU  89 141.966  -4.744  -1.491
 1399   2HD2  LEU  89          HD21      LEU  89 142.187  -5.849  -2.844
 1400   3HD2  LEU  89          HD23      LEU  89 140.599  -5.150  -2.528
   
  No H/Q in entry =        1400
  Start of MODEL   20
    1   1H    MET   1           HT3      MET   1 114.745  -8.364  12.669
    2   2H    MET   1           HT2      MET   1 114.470  -7.100  13.771
    3   3H    MET   1           HT1      MET   1 115.788  -7.026  12.701
    4    HA   MET   1           HA       MET   1 116.680  -7.622  14.785
    5   1HB   MET   1           HB2      MET   1 115.771  -9.444  16.112
    6   2HB   MET   1           HB1      MET   1 114.460  -8.330  15.725
    7   1HG   MET   1           HG2      MET   1 113.954  -9.827  13.721
    8   2HG   MET   1           HG1      MET   1 115.060 -11.000  14.435
    9   1HE   MET   1           HE2      MET   1 114.934 -12.037  16.531
   10   2HE   MET   1           HE1      MET   1 114.523 -10.741  17.652
   11   3HE   MET   1           HE3      MET   1 113.539 -12.209  17.591
   12    H    THR   2           HN       THR   2 115.451  -9.923  12.375
   13    HA   THR   2           HA       THR   2 118.024 -11.423  12.478
   14    HB   THR   2           HB       THR   2 115.501 -11.979  10.881
   15    HG1  THR   2           HG1      THR   2 115.713 -13.766  12.673
   16   1HG2  THR   2          HG21      THR   2 117.985 -13.614  11.461
   17   2HG2  THR   2          HG23      THR   2 116.517 -14.271  10.739
   18   3HG2  THR   2          HG22      THR   2 117.441 -13.035   9.886
   19    H    THR   3           HN       THR   3 119.601 -10.694  11.135
   20    HA   THR   3           HA       THR   3 118.965  -8.910   8.907
   21    HB   THR   3           HB       THR   3 121.407  -8.864   8.554
   22    HG1  THR   3           HG1      THR   3 121.900 -10.412  10.778
   23   1HG2  THR   3          HG22      THR   3 120.228  -7.552  10.415
   24   2HG2  THR   3          HG21      THR   3 120.858  -8.769  11.526
   25   3HG2  THR   3          HG23      THR   3 121.970  -7.767  10.592
   26    H    SER   4           HN       SER   4 119.899  -9.390   6.697
   27    HA   SER   4           HA       SER   4 118.880 -11.917   5.741
   28   1HB   SER   4           HB2      SER   4 118.821  -9.989   4.273
   29   2HB   SER   4           HB1      SER   4 120.564  -9.774   4.411
   30    HG   SER   4           HG       SER   4 120.597 -12.052   3.565
   31    H    GLN   5           HN       GLN   5 120.135 -13.569   4.690
   32    HA   GLN   5           HA       GLN   5 122.344 -14.498   6.209
   33   1HB   GLN   5           HB2      GLN   5 121.334 -15.250   3.456
   34   2HB   GLN   5           HB1      GLN   5 122.628 -16.121   4.283
   35   1HG   GLN   5           HG2      GLN   5 121.136 -16.612   6.162
   36   2HG   GLN   5           HG1      GLN   5 119.843 -15.683   5.404
   37   1HE2  GLN   5          HE22      GLN   5 119.807 -19.466   4.555
   38   2HE2  GLN   5          HE21      GLN   5 120.208 -18.719   6.025
   39    H    LYS   6           HN       LYS   6 122.223 -12.297   3.503
   40    HA   LYS   6           HA       LYS   6 124.861 -12.652   2.495
   41   1HB   LYS   6           HB2      LYS   6 123.132 -10.168   2.609
   42   2HB   LYS   6           HB1      LYS   6 124.583 -10.340   1.625
   43   1HG   LYS   6           HG2      LYS   6 122.199 -12.196   1.395
   44   2HG   LYS   6           HG1      LYS   6 122.390 -10.751   0.405
   45   1HD   LYS   6           HD2      LYS   6 124.701 -11.726  -0.239
   46   2HD   LYS   6           HD1      LYS   6 124.102 -13.244   0.432
   47   1HE   LYS   6           HE2      LYS   6 122.916 -11.662  -1.858
   48   2HE   LYS   6           HE1      LYS   6 123.607 -13.284  -1.917
   49   1HZ   LYS   6           HZ2      LYS   6 121.261 -12.585  -0.245
   50   2HZ   LYS   6           HZ1      LYS   6 121.123 -13.179  -1.831
   51   3HZ   LYS   6           HZ3      LYS   6 121.841 -14.136  -0.630
   52    H    HIS   7           HN       HIS   7 123.598 -10.618   5.137
   53    HA   HIS   7           HA       HIS   7 125.983  -9.154   5.589
   54   1HB   HIS   7           HB2      HIS   7 123.918  -8.483   6.673
   55   2HB   HIS   7           HB1      HIS   7 123.820 -10.020   7.532
   56    HD2  HIS   7           HD2      HIS   7 125.302 -10.135   9.900
   57    HE1  HIS   7           HE1      HIS   7 127.235  -6.401   9.511
   58    HE2  HIS   7           HE2      HIS   7 126.843  -8.376  11.053
   59    H    ARG   8           HN       ARG   8 124.905 -12.179   7.169
   60    HA   ARG   8           HA       ARG   8 127.320 -12.483   8.682
   61   1HB   ARG   8           HB2      ARG   8 125.137 -14.428   7.892
   62   2HB   ARG   8           HB1      ARG   8 126.454 -14.833   8.994
   63   1HG   ARG   8           HG2      ARG   8 125.785 -13.039  10.506
   64   2HG   ARG   8           HG1      ARG   8 124.511 -12.538   9.397
   65   1HD   ARG   8           HD2      ARG   8 123.641 -14.965   9.619
   66   2HD   ARG   8           HD1      ARG   8 124.684 -15.077  11.033
   67    HE   ARG   8           HE       ARG   8 122.111 -13.828  10.922
   68   1HH1  ARG   8          HH21      ARG   8 125.290 -13.252  12.146
   69   2HH1  ARG   8          HH22      ARG   8 124.777 -12.004  13.228
   70   1HH2  ARG   8          HH11      ARG   8 121.440 -12.227  12.339
   71   2HH2  ARG   8          HH12      ARG   8 122.603 -11.432  13.346
   72    H    ASP   9           HN       ASP   9 126.251 -13.574   5.516
   73    HA   ASP   9           HA       ASP   9 128.430 -15.430   5.099
   74   1HB   ASP   9           HB2      ASP   9 126.544 -14.047   3.191
   75   2HB   ASP   9           HB1      ASP   9 127.746 -15.222   2.674
   76    H    PHE  10           HN       PHE  10 127.896 -12.010   4.263
   77    HA   PHE  10           HA       PHE  10 130.287 -11.778   2.681
   78   1HB   PHE  10           HB2      PHE  10 128.343 -10.168   2.655
   79   2HB   PHE  10           HB1      PHE  10 128.913  -9.555   4.208
   80    HD1  PHE  10           HD1      PHE  10 129.645  -9.830   0.609
   81    HD2  PHE  10           HD2      PHE  10 131.000  -8.295   4.385
   82    HE1  PHE  10           HE1      PHE  10 131.304  -8.407  -0.565
   83    HE2  PHE  10           HE2      PHE  10 132.659  -6.872   3.210
   84    HZ   PHE  10           HZ       PHE  10 132.812  -6.929   0.737
   85    H    VAL  11           HN       VAL  11 129.636 -11.203   6.136
   86    HA   VAL  11           HA       VAL  11 132.409 -10.327   6.590
   87    HB   VAL  11           HB       VAL  11 131.732 -10.154   8.933
   88   1HG1  VAL  11          HG13      VAL  11 129.644  -9.195   6.953
   89   2HG1  VAL  11          HG12      VAL  11 129.740  -8.646   8.626
   90   3HG1  VAL  11          HG11      VAL  11 131.062  -8.308   7.510
   91   1HG2  VAL  11          HG23      VAL  11 129.351 -11.719   7.935
   92   2HG2  VAL  11          HG22      VAL  11 130.415 -12.099   9.287
   93   3HG2  VAL  11          HG21      VAL  11 129.266 -10.767   9.417
   94    H    ALA  12           HN       ALA  12 131.499 -13.201   5.684
   95    HA   ALA  12           HA       ALA  12 133.038 -14.710   7.783
   96   1HB   ALA  12           HB3      ALA  12 130.793 -15.620   5.969
   97   2HB   ALA  12           HB2      ALA  12 131.741 -16.699   6.992
   98   3HB   ALA  12           HB1      ALA  12 130.735 -15.448   7.723
   99    H    GLU  13           HN       GLU  13 133.157 -13.651   4.539
  100    HA   GLU  13           HA       GLU  13 135.451 -15.446   4.076
  101   1HB   GLU  13           HB2      GLU  13 134.584 -16.237   1.891
  102   2HB   GLU  13           HB1      GLU  13 133.567 -16.771   3.226
  103   1HG   GLU  13           HG2      GLU  13 132.106 -14.758   2.800
  104   2HG   GLU  13           HG1      GLU  13 133.045 -14.464   1.338
  105    HA   PRO  14           HA       PRO  14 137.308 -11.932   2.064
  106   1HB   PRO  14           HB2      PRO  14 137.642 -13.765  -0.301
  107   2HB   PRO  14           HB1      PRO  14 138.824 -12.670   0.447
  108   1HG   PRO  14           HG2      PRO  14 138.881 -15.297   0.912
  109   2HG   PRO  14           HG1      PRO  14 139.275 -14.122   2.181
  110   1HD   PRO  14           HD2      PRO  14 136.858 -15.837   1.909
  111   2HD   PRO  14           HD1      PRO  14 137.570 -15.109   3.365
  112    H    MET  15           HN       MET  15 136.917 -10.436   0.230
  113    HA   MET  15           HA       MET  15 134.117 -10.605  -0.724
  114   1HB   MET  15           HB2      MET  15 134.743  -8.256  -1.624
  115   2HB   MET  15           HB1      MET  15 134.653  -8.463   0.126
  116   1HG   MET  15           HG2      MET  15 137.003  -8.531   0.363
  117   2HG   MET  15           HG1      MET  15 137.257  -8.862  -1.351
  118   1HE   MET  15           HE3      MET  15 135.724  -6.677   1.177
  119   2HE   MET  15           HE2      MET  15 137.264  -5.832   1.282
  120   3HE   MET  15           HE1      MET  15 135.858  -5.004   0.614
  121    H    GLY  16           HN       GLY  16 137.347 -11.034  -1.893
  122   1HA   GLY  16           HA2      GLY  16 138.196 -11.465  -4.045
  123   2HA   GLY  16           HA1      GLY  16 136.664 -12.305  -4.285
  124    H    GLU  17           HN       GLU  17 136.244 -11.631  -6.389
  125    HA   GLU  17           HA       GLU  17 136.239  -8.706  -6.970
  126   1HB   GLU  17           HB2      GLU  17 136.078 -11.152  -8.748
  127   2HB   GLU  17           HB1      GLU  17 135.969  -9.495  -9.340
  128   1HG   GLU  17           HG2      GLU  17 138.190  -8.996  -8.424
  129   2HG   GLU  17           HG1      GLU  17 138.303 -10.631  -7.771
  130    H    LYS  18           HN       LYS  18 134.075 -10.062  -5.383
  131    HA   LYS  18           HA       LYS  18 131.754 -10.430  -7.001
  132   1HB   LYS  18           HB2      LYS  18 132.073  -9.554  -4.119
  133   2HB   LYS  18           HB1      LYS  18 130.502  -9.872  -4.852
  134   1HG   LYS  18           HG2      LYS  18 131.084 -12.165  -5.294
  135   2HG   LYS  18           HG1      LYS  18 132.766 -11.882  -4.843
  136   1HD   LYS  18           HD2      LYS  18 132.080 -11.394  -2.531
  137   2HD   LYS  18           HD1      LYS  18 130.390 -11.640  -2.973
  138   1HE   LYS  18           HE2      LYS  18 131.117 -13.981  -3.765
  139   2HE   LYS  18           HE1      LYS  18 132.611 -13.685  -2.874
  140   1HZ   LYS  18           HZ2      LYS  18 130.826 -12.974  -1.054
  141   2HZ   LYS  18           HZ1      LYS  18 129.918 -14.146  -1.882
  142   3HZ   LYS  18           HZ3      LYS  18 131.413 -14.562  -1.199
  143    HA   PRO  19           HA       PRO  19 130.895  -6.256  -8.242
  144   1HB   PRO  19           HB2      PRO  19 128.171  -6.320  -8.556
  145   2HB   PRO  19           HB1      PRO  19 129.293  -7.132  -9.668
  146   1HG   PRO  19           HG2      PRO  19 127.728  -8.285  -7.396
  147   2HG   PRO  19           HG1      PRO  19 127.977  -8.930  -9.029
  148   1HD   PRO  19           HD2      PRO  19 129.404  -9.832  -6.898
  149   2HD   PRO  19           HD1      PRO  19 130.101  -9.749  -8.530
  150    H    VAL  20           HN       VAL  20 129.866  -4.257  -7.591
  151    HA   VAL  20           HA       VAL  20 129.940  -3.734  -4.831
  152    HB   VAL  20           HB       VAL  20 130.155  -1.962  -6.480
  153   1HG1  VAL  20          HG12      VAL  20 128.399  -3.038  -8.030
  154   2HG1  VAL  20          HG11      VAL  20 127.196  -2.202  -7.049
  155   3HG1  VAL  20          HG13      VAL  20 128.409  -1.279  -7.934
  156   1HG2  VAL  20          HG23      VAL  20 129.121  -1.556  -4.143
  157   2HG2  VAL  20          HG22      VAL  20 128.912  -0.290  -5.353
  158   3HG2  VAL  20          HG21      VAL  20 127.585  -1.395  -4.995
  159    H    GLY  21           HN       GLY  21 127.050  -4.210  -6.873
  160   1HA   GLY  21           HA2      GLY  21 125.073  -3.783  -4.940
  161   2HA   GLY  21           HA1      GLY  21 124.886  -4.900  -6.290
  162    H    SER  22           HN       SER  22 127.512  -6.076  -4.700
  163    HA   SER  22           HA       SER  22 125.901  -8.162  -3.405
  164   1HB   SER  22           HB2      SER  22 128.912  -7.816  -3.445
  165   2HB   SER  22           HB1      SER  22 128.023  -9.280  -3.029
  166    HG   SER  22           HG       SER  22 127.071  -8.793  -5.292
  167    H    LEU  23           HN       LEU  23 127.604  -5.270  -2.491
  168    HA   LEU  23           HA       LEU  23 128.102  -5.911   0.253
  169   1HB   LEU  23           HB2      LEU  23 127.559  -3.245  -1.084
  170   2HB   LEU  23           HB1      LEU  23 128.123  -3.421   0.577
  171    HG   LEU  23           HG       LEU  23 129.577  -4.543  -1.837
  172   1HD1  LEU  23          HD11      LEU  23 129.493  -2.068  -1.878
  173   2HD1  LEU  23          HD13      LEU  23 130.157  -2.026  -0.246
  174   3HD1  LEU  23          HD12      LEU  23 131.128  -2.658  -1.577
  175   1HD2  LEU  23          HD22      LEU  23 130.114  -4.476   1.129
  176   2HD2  LEU  23          HD21      LEU  23 130.385  -5.780  -0.025
  177   3HD2  LEU  23          HD23      LEU  23 131.481  -4.402   0.019
  178    H    ALA  24           HN       ALA  24 126.821  -5.795   2.037
  179    HA   ALA  24           HA       ALA  24 123.985  -6.038   1.717
  180   1HB   ALA  24           HB3      ALA  24 125.246  -6.997   3.626
  181   2HB   ALA  24           HB2      ALA  24 125.546  -5.366   4.228
  182   3HB   ALA  24           HB1      ALA  24 123.899  -5.994   4.166
  183    H    GLY  25           HN       GLY  25 122.387  -4.557   1.769
  184   1HA   GLY  25           HA2      GLY  25 121.358  -2.468   2.473
  185   2HA   GLY  25           HA1      GLY  25 122.963  -1.776   2.695
  186    H    ILE  26           HN       ILE  26 123.626  -3.133  -0.042
  187    HA   ILE  26           HA       ILE  26 122.702  -0.809  -1.670
  188    HB   ILE  26           HB       ILE  26 124.694  -2.996  -2.361
  189   1HG1  ILE  26          HG12      ILE  26 125.541  -1.742  -0.459
  190   2HG1  ILE  26          HG11      ILE  26 126.410  -1.223  -1.902
  191   1HG2  ILE  26          HG22      ILE  26 124.085  -0.306  -3.619
  192   2HG2  ILE  26          HG21      ILE  26 125.413  -1.364  -4.096
  193   3HG2  ILE  26          HG23      ILE  26 123.744  -1.888  -4.320
  194   1HD1  ILE  26          HD13      ILE  26 124.552   0.634  -2.029
  195   2HD1  ILE  26          HD12      ILE  26 124.312   0.248  -0.327
  196   3HD1  ILE  26          HD11      ILE  26 125.882   0.817  -0.888
  197    H    GLY  27           HN       GLY  27 120.829  -1.157  -2.827
  198   1HA   GLY  27           HA2      GLY  27 119.986  -3.919  -3.428
  199   2HA   GLY  27           HA1      GLY  27 119.028  -2.459  -3.683
  200    H    GLU  28           HN       GLU  28 119.097  -4.255  -5.729
  201    HA   GLU  28           HA       GLU  28 121.198  -4.055  -7.595
  202   1HB   GLU  28           HB2      GLU  28 118.222  -4.403  -8.029
  203   2HB   GLU  28           HB1      GLU  28 119.409  -4.550  -9.323
  204   1HG   GLU  28           HG2      GLU  28 119.017  -6.773  -8.510
  205   2HG   GLU  28           HG1      GLU  28 120.592  -6.286  -7.883
  206    H    VAL  29           HN       VAL  29 118.407  -1.871  -7.153
  207    HA   VAL  29           HA       VAL  29 119.037  -0.247  -9.455
  208    HB   VAL  29           HB       VAL  29 117.437   0.338  -6.947
  209   1HG1  VAL  29          HG11      VAL  29 117.894   1.991  -9.438
  210   2HG1  VAL  29          HG13      VAL  29 116.499   2.231  -8.387
  211   3HG1  VAL  29          HG12      VAL  29 118.128   2.475  -7.758
  212   1HG2  VAL  29          HG22      VAL  29 116.723  -0.456  -9.782
  213   2HG2  VAL  29          HG21      VAL  29 116.384  -1.347  -8.299
  214   3HG2  VAL  29          HG23      VAL  29 115.540   0.164  -8.632
  215    H    LEU  30           HN       LEU  30 119.854  -0.002  -6.012
  216    HA   LEU  30           HA       LEU  30 121.203   2.525  -6.218
  217   1HB   LEU  30           HB2      LEU  30 121.499   0.268  -4.216
  218   2HB   LEU  30           HB1      LEU  30 122.220   1.864  -4.025
  219    HG   LEU  30           HG       LEU  30 119.249   1.358  -4.374
  220   1HD1  LEU  30          HD13      LEU  30 120.114   0.441  -2.242
  221   2HD1  LEU  30          HD12      LEU  30 120.820   2.013  -1.863
  222   3HD1  LEU  30          HD11      LEU  30 119.069   1.836  -1.973
  223   1HD2  LEU  30          HD21      LEU  30 120.951   3.816  -4.025
  224   2HD2  LEU  30          HD23      LEU  30 119.522   3.576  -5.031
  225   3HD2  LEU  30          HD22      LEU  30 119.347   3.797  -3.294
  226    H    GLY  31           HN       GLY  31 122.290  -0.829  -6.543
  227   1HA   GLY  31           HA2      GLY  31 125.090  -0.308  -6.599
  228   2HA   GLY  31           HA1      GLY  31 124.310  -1.676  -7.396
  229    H    LYS  32           HN       LYS  32 122.625  -0.169  -9.146
  230    HA   LYS  32           HA       LYS  32 124.401   0.238 -11.343
  231   1HB   LYS  32           HB2      LYS  32 121.954  -0.297 -11.530
  232   2HB   LYS  32           HB1      LYS  32 121.603   1.361 -11.041
  233   1HG   LYS  32           HG2      LYS  32 122.886   2.207 -12.972
  234   2HG   LYS  32           HG1      LYS  32 123.237   0.551 -13.466
  235   1HD   LYS  32           HD2      LYS  32 120.809   0.118 -13.702
  236   2HD   LYS  32           HD1      LYS  32 120.477   1.789 -13.250
  237   1HE   LYS  32           HE2      LYS  32 122.172   0.961 -15.624
  238   2HE   LYS  32           HE1      LYS  32 120.477   1.441 -15.725
  239   1HZ   LYS  32           HZ2      LYS  32 121.972   3.337 -14.240
  240   2HZ   LYS  32           HZ1      LYS  32 122.680   3.097 -15.765
  241   3HZ   LYS  32           HZ3      LYS  32 121.053   3.565 -15.651
  242    H    LYS  33           HN       LYS  33 122.919   2.578  -9.076
  243    HA   LYS  33           HA       LYS  33 123.845   4.893 -10.519
  244   1HB   LYS  33           HB2      LYS  33 123.084   4.489  -7.616
  245   2HB   LYS  33           HB1      LYS  33 123.492   6.063  -8.299
  246   1HG   LYS  33           HG2      LYS  33 121.682   5.817  -9.959
  247   2HG   LYS  33           HG1      LYS  33 121.269   4.244  -9.275
  248   1HD   LYS  33           HD2      LYS  33 120.778   5.312  -7.105
  249   2HD   LYS  33           HD1      LYS  33 121.187   6.886  -7.788
  250   1HE   LYS  33           HE2      LYS  33 118.994   5.073  -8.837
  251   2HE   LYS  33           HE1      LYS  33 118.727   6.456  -7.777
  252   1HZ   LYS  33           HZ3      LYS  33 120.291   7.407  -9.821
  253   2HZ   LYS  33           HZ2      LYS  33 119.158   6.398 -10.589
  254   3HZ   LYS  33           HZ1      LYS  33 118.631   7.681  -9.607
  255    H    LEU  34           HN       LEU  34 125.252   3.081  -7.762
  256    HA   LEU  34           HA       LEU  34 127.551   4.777  -7.503
  257   1HB   LEU  34           HB2      LEU  34 127.138   1.857  -6.799
  258   2HB   LEU  34           HB1      LEU  34 128.594   2.754  -6.391
  259    HG   LEU  34           HG       LEU  34 125.813   3.624  -5.553
  260   1HD1  LEU  34          HD12      LEU  34 127.896   1.984  -4.084
  261   2HD1  LEU  34          HD11      LEU  34 126.532   2.767  -3.286
  262   3HD1  LEU  34          HD13      LEU  34 126.247   1.504  -4.484
  263   1HD2  LEU  34          HD23      LEU  34 128.626   4.563  -4.953
  264   2HD2  LEU  34          HD22      LEU  34 127.207   5.517  -5.384
  265   3HD2  LEU  34          HD21      LEU  34 127.338   4.823  -3.776
  266    H    GLU  35           HN       GLU  35 126.861   1.943  -9.468
  267    HA   GLU  35           HA       GLU  35 129.475   1.547 -10.536
  268   1HB   GLU  35           HB2      GLU  35 127.626  -0.063 -10.845
  269   2HB   GLU  35           HB1      GLU  35 126.789   1.092 -11.881
  270   1HG   GLU  35           HG2      GLU  35 128.678   1.030 -13.476
  271   2HG   GLU  35           HG1      GLU  35 129.515  -0.124 -12.436
  272    H    GLU  36           HN       GLU  36 126.856   3.703 -11.580
  273    HA   GLU  36           HA       GLU  36 128.223   4.686 -13.925
  274   1HB   GLU  36           HB2      GLU  36 126.019   5.866 -12.211
  275   2HB   GLU  36           HB1      GLU  36 126.613   6.631 -13.684
  276   1HG   GLU  36           HG2      GLU  36 125.573   3.791 -13.594
  277   2HG   GLU  36           HG1      GLU  36 124.567   5.179 -14.005
  278    H    ARG  37           HN       ARG  37 128.575   5.218 -10.550
  279    HA   ARG  37           HA       ARG  37 129.919   7.827 -10.917
  280   1HB   ARG  37           HB2      ARG  37 129.316   6.135  -8.480
  281   2HB   ARG  37           HB1      ARG  37 130.218   7.644  -8.399
  282   1HG   ARG  37           HG2      ARG  37 127.506   7.541  -9.713
  283   2HG   ARG  37           HG1      ARG  37 127.642   7.682  -7.964
  284   1HD   ARG  37           HD2      ARG  37 129.009   9.593  -9.884
  285   2HD   ARG  37           HD1      ARG  37 127.426   9.883  -9.187
  286    HE   ARG  37           HE       ARG  37 129.100   9.326  -7.012
  287   1HH1  ARG  37          HH21      ARG  37 128.949  11.542  -9.647
  288   2HH1  ARG  37          HH22      ARG  37 129.772  12.810  -8.803
  289   1HH2  ARG  37          HH11      ARG  37 130.179  10.969  -5.891
  290   2HH2  ARG  37          HH12      ARG  37 130.474  12.484  -6.676
  291    H    GLY  38           HN       GLY  38 130.859   4.729 -11.478
  292   1HA   GLY  38           HA2      GLY  38 133.135   4.251 -12.108
  293   2HA   GLY  38           HA1      GLY  38 133.703   5.440 -10.946
  294    H    PHE  39           HN       PHE  39 131.323   3.454  -9.511
  295    HA   PHE  39           HA       PHE  39 133.482   1.817  -8.214
  296   1HB   PHE  39           HB2      PHE  39 130.690   2.499  -7.264
  297   2HB   PHE  39           HB1      PHE  39 131.863   1.539  -6.368
  298    HD1  PHE  39           HD2      PHE  39 133.862   2.574  -5.401
  299    HD2  PHE  39           HD1      PHE  39 130.975   4.889  -7.551
  300    HE1  PHE  39           HE2      PHE  39 134.886   4.660  -4.525
  301    HE2  PHE  39           HE1      PHE  39 131.983   6.978  -6.682
  302    HZ   PHE  39           HZ       PHE  39 133.945   6.865  -5.165
  303    H    ASP  40           HN       ASP  40 133.322   0.453 -10.227
  304    HA   ASP  40           HA       ASP  40 130.863  -1.053 -10.651
  305   1HB   ASP  40           HB2      ASP  40 132.128  -2.220 -12.377
  306   2HB   ASP  40           HB1      ASP  40 132.438  -0.488 -12.490
  307    H    LYS  41           HN       LYS  41 133.402  -1.385  -8.405
  308    HA   LYS  41           HA       LYS  41 132.514  -4.186  -7.859
  309   1HB   LYS  41           HB2      LYS  41 135.396  -3.270  -8.018
  310   2HB   LYS  41           HB1      LYS  41 134.875  -4.824  -7.359
  311   1HG   LYS  41           HG2      LYS  41 133.797  -5.375  -9.517
  312   2HG   LYS  41           HG1      LYS  41 134.341  -3.834 -10.177
  313   1HD   LYS  41           HD2      LYS  41 136.691  -4.500  -9.792
  314   2HD   LYS  41           HD1      LYS  41 136.133  -6.044  -9.147
  315   1HE   LYS  41           HE2      LYS  41 135.346  -5.129 -11.912
  316   2HE   LYS  41           HE1      LYS  41 136.848  -6.006 -11.622
  317   1HZ   LYS  41           HZ1      LYS  41 134.146  -6.955 -10.840
  318   2HZ   LYS  41           HZ3      LYS  41 135.005  -7.481 -12.204
  319   3HZ   LYS  41           HZ2      LYS  41 135.604  -7.805 -10.648
  320    H    ALA  42           HN       ALA  42 132.963  -4.876  -5.665
  321    HA   ALA  42           HA       ALA  42 132.189  -2.901  -3.754
  322   1HB   ALA  42           HB1      ALA  42 133.215  -5.722  -3.481
  323   2HB   ALA  42           HB3      ALA  42 132.738  -4.756  -2.085
  324   3HB   ALA  42           HB2      ALA  42 131.556  -5.144  -3.334
  325    H    TYR  43           HN       TYR  43 135.430  -4.373  -4.308
  326    HA   TYR  43           HA       TYR  43 136.599  -3.198  -2.005
  327   1HB   TYR  43           HB2      TYR  43 138.765  -3.632  -2.945
  328   2HB   TYR  43           HB1      TYR  43 137.704  -4.977  -3.339
  329    HD1  TYR  43           HD1      TYR  43 139.081  -1.778  -4.730
  330    HD2  TYR  43           HD2      TYR  43 137.429  -5.653  -5.571
  331    HE1  TYR  43           HE1      TYR  43 139.629  -1.494  -7.126
  332    HE2  TYR  43           HE2      TYR  43 137.985  -5.363  -7.966
  333    HH   TYR  43           HH       TYR  43 140.085  -3.396  -9.148
  334    H    VAL  44           HN       VAL  44 135.613  -1.629  -4.918
  335    HA   VAL  44           HA       VAL  44 137.440   0.651  -4.541
  336    HB   VAL  44           HB       VAL  44 134.870   0.575  -6.160
  337   1HG1  VAL  44          HG12      VAL  44 136.158   2.785  -5.555
  338   2HG1  VAL  44          HG11      VAL  44 137.331   2.222  -6.742
  339   3HG1  VAL  44          HG13      VAL  44 135.661   2.514  -7.224
  340   1HG2  VAL  44          HG22      VAL  44 137.697  -0.208  -6.924
  341   2HG2  VAL  44          HG21      VAL  44 136.263  -1.233  -6.959
  342   3HG2  VAL  44          HG23      VAL  44 136.420   0.104  -8.098
  343    H    VAL  45           HN       VAL  45 134.236  -0.351  -3.682
  344    HA   VAL  45           HA       VAL  45 133.372   2.196  -2.546
  345    HB   VAL  45           HB       VAL  45 132.313  -0.626  -2.161
  346   1HG1  VAL  45          HG11      VAL  45 131.194   2.079  -1.376
  347   2HG1  VAL  45          HG13      VAL  45 130.240   0.597  -1.405
  348   3HG1  VAL  45          HG12      VAL  45 131.605   0.745  -0.300
  349   1HG2  VAL  45          HG22      VAL  45 131.571   1.652  -4.013
  350   2HG2  VAL  45          HG21      VAL  45 132.065   0.018  -4.455
  351   3HG2  VAL  45          HG23      VAL  45 130.496   0.290  -3.699
  352    H    LEU  46           HN       LEU  46 134.757  -0.836  -1.293
  353    HA   LEU  46           HA       LEU  46 134.628  -0.163   1.476
  354   1HB   LEU  46           HB2      LEU  46 135.211  -2.439   0.679
  355   2HB   LEU  46           HB1      LEU  46 136.724  -1.818   0.022
  356    HG   LEU  46           HG       LEU  46 137.431  -1.142   2.291
  357   1HD1  LEU  46          HD11      LEU  46 134.682  -2.124   2.992
  358   2HD1  LEU  46          HD13      LEU  46 135.971  -2.255   4.186
  359   3HD1  LEU  46          HD12      LEU  46 135.522  -0.682   3.546
  360   1HD2  LEU  46          HD23      LEU  46 137.701  -3.551   1.283
  361   2HD2  LEU  46          HD22      LEU  46 138.108  -3.258   2.973
  362   3HD2  LEU  46          HD21      LEU  46 136.567  -4.003   2.559
  363    H    GLY  47           HN       GLY  47 136.945   0.570  -1.061
  364   1HA   GLY  47           HA2      GLY  47 139.026   1.722   0.466
  365   2HA   GLY  47           HA1      GLY  47 138.625   2.214  -1.180
  366    H    GLN  48           HN       GLN  48 136.026   3.234  -0.764
  367    HA   GLN  48           HA       GLN  48 136.584   5.888   0.131
  368   1HB   GLN  48           HB2      GLN  48 134.685   5.259  -1.364
  369   2HB   GLN  48           HB1      GLN  48 133.892   4.487   0.007
  370   1HG   GLN  48           HG2      GLN  48 132.964   6.713  -0.265
  371   2HG   GLN  48           HG1      GLN  48 133.938   6.701   1.201
  372   1HE2  GLN  48          HE22      GLN  48 136.074   9.236   0.030
  373   2HE2  GLN  48          HE21      GLN  48 135.495   8.332   1.345
  374    H    PHE  49           HN       PHE  49 135.064   3.138   1.793
  375    HA   PHE  49           HA       PHE  49 134.362   4.463   4.216
  376   1HB   PHE  49           HB2      PHE  49 133.616   2.180   3.569
  377   2HB   PHE  49           HB1      PHE  49 135.260   1.599   3.796
  378    HD1  PHE  49           HD1      PHE  49 132.693   3.603   5.658
  379    HD2  PHE  49           HD2      PHE  49 135.751   0.591   5.851
  380    HE1  PHE  49           HE1      PHE  49 132.202   3.259   8.062
  381    HE2  PHE  49           HE2      PHE  49 135.262   0.250   8.258
  382    HZ   PHE  49           HZ       PHE  49 133.487   1.583   9.363
  383    H    LEU  50           HN       LEU  50 137.346   2.900   3.158
  384    HA   LEU  50           HA       LEU  50 138.744   3.203   5.669
  385   1HB   LEU  50           HB2      LEU  50 139.883   3.045   2.857
  386   2HB   LEU  50           HB1      LEU  50 140.793   2.799   4.345
  387    HG   LEU  50           HG       LEU  50 138.452   1.109   3.408
  388   1HD1  LEU  50          HD12      LEU  50 140.646   0.866   2.166
  389   2HD1  LEU  50          HD11      LEU  50 141.371   0.346   3.684
  390   3HD1  LEU  50          HD13      LEU  50 140.079  -0.607   2.951
  391   1HD2  LEU  50          HD22      LEU  50 140.113   1.132   5.929
  392   2HD2  LEU  50          HD21      LEU  50 138.365   0.959   5.753
  393   3HD2  LEU  50          HD23      LEU  50 139.426  -0.380   5.339
  394    H    VAL  51           HN       VAL  51 138.422   5.278   2.824
  395    HA   VAL  51           HA       VAL  51 140.316   7.258   3.651
  396    HB   VAL  51           HB       VAL  51 137.865   7.493   1.884
  397   1HG1  VAL  51          HG11      VAL  51 140.137   9.404   2.471
  398   2HG1  VAL  51          HG13      VAL  51 139.143   9.530   1.020
  399   3HG1  VAL  51          HG12      VAL  51 138.405   9.709   2.612
  400   1HG2  VAL  51          HG23      VAL  51 139.722   5.920   1.190
  401   2HG2  VAL  51          HG22      VAL  51 139.435   7.244   0.061
  402   3HG2  VAL  51          HG21      VAL  51 140.806   7.309   1.169
  403    H    LEU  52           HN       LEU  52 136.990   6.653   4.603
  404    HA   LEU  52           HA       LEU  52 136.747   9.305   5.890
  405   1HB   LEU  52           HB2      LEU  52 134.858   6.936   5.843
  406   2HB   LEU  52           HB1      LEU  52 134.483   8.529   6.500
  407    HG   LEU  52           HG       LEU  52 135.267   7.984   3.617
  408   1HD1  LEU  52          HD12      LEU  52 132.608   8.354   4.997
  409   2HD1  LEU  52          HD11      LEU  52 132.805   8.699   3.279
  410   3HD1  LEU  52          HD13      LEU  52 133.098   7.071   3.891
  411   1HD2  LEU  52          HD23      LEU  52 134.612  10.472   5.194
  412   2HD2  LEU  52          HD22      LEU  52 135.863  10.224   3.976
  413   3HD2  LEU  52          HD21      LEU  52 134.183  10.400   3.486
  414    H    LYS  53           HN       LYS  53 138.565   6.866   6.813
  415    HA   LYS  53           HA       LYS  53 139.195   5.944   8.889
  416   1HB   LYS  53           HB2      LYS  53 138.187   8.681   9.708
  417   2HB   LYS  53           HB1      LYS  53 139.157   7.626  10.735
  418   1HG   LYS  53           HG2      LYS  53 140.963   7.646   9.048
  419   2HG   LYS  53           HG1      LYS  53 139.991   8.705   8.026
  420   1HD   LYS  53           HD2      LYS  53 139.973  10.416   9.799
  421   2HD   LYS  53           HD1      LYS  53 140.944   9.363  10.830
  422   1HE   LYS  53           HE2      LYS  53 142.780   9.418   9.225
  423   2HE   LYS  53           HE1      LYS  53 141.807  10.367   8.100
  424   1HZ   LYS  53           HZ2      LYS  53 141.665  11.782  10.409
  425   2HZ   LYS  53           HZ1      LYS  53 143.266  11.214  10.422
  426   3HZ   LYS  53           HZ3      LYS  53 142.702  12.124   9.107
  427    H    LYS  54           HN       LYS  54 136.562   5.147   8.118
  428    HA   LYS  54           HA       LYS  54 134.664   4.109   9.013
  429   1HB   LYS  54           HB2      LYS  54 136.206   4.364  11.622
  430   2HB   LYS  54           HB1      LYS  54 134.802   3.342  11.350
  431   1HG   LYS  54           HG2      LYS  54 136.026   2.091   9.625
  432   2HG   LYS  54           HG1      LYS  54 137.439   3.114   9.875
  433   1HD   LYS  54           HD2      LYS  54 137.568   2.366  12.224
  434   2HD   LYS  54           HD1      LYS  54 136.157   1.337  11.974
  435   1HE   LYS  54           HE2      LYS  54 137.319  -0.093  10.488
  436   2HE   LYS  54           HE1      LYS  54 138.616   1.077  10.241
  437   1HZ   LYS  54           HZ3      LYS  54 139.189   0.804  12.611
  438   2HZ   LYS  54           HZ2      LYS  54 138.029  -0.433  12.729
  439   3HZ   LYS  54           HZ1      LYS  54 139.378  -0.623  11.714
  440    H    ASP  55           HN       ASP  55 135.042   7.214   9.124
  441    HA   ASP  55           HA       ASP  55 133.505   8.055  11.424
  442   1HB   ASP  55           HB2      ASP  55 134.876   9.668  10.206
  443   2HB   ASP  55           HB1      ASP  55 133.928   9.406   8.743
  444    H    GLU  56           HN       GLU  56 131.471   7.384  11.750
  445    HA   GLU  56           HA       GLU  56 129.794   6.187   9.805
  446   1HB   GLU  56           HB2      GLU  56 129.626   5.792  12.227
  447   2HB   GLU  56           HB1      GLU  56 129.049   7.441  12.455
  448   1HG   GLU  56           HG2      GLU  56 127.079   6.960  11.047
  449   2HG   GLU  56           HG1      GLU  56 127.662   5.314  10.793
  450    H    ASP  57           HN       ASP  57 129.700   9.543  11.060
  451    HA   ASP  57           HA       ASP  57 127.256  10.193   9.661
  452   1HB   ASP  57           HB2      ASP  57 129.442  11.924  10.841
  453   2HB   ASP  57           HB1      ASP  57 127.967  12.577  10.125
  454    H    LEU  58           HN       LEU  58 130.671  10.583   8.851
  455    HA   LEU  58           HA       LEU  58 130.136  12.103   6.444
  456   1HB   LEU  58           HB2      LEU  58 132.543  10.439   7.217
  457   2HB   LEU  58           HB1      LEU  58 132.479  11.483   5.803
  458    HG   LEU  58           HG       LEU  58 132.027  12.430   8.650
  459   1HD1  LEU  58          HD12      LEU  58 134.479  12.410   6.885
  460   2HD1  LEU  58          HD11      LEU  58 134.302  13.550   8.219
  461   3HD1  LEU  58          HD13      LEU  58 134.316  11.815   8.537
  462   1HD2  LEU  58          HD22      LEU  58 132.022  13.761   5.949
  463   2HD2  LEU  58          HD21      LEU  58 130.984  14.054   7.342
  464   3HD2  LEU  58          HD23      LEU  58 132.633  14.671   7.329
  465    H    PHE  59           HN       PHE  59 130.559   8.633   7.066
  466    HA   PHE  59           HA       PHE  59 130.466   7.842   4.302
  467   1HB   PHE  59           HB2      PHE  59 131.266   6.295   6.002
  468   2HB   PHE  59           HB1      PHE  59 129.704   6.335   6.820
  469    HD1  PHE  59           HD1      PHE  59 131.384   5.389   3.624
  470    HD2  PHE  59           HD2      PHE  59 127.918   4.933   6.124
  471    HE1  PHE  59           HE1      PHE  59 130.576   3.548   2.169
  472    HE2  PHE  59           HE2      PHE  59 127.112   3.096   4.669
  473    HZ   PHE  59           HZ       PHE  59 128.439   2.402   2.691
  474    H    ARG  60           HN       ARG  60 127.913   8.184   6.781
  475    HA   ARG  60           HA       ARG  60 125.776   7.235   5.171
  476   1HB   ARG  60           HB2      ARG  60 125.814   9.249   7.422
  477   2HB   ARG  60           HB1      ARG  60 124.325   8.691   6.666
  478   1HG   ARG  60           HG2      ARG  60 124.895   6.362   7.262
  479   2HG   ARG  60           HG1      ARG  60 126.379   6.921   8.025
  480   1HD   ARG  60           HD2      ARG  60 125.026   8.334   9.566
  481   2HD   ARG  60           HD1      ARG  60 123.562   7.701   8.826
  482    HE   ARG  60           HE       ARG  60 124.987   5.443   9.655
  483   1HH1  ARG  60          HH21      ARG  60 123.746   8.347  11.041
  484   2HH1  ARG  60          HH22      ARG  60 123.506   7.656  12.611
  485   1HH2  ARG  60          HH11      ARG  60 124.680   4.520  11.702
  486   2HH2  ARG  60          HH12      ARG  60 124.038   5.489  12.986
  487    H    GLU  61           HN       GLU  61 126.927  10.635   5.579
  488    HA   GLU  61           HA       GLU  61 124.967  11.706   3.772
  489   1HB   GLU  61           HB2      GLU  61 127.645  12.707   4.756
  490   2HB   GLU  61           HB1      GLU  61 126.700  13.621   3.583
  491   1HG   GLU  61           HG2      GLU  61 126.100  14.499   5.716
  492   2HG   GLU  61           HG1      GLU  61 124.752  13.467   5.244
  493    H    TRP  62           HN       TRP  62 128.255  10.429   3.283
  494    HA   TRP  62           HA       TRP  62 128.519  11.248   0.577
  495   1HB   TRP  62           HB2      TRP  62 130.460  10.418   1.720
  496   2HB   TRP  62           HB1      TRP  62 129.674   8.876   2.062
  497    HD1  TRP  62           HD1      TRP  62 131.152  10.904  -0.846
  498    HE1  TRP  62           HE1      TRP  62 131.653   9.299  -2.805
  499    HE3  TRP  62           HE3      TRP  62 129.119   6.590   0.998
  500    HZ2  TRP  62           HZ2      TRP  62 131.252   6.548  -3.492
  501    HZ3  TRP  62           HZ3      TRP  62 129.204   4.498  -0.325
  502    HH2  TRP  62           HH2      TRP  62 130.262   4.472  -2.565
  503    H    LEU  63           HN       LEU  63 127.288   8.151   1.876
  504    HA   LEU  63           HA       LEU  63 126.707   7.075  -0.720
  505   1HB   LEU  63           HB2      LEU  63 126.983   5.667   1.292
  506   2HB   LEU  63           HB1      LEU  63 125.520   6.368   1.980
  507    HG   LEU  63           HG       LEU  63 124.211   5.482   0.079
  508   1HD1  LEU  63          HD13      LEU  63 126.939   4.636  -0.844
  509   2HD1  LEU  63          HD12      LEU  63 125.553   3.629  -1.260
  510   3HD1  LEU  63          HD11      LEU  63 125.604   5.313  -1.774
  511   1HD2  LEU  63          HD22      LEU  63 125.928   3.469   1.555
  512   2HD2  LEU  63          HD21      LEU  63 124.376   4.119   2.085
  513   3HD2  LEU  63          HD23      LEU  63 124.455   3.059   0.678
  514    H    LYS  64           HN       LYS  64 124.631   8.627   1.717
  515    HA   LYS  64           HA       LYS  64 122.211   8.464   0.183
  516   1HB   LYS  64           HB2      LYS  64 122.216   8.983   2.601
  517   2HB   LYS  64           HB1      LYS  64 122.992  10.530   2.264
  518   1HG   LYS  64           HG2      LYS  64 121.048  11.215   0.898
  519   2HG   LYS  64           HG1      LYS  64 120.270   9.667   1.230
  520   1HD   LYS  64           HD2      LYS  64 120.401  10.207   3.682
  521   2HD   LYS  64           HD1      LYS  64 120.991  11.812   3.244
  522   1HE   LYS  64           HE2      LYS  64 118.323  10.601   2.461
  523   2HE   LYS  64           HE1      LYS  64 118.582  11.923   3.600
  524   1HZ   LYS  64           HZ2      LYS  64 119.266  11.970   0.710
  525   2HZ   LYS  64           HZ1      LYS  64 117.934  12.746   1.424
  526   3HZ   LYS  64           HZ3      LYS  64 119.509  13.245   1.808
  527    H    ASP  65           HN       ASP  65 124.608  11.054   0.520
  528    HA   ASP  65           HA       ASP  65 123.342  12.840  -1.345
  529   1HB   ASP  65           HB2      ASP  65 125.077  13.462   0.402
  530   2HB   ASP  65           HB1      ASP  65 126.289  12.733  -0.652
  531    H    THR  66           HN       THR  66 125.660  10.213  -1.678
  532    HA   THR  66           HA       THR  66 126.324  10.878  -4.428
  533    HB   THR  66           HB       THR  66 126.825   8.375  -2.793
  534    HG1  THR  66           HG1      THR  66 128.518  10.515  -3.570
  535   1HG2  THR  66          HG22      THR  66 127.864   9.229  -5.510
  536   2HG2  THR  66          HG21      THR  66 128.539   7.906  -4.559
  537   3HG2  THR  66          HG23      THR  66 126.884   7.807  -5.156
  538    H    CYS  67           HN       CYS  67 123.990   8.653  -2.876
  539    HA   CYS  67           HA       CYS  67 122.942   8.060  -5.633
  540   1HB   CYS  67           HB2      CYS  67 122.504   5.773  -4.941
  541   2HB   CYS  67           HB1      CYS  67 124.211   6.142  -4.706
  542    HG   CYS  67           HG       CYS  67 123.865   5.507  -2.343
  543    H    GLY  68           HN       GLY  68 122.157   8.619  -2.231
  544   1HA   GLY  68           HA2      GLY  68 120.047   9.759  -1.700
  545   2HA   GLY  68           HA1      GLY  68 119.281   8.898  -3.034
  546    H    ALA  69           HN       ALA  69 121.467   7.000  -1.173
  547    HA   ALA  69           HA       ALA  69 119.620   5.024  -0.451
  548   1HB   ALA  69           HB3      ALA  69 122.125   5.888   1.024
  549   2HB   ALA  69           HB2      ALA  69 121.267   4.374   1.311
  550   3HB   ALA  69           HB1      ALA  69 122.032   4.673  -0.251
  551    H    ASN  70           HN       ASN  70 118.491   4.563   1.555
  552    HA   ASN  70           HA       ASN  70 117.587   7.015   2.939
  553   1HB   ASN  70           HB2      ASN  70 116.663   4.128   3.008
  554   2HB   ASN  70           HB1      ASN  70 115.935   5.414   3.971
  555   1HD2  ASN  70          HD22      ASN  70 114.098   5.052   0.687
  556   2HD2  ASN  70          HD21      ASN  70 114.501   3.950   1.912
  557    H    ALA  71           HN       ALA  71 117.194   6.688   5.386
  558    HA   ALA  71           HA       ALA  71 119.687   6.400   6.714
  559   1HB   ALA  71           HB1      ALA  71 117.682   7.678   7.552
  560   2HB   ALA  71           HB3      ALA  71 116.952   6.133   7.983
  561   3HB   ALA  71           HB2      ALA  71 118.444   6.651   8.766
  562    H    LYS  72           HN       LYS  72 117.051   4.048   6.240
  563    HA   LYS  72           HA       LYS  72 118.155   2.105   8.066
  564   1HB   LYS  72           HB2      LYS  72 115.775   2.124   7.304
  565   2HB   LYS  72           HB1      LYS  72 116.321   1.641   5.699
  566   1HG   LYS  72           HG2      LYS  72 117.307  -0.412   6.645
  567   2HG   LYS  72           HG1      LYS  72 116.765   0.066   8.255
  568   1HD   LYS  72           HD2      LYS  72 114.422   0.047   7.473
  569   2HD   LYS  72           HD1      LYS  72 114.964  -0.439   5.865
  570   1HE   LYS  72           HE2      LYS  72 115.926  -2.507   6.812
  571   2HE   LYS  72           HE1      LYS  72 115.390  -2.019   8.419
  572   1HZ   LYS  72           HZ1      LYS  72 113.309  -1.949   6.434
  573   2HZ   LYS  72           HZ3      LYS  72 113.947  -3.502   6.684
  574   3HZ   LYS  72           HZ2      LYS  72 113.303  -2.627   7.991
  575    H    GLN  73           HN       GLN  73 118.425   2.587   4.573
  576    HA   GLN  73           HA       GLN  73 119.939   0.209   4.068
  577   1HB   GLN  73           HB2      GLN  73 119.722   2.816   2.540
  578   2HB   GLN  73           HB1      GLN  73 120.531   1.373   1.925
  579   1HG   GLN  73           HG2      GLN  73 118.476   0.094   2.037
  580   2HG   GLN  73           HG1      GLN  73 117.645   1.422   2.848
  581   1HE2  GLN  73          HE22      GLN  73 116.722   1.686  -0.729
  582   2HE2  GLN  73          HE21      GLN  73 116.434   0.600   0.543
  583    H    SER  74           HN       SER  74 120.904   3.536   4.882
  584    HA   SER  74           HA       SER  74 123.697   3.128   4.399
  585   1HB   SER  74           HB2      SER  74 123.996   5.248   5.345
  586   2HB   SER  74           HB1      SER  74 122.328   5.333   4.785
  587    HG   SER  74           HG       SER  74 121.748   5.558   6.783
  588    H    ARG  75           HN       ARG  75 121.657   2.668   7.306
  589    HA   ARG  75           HA       ARG  75 123.801   2.221   9.124
  590   1HB   ARG  75           HB2      ARG  75 120.954   1.205   9.093
  591   2HB   ARG  75           HB1      ARG  75 122.074   0.850  10.409
  592   1HG   ARG  75           HG2      ARG  75 122.407   3.267  10.781
  593   2HG   ARG  75           HG1      ARG  75 121.281   3.622   9.469
  594   1HD   ARG  75           HD2      ARG  75 120.611   2.082  11.996
  595   2HD   ARG  75           HD1      ARG  75 120.144   3.751  11.655
  596    HE   ARG  75           HE       ARG  75 119.138   2.361   9.501
  597   1HH1  ARG  75          HH21      ARG  75 118.982   2.042  12.928
  598   2HH1  ARG  75          HH22      ARG  75 117.392   1.357  12.925
  599   1HH2  ARG  75          HH11      ARG  75 117.061   1.475   9.472
  600   2HH2  ARG  75          HH12      ARG  75 116.302   1.036  10.967
  601    H    ASP  76           HN       ASP  76 122.118  -0.042   6.924
  602    HA   ASP  76           HA       ASP  76 123.377  -2.385   7.965
  603   1HB   ASP  76           HB2      ASP  76 122.186  -1.756   5.256
  604   2HB   ASP  76           HB1      ASP  76 122.757  -3.362   5.711
  605    H    CYS  77           HN       CYS  77 124.344  -0.166   5.339
  606    HA   CYS  77           HA       CYS  77 126.581  -1.778   4.516
  607   1HB   CYS  77           HB2      CYS  77 125.916   1.150   4.170
  608   2HB   CYS  77           HB1      CYS  77 127.364   0.414   3.483
  609    HG   CYS  77           HG       CYS  77 125.905  -1.032   1.942
  610    H    PHE  78           HN       PHE  78 126.238   0.910   6.856
  611    HA   PHE  78           HA       PHE  78 129.010   1.250   7.354
  612   1HB   PHE  78           HB2      PHE  78 127.368   2.817   8.239
  613   2HB   PHE  78           HB1      PHE  78 126.657   1.553   9.242
  614    HD1  PHE  78           HD1      PHE  78 129.556   3.780   8.782
  615    HD2  PHE  78           HD2      PHE  78 127.795   0.723  11.231
  616    HE1  PHE  78           HE1      PHE  78 131.191   4.277  10.579
  617    HE2  PHE  78           HE2      PHE  78 129.431   1.218  13.027
  618    HZ   PHE  78           HZ       PHE  78 131.129   2.994  12.701
  619    H    GLY  79           HN       GLY  79 126.715  -0.665   9.335
  620   1HA   GLY  79           HA2      GLY  79 128.731  -1.931  10.887
  621   2HA   GLY  79           HA1      GLY  79 127.090  -2.535  10.682
  622    H    CYS  80           HN       CYS  80 127.346  -2.800   7.754
  623    HA   CYS  80           HA       CYS  80 128.435  -5.485   7.720
  624   1HB   CYS  80           HB2      CYS  80 126.573  -4.708   6.238
  625   2HB   CYS  80           HB1      CYS  80 127.740  -3.726   5.353
  626    HG   CYS  80           HG       CYS  80 127.389  -6.730   5.058
  627    H    LEU  81           HN       LEU  81 129.562  -2.401   6.259
  628    HA   LEU  81           HA       LEU  81 132.002  -3.585   5.248
  629   1HB   LEU  81           HB2      LEU  81 131.353  -0.684   5.879
  630   2HB   LEU  81           HB1      LEU  81 132.735  -1.239   4.936
  631    HG   LEU  81           HG       LEU  81 129.821  -1.669   4.209
  632   1HD1  LEU  81          HD12      LEU  81 130.646   0.677   3.994
  633   2HD1  LEU  81          HD11      LEU  81 131.928   0.096   2.932
  634   3HD1  LEU  81          HD13      LEU  81 130.241  -0.048   2.438
  635   1HD2  LEU  81          HD23      LEU  81 132.416  -2.625   3.022
  636   2HD2  LEU  81          HD22      LEU  81 130.892  -3.489   3.213
  637   3HD2  LEU  81          HD21      LEU  81 131.061  -2.274   1.950
  638    H    ARG  82           HN       ARG  82 131.115  -1.858   8.210
  639    HA   ARG  82           HA       ARG  82 133.735  -1.603   9.304
  640   1HB   ARG  82           HB2      ARG  82 131.759  -0.442  10.230
  641   2HB   ARG  82           HB1      ARG  82 131.106  -1.991  10.763
  642   1HG   ARG  82           HG2      ARG  82 133.025  -2.334  12.240
  643   2HG   ARG  82           HG1      ARG  82 133.767  -0.842  11.659
  644   1HD   ARG  82           HD2      ARG  82 131.840   0.445  12.518
  645   2HD   ARG  82           HD1      ARG  82 131.114  -1.048  13.114
  646    HE   ARG  82           HE       ARG  82 133.607  -1.030  14.304
  647   1HH1  ARG  82          HH21      ARG  82 130.977   1.182  14.011
  648   2HH1  ARG  82          HH22      ARG  82 131.259   1.928  15.549
  649   1HH2  ARG  82          HH11      ARG  82 133.995  -0.060  16.311
  650   2HH2  ARG  82          HH12      ARG  82 132.972   1.230  16.846
  651    H    GLU  83           HN       GLU  83 131.384  -4.261   9.484
  652    HA   GLU  83           HA       GLU  83 132.942  -5.860  11.303
  653   1HB   GLU  83           HB2      GLU  83 130.682  -6.509   9.407
  654   2HB   GLU  83           HB1      GLU  83 131.432  -7.726  10.443
  655   1HG   GLU  83           HG2      GLU  83 130.343  -5.121  11.527
  656   2HG   GLU  83           HG1      GLU  83 129.358  -6.578  11.401
  657    H    TRP  84           HN       TRP  84 132.768  -5.776   7.720
  658    HA   TRP  84           HA       TRP  84 134.366  -8.108   7.307
  659   1HB   TRP  84           HB2      TRP  84 133.058  -6.963   5.509
  660   2HB   TRP  84           HB1      TRP  84 134.216  -5.632   5.555
  661    HD1  TRP  84           HD1      TRP  84 133.805  -9.220   4.414
  662    HE1  TRP  84           HE1      TRP  84 135.846  -9.908   3.002
  663    HE3  TRP  84           HE3      TRP  84 136.815  -5.166   5.185
  664    HZ2  TRP  84           HZ2      TRP  84 138.419  -8.880   2.296
  665    HZ3  TRP  84           HZ3      TRP  84 139.058  -5.051   4.135
  666    HH2  TRP  84           HH2      TRP  84 139.862  -6.903   2.696
  667    H    CYS  85           HN       CYS  85 135.205  -4.678   7.738
  668    HA   CYS  85           HA       CYS  85 137.997  -4.943   7.257
  669   1HB   CYS  85           HB2      CYS  85 136.418  -3.009   8.963
  670   2HB   CYS  85           HB1      CYS  85 138.162  -2.873   8.740
  671    HG   CYS  85           HG       CYS  85 137.694  -1.782   6.576
  672    H    ASP  86           HN       ASP  86 136.103  -5.347  10.231
  673    HA   ASP  86           HA       ASP  86 138.274  -5.629  12.038
  674   1HB   ASP  86           HB2      ASP  86 135.497  -6.832  12.055
  675   2HB   ASP  86           HB1      ASP  86 136.624  -6.980  13.403
  676    H    ALA  87           HN       ALA  87 136.902  -7.910   9.734
  677    HA   ALA  87           HA       ALA  87 138.423 -10.160  10.923
  678   1HB   ALA  87           HB1      ALA  87 136.099 -10.442   9.984
  679   2HB   ALA  87           HB3      ALA  87 136.778 -10.141   8.383
  680   3HB   ALA  87           HB2      ALA  87 137.297 -11.547   9.310
  681    H    PHE  88           HN       PHE  88 138.518  -8.116   8.024
  682    HA   PHE  88           HA       PHE  88 141.020  -9.529   7.156
  683   1HB   PHE  88           HB2      PHE  88 139.096  -7.812   5.587
  684   2HB   PHE  88           HB1      PHE  88 140.537  -8.583   4.931
  685    HD1  PHE  88           HD2      PHE  88 140.693 -11.091   4.889
  686    HD2  PHE  88           HD1      PHE  88 137.073  -9.037   5.951
  687    HE1  PHE  88           HE2      PHE  88 139.397 -13.170   4.499
  688    HE2  PHE  88           HE1      PHE  88 135.776 -11.117   5.560
  689    HZ   PHE  88           HZ       PHE  88 136.940 -13.178   4.828
  690    H    LEU  89           HN       LEU  89 140.182  -6.745   8.792
  691    HA   LEU  89           HA       LEU  89 142.735  -5.464   8.026
  692   1HB   LEU  89           HB2      LEU  89 141.069  -4.480   6.479
  693   2HB   LEU  89           HB1      LEU  89 140.060  -4.035   7.847
  694    HG   LEU  89           HG       LEU  89 141.958  -2.602   8.699
  695   1HD1  LEU  89          HD12      LEU  89 143.124  -3.428   6.038
  696   2HD1  LEU  89          HD11      LEU  89 143.634  -1.965   6.865
  697   3HD1  LEU  89          HD13      LEU  89 143.887  -3.535   7.623
  698   1HD2  LEU  89          HD21      LEU  89 140.059  -1.696   7.369
  699   2HD2  LEU  89          HD23      LEU  89 141.556  -0.807   7.082
  700   3HD2  LEU  89          HD22      LEU  89 140.989  -1.983   5.895
  701   1H    MET   1           HT3      MET   1 169.372  -5.235  -4.490
  702   2H    MET   1           HT2      MET   1 169.375  -5.080  -6.182
  703   3H    MET   1           HT1      MET   1 167.977  -4.703  -5.294
  704    HA   MET   1           HA       MET   1 167.586  -6.806  -6.257
  705   1HB   MET   1           HB2      MET   1 169.172  -8.634  -6.068
  706   2HB   MET   1           HB1      MET   1 170.017  -7.235  -6.730
  707   1HG   MET   1           HG2      MET   1 170.696  -6.681  -4.330
  708   2HG   MET   1           HG1      MET   1 170.111  -8.286  -3.895
  709   1HE   MET   1           HE2      MET   1 170.821 -10.365  -4.693
  710   2HE   MET   1           HE1      MET   1 170.951 -10.158  -6.438
  711   3HE   MET   1           HE3      MET   1 172.327 -10.775  -5.511
  712    H    THR   2           HN       THR   2 169.153  -6.280  -3.112
  713    HA   THR   2           HA       THR   2 167.204  -8.128  -1.819
  714    HB   THR   2           HB       THR   2 169.549  -6.613  -0.623
  715    HG1  THR   2           HG1      THR   2 170.129  -9.090  -0.652
  716   1HG2  THR   2          HG21      THR   2 167.787  -8.852   0.407
  717   2HG2  THR   2          HG23      THR   2 169.283  -8.336   1.187
  718   3HG2  THR   2          HG22      THR   2 167.923  -7.221   1.063
  719    H    THR   3           HN       THR   3 165.321  -7.206  -1.155
  720    HA   THR   3           HA       THR   3 165.085  -4.305  -0.878
  721    HB   THR   3           HB       THR   3 162.722  -4.788  -0.341
  722    HG1  THR   3           HG1      THR   3 163.024  -7.484  -0.803
  723   1HG2  THR   3          HG22      THR   3 163.673  -4.847  -2.726
  724   2HG2  THR   3          HG21      THR   3 163.586  -6.604  -2.597
  725   3HG2  THR   3          HG23      THR   3 162.116  -5.637  -2.479
  726    H    SER   4           HN       SER   4 164.070  -3.385   1.150
  727    HA   SER   4           HA       SER   4 165.693  -4.067   3.439
  728   1HB   SER   4           HB2      SER   4 164.959  -1.777   3.148
  729   2HB   SER   4           HB1      SER   4 163.269  -2.273   3.131
  730    HG   SER   4           HG       SER   4 163.843  -3.190   5.308
  731    H    GLN   5           HN       GLN   5 164.889  -4.818   5.488
  732    HA   GLN   5           HA       GLN   5 163.290  -7.157   5.330
  733   1HB   GLN   5           HB2      GLN   5 164.123  -5.445   7.686
  734   2HB   GLN   5           HB1      GLN   5 163.281  -6.985   7.860
  735   1HG   GLN   5           HG2      GLN   5 165.081  -8.139   6.665
  736   2HG   GLN   5           HG1      GLN   5 165.911  -6.606   6.399
  737   1HE2  GLN   5          HE22      GLN   5 167.005  -8.489   9.607
  738   2HE2  GLN   5          HE21      GLN   5 166.577  -9.139   8.098
  739    H    LYS   6           HN       LYS   6 162.377  -3.807   5.735
  740    HA   LYS   6           HA       LYS   6 159.870  -4.160   7.038
  741   1HB   LYS   6           HB2      LYS   6 160.745  -2.078   5.020
  742   2HB   LYS   6           HB1      LYS   6 159.305  -1.958   6.028
  743   1HG   LYS   6           HG2      LYS   6 162.098  -2.275   7.160
  744   2HG   LYS   6           HG1      LYS   6 161.340  -0.709   6.895
  745   1HD   LYS   6           HD2      LYS   6 159.388  -1.615   8.331
  746   2HD   LYS   6           HD1      LYS   6 160.506  -2.889   8.816
  747   1HE   LYS   6           HE2      LYS   6 160.854   0.092   9.203
  748   2HE   LYS   6           HE1      LYS   6 160.687  -1.139  10.455
  749   1HZ   LYS   6           HZ2      LYS   6 162.900  -1.120   8.483
  750   2HZ   LYS   6           HZ1      LYS   6 163.012  -0.381  10.009
  751   3HZ   LYS   6           HZ3      LYS   6 162.775  -2.057   9.894
  752    H    HIS   7           HN       HIS   7 160.770  -4.255   3.589
  753    HA   HIS   7           HA       HIS   7 158.125  -4.343   2.565
  754   1HB   HIS   7           HB2      HIS   7 160.005  -4.016   1.065
  755   2HB   HIS   7           HB1      HIS   7 160.679  -5.586   1.501
  756    HD2  HIS   7           HD2      HIS   7 159.620  -7.751   0.081
  757    HE1  HIS   7           HE1      HIS   7 156.593  -5.636  -1.969
  758    HE2  HIS   7           HE2      HIS   7 157.774  -7.870  -1.757
  759    H    ARG   8           HN       ARG   8 160.279  -7.088   3.377
  760    HA   ARG   8           HA       ARG   8 158.287  -9.073   2.825
  761   1HB   ARG   8           HB2      ARG   8 160.847  -9.131   4.443
  762   2HB   ARG   8           HB1      ARG   8 159.870 -10.562   4.107
  763   1HG   ARG   8           HG2      ARG   8 160.139 -10.220   1.705
  764   2HG   ARG   8           HG1      ARG   8 161.045  -8.736   1.988
  765   1HD   ARG   8           HD2      ARG   8 162.641 -10.217   3.388
  766   2HD   ARG   8           HD1      ARG   8 161.870 -11.584   2.589
  767    HE   ARG   8           HE       ARG   8 163.897  -9.894   1.477
  768   1HH1  ARG   8          HH21      ARG   8 160.881 -11.342   0.619
  769   2HH1  ARG   8          HH22      ARG   8 161.116 -11.111  -1.079
  770   1HH2  ARG   8          HH11      ARG   8 164.213  -9.610  -0.724
  771   2HH2  ARG   8          HH12      ARG   8 163.000 -10.143  -1.838
  772    H    ASP   9           HN       ASP   9 159.233  -7.276   5.694
  773    HA   ASP   9           HA       ASP   9 157.699  -8.877   7.553
  774   1HB   ASP   9           HB2      ASP   9 158.809  -6.075   7.721
  775   2HB   ASP   9           HB1      ASP   9 157.969  -6.860   9.054
  776    H    PHE  10           HN       PHE  10 157.038  -5.894   5.725
  777    HA   PHE  10           HA       PHE  10 154.513  -5.387   7.006
  778   1HB   PHE  10           HB2      PHE  10 155.841  -3.714   5.659
  779   2HB   PHE  10           HB1      PHE  10 155.310  -4.560   4.205
  780    HD1  PHE  10           HD1      PHE  10 154.250  -2.481   7.055
  781    HD2  PHE  10           HD2      PHE  10 152.974  -4.504   3.486
  782    HE1  PHE  10           HE1      PHE  10 152.095  -1.253   7.129
  783    HE2  PHE  10           HE2      PHE  10 150.819  -3.275   3.562
  784    HZ   PHE  10           HZ       PHE  10 150.380  -1.652   5.384
  785    H    VAL  11           HN       VAL  11 155.385  -7.193   4.061
  786    HA   VAL  11           HA       VAL  11 152.559  -7.788   3.494
  787    HB   VAL  11           HB       VAL  11 153.443  -9.082   1.617
  788   1HG1  VAL  11          HG13      VAL  11 154.860  -6.443   2.094
  789   2HG1  VAL  11          HG12      VAL  11 154.816  -7.268   0.536
  790   3HG1  VAL  11          HG11      VAL  11 153.321  -6.686   1.267
  791   1HG2  VAL  11          HG23      VAL  11 156.044  -8.683   3.098
  792   2HG2  VAL  11          HG22      VAL  11 155.330 -10.193   2.536
  793   3HG2  VAL  11          HG21      VAL  11 156.018  -9.057   1.375
  794    H    ALA  12           HN       ALA  12 154.192  -8.764   6.001
  795    HA   ALA  12           HA       ALA  12 153.480 -11.676   5.743
  796   1HB   ALA  12           HB3      ALA  12 155.646 -10.328   7.372
  797   2HB   ALA  12           HB2      ALA  12 155.217 -12.034   7.508
  798   3HB   ALA  12           HB1      ALA  12 155.871 -11.407   5.994
  799    H    GLU  13           HN       GLU  13 152.624  -8.785   7.343
  800    HA   GLU  13           HA       GLU  13 150.957 -10.350   9.205
  801   1HB   GLU  13           HB2      GLU  13 151.739  -9.095  11.197
  802   2HB   GLU  13           HB1      GLU  13 153.033 -10.052  10.482
  803   1HG   GLU  13           HG2      GLU  13 153.731  -7.987   9.207
  804   2HG   GLU  13           HG1      GLU  13 152.569  -7.077  10.172
  805    HA   PRO  14           HA       PRO  14 147.862  -7.230   8.466
  806   1HB   PRO  14           HB2      PRO  14 147.818  -6.908  11.460
  807   2HB   PRO  14           HB1      PRO  14 146.460  -7.068  10.327
  808   1HG   PRO  14           HG2      PRO  14 147.278  -9.131  11.808
  809   2HG   PRO  14           HG1      PRO  14 146.703  -9.352  10.145
  810   1HD   PRO  14           HD2      PRO  14 149.478  -9.549  11.203
  811   2HD   PRO  14           HD1      PRO  14 148.765 -10.291   9.754
  812    H    MET  15           HN       MET  15 147.538  -4.869   8.693
  813    HA   MET  15           HA       MET  15 150.106  -3.458   9.123
  814   1HB   MET  15           HB2      MET  15 148.666  -1.491   8.232
  815   2HB   MET  15           HB1      MET  15 149.044  -2.802   7.115
  816   1HG   MET  15           HG2      MET  15 146.885  -3.744   7.292
  817   2HG   MET  15           HG1      MET  15 146.526  -2.864   8.779
  818   1HE   MET  15           HE3      MET  15 147.618  -2.687   5.273
  819   2HE   MET  15           HE2      MET  15 145.920  -2.683   4.815
  820   3HE   MET  15           HE1      MET  15 146.899  -1.243   4.544
  821    H    GLY  16           HN       GLY  16 147.048  -3.929  10.673
  822   1HA   GLY  16           HA2      GLY  16 146.102  -2.988  12.611
  823   2HA   GLY  16           HA1      GLY  16 147.774  -2.901  13.168
  824    H    GLU  17           HN       GLU  17 147.695  -0.880  14.146
  825    HA   GLU  17           HA       GLU  17 146.721   1.441  12.547
  826   1HB   GLU  17           HB2      GLU  17 147.406   1.110  15.478
  827   2HB   GLU  17           HB1      GLU  17 146.919   2.639  14.747
  828   1HG   GLU  17           HG2      GLU  17 144.788   1.647  14.038
  829   2HG   GLU  17           HG1      GLU  17 145.273   0.091  14.714
  830    H    LYS  18           HN       LYS  18 149.383   0.122  12.067
  831    HA   LYS  18           HA       LYS  18 151.477   1.711  13.175
  832   1HB   LYS  18           HB2      LYS  18 151.277   0.197  10.558
  833   2HB   LYS  18           HB1      LYS  18 152.762   0.980  11.096
  834   1HG   LYS  18           HG2      LYS  18 152.867  -0.396  13.067
  835   2HG   LYS  18           HG1      LYS  18 151.251  -1.041  12.769
  836   1HD   LYS  18           HD2      LYS  18 152.043  -2.097  10.693
  837   2HD   LYS  18           HD1      LYS  18 153.656  -1.437  10.965
  838   1HE   LYS  18           HE2      LYS  18 153.587  -2.656  13.231
  839   2HE   LYS  18           HE1      LYS  18 152.200  -3.530  12.581
  840   1HZ   LYS  18           HZ2      LYS  18 153.894  -3.769  10.563
  841   2HZ   LYS  18           HZ1      LYS  18 155.007  -3.690  11.846
  842   3HZ   LYS  18           HZ3      LYS  18 153.812  -4.892  11.835
  843    HA   PRO  19           HA       PRO  19 150.836   5.570  11.076
  844   1HB   PRO  19           HB2      PRO  19 153.387   6.582  10.988
  845   2HB   PRO  19           HB1      PRO  19 152.440   6.472  12.486
  846   1HG   PRO  19           HG2      PRO  19 154.558   4.629  11.458
  847   2HG   PRO  19           HG1      PRO  19 154.314   5.257  13.100
  848   1HD   PRO  19           HD2      PRO  19 153.519   2.757  12.386
  849   2HD   PRO  19           HD1      PRO  19 152.627   3.722  13.583
  850    H    VAL  20           HN       VAL  20 151.268   6.748   9.097
  851    HA   VAL  20           HA       VAL  20 151.391   5.166   6.778
  852    HB   VAL  20           HB       VAL  20 150.430   7.398   6.756
  853   1HG1  VAL  20          HG12      VAL  20 152.220   8.301   8.381
  854   2HG1  VAL  20          HG11      VAL  20 153.220   8.546   6.951
  855   3HG1  VAL  20          HG13      VAL  20 151.679   9.385   7.103
  856   1HG2  VAL  20          HG23      VAL  20 151.583   6.371   4.679
  857   2HG2  VAL  20          HG22      VAL  20 151.235   8.099   4.641
  858   3HG2  VAL  20          HG21      VAL  20 152.872   7.539   4.980
  859    H    GLY  21           HN       GLY  21 154.001   7.154   8.187
  860   1HA   GLY  21           HA2      GLY  21 155.979   6.711   6.259
  861   2HA   GLY  21           HA1      GLY  21 156.329   6.966   7.967
  862    H    SER  22           HN       SER  22 154.420   4.289   7.984
  863    HA   SER  22           HA       SER  22 156.751   2.530   8.288
  864   1HB   SER  22           HB2      SER  22 153.802   1.850   8.470
  865   2HB   SER  22           HB1      SER  22 155.147   0.880   9.064
  866    HG   SER  22           HG       SER  22 155.608   3.047  10.222
  867    H    LEU  23           HN       LEU  23 154.363   3.265   5.866
  868    HA   LEU  23           HA       LEU  23 154.447   0.802   4.413
  869   1HB   LEU  23           HB2      LEU  23 153.959   3.637   3.462
  870   2HB   LEU  23           HB1      LEU  23 153.694   2.205   2.471
  871    HG   LEU  23           HG       LEU  23 152.364   2.685   5.156
  872   1HD1  LEU  23          HD11      LEU  23 151.666   4.359   3.468
  873   2HD1  LEU  23          HD13      LEU  23 151.242   3.054   2.360
  874   3HD1  LEU  23          HD12      LEU  23 150.350   3.255   3.871
  875   1HD2  LEU  23          HD22      LEU  23 152.207   0.521   3.061
  876   2HD2  LEU  23          HD21      LEU  23 152.224   0.373   4.817
  877   3HD2  LEU  23          HD23      LEU  23 150.763   0.909   3.993
  878    H    ALA  24           HN       ALA  24 155.844   0.045   2.894
  879    HA   ALA  24           HA       ALA  24 158.551   0.981   2.920
  880   1HB   ALA  24           HB3      ALA  24 157.906  -1.351   2.382
  881   2HB   ALA  24           HB2      ALA  24 157.189  -0.790   0.871
  882   3HB   ALA  24           HB1      ALA  24 158.928  -0.649   1.127
  883    H    GLY  25           HN       GLY  25 159.604   2.412   1.659
  884   1HA   GLY  25           HA2      GLY  25 160.017   3.614  -0.418
  885   2HA   GLY  25           HA1      GLY  25 158.319   3.418  -0.844
  886    H    ILE  26           HN       ILE  26 157.772   4.209   2.133
  887    HA   ILE  26           HA       ILE  26 157.710   7.140   1.572
  888    HB   ILE  26           HB       ILE  26 156.422   5.567   3.829
  889   1HG1  ILE  26          HG12      ILE  26 155.479   4.818   1.719
  890   2HG1  ILE  26          HG11      ILE  26 154.315   5.883   2.503
  891   1HG2  ILE  26          HG22      ILE  26 156.006   8.388   2.798
  892   2HG2  ILE  26          HG21      ILE  26 155.017   7.611   4.034
  893   3HG2  ILE  26          HG23      ILE  26 156.723   7.934   4.344
  894   1HD1  ILE  26          HD13      ILE  26 155.476   7.762   1.072
  895   2HD1  ILE  26          HD12      ILE  26 156.036   6.408   0.093
  896   3HD1  ILE  26          HD11      ILE  26 154.309   6.685   0.306
  897    H    GLY  27           HN       GLY  27 159.435   8.288   2.393
  898   1HA   GLY  27           HA2      GLY  27 161.007   7.154   4.616
  899   2HA   GLY  27           HA1      GLY  27 161.427   8.582   3.667
  900    H    GLU  28           HN       GLU  28 161.658   8.792   6.375
  901    HA   GLU  28           HA       GLU  28 159.379   9.558   7.841
  902   1HB   GLU  28           HB2      GLU  28 162.236  10.549   8.009
  903   2HB   GLU  28           HB1      GLU  28 160.995  10.976   9.185
  904   1HG   GLU  28           HG2      GLU  28 162.158   9.081  10.083
  905   2HG   GLU  28           HG1      GLU  28 160.603   8.483   9.505
  906    H    VAL  29           HN       VAL  29 161.389  11.547   5.663
  907    HA   VAL  29           HA       VAL  29 159.997  14.002   6.270
  908    HB   VAL  29           HB       VAL  29 161.646  13.150   3.872
  909   1HG1  VAL  29          HG11      VAL  29 160.380  15.808   4.567
  910   2HG1  VAL  29          HG13      VAL  29 161.759  15.675   3.476
  911   3HG1  VAL  29          HG12      VAL  29 160.231  14.897   3.065
  912   1HG2  VAL  29          HG22      VAL  29 162.198  14.806   6.349
  913   2HG2  VAL  29          HG21      VAL  29 162.986  13.305   5.862
  914   3HG2  VAL  29          HG23      VAL  29 163.269  14.787   4.948
  915    H    LEU  30           HN       LEU  30 159.591  11.542   3.747
  916    HA   LEU  30           HA       LEU  30 157.513  12.923   2.332
  917   1HB   LEU  30           HB2      LEU  30 158.191   9.973   2.494
  918   2HB   LEU  30           HB1      LEU  30 157.038  10.662   1.353
  919    HG   LEU  30           HG       LEU  30 159.949  11.493   1.560
  920   1HD1  LEU  30          HD13      LEU  30 159.685   9.155   0.787
  921   2HD1  LEU  30          HD12      LEU  30 158.583   9.707  -0.476
  922   3HD1  LEU  30          HD11      LEU  30 160.275  10.205  -0.503
  923   1HD2  LEU  30          HD21      LEU  30 157.624  12.332  -0.162
  924   2HD2  LEU  30          HD23      LEU  30 158.909  13.315   0.541
  925   3HD2  LEU  30          HD22      LEU  30 159.238  12.322  -0.872
  926    H    GLY  31           HN       GLY  31 157.481  10.612   5.010
  927   1HA   GLY  31           HA2      GLY  31 154.673  10.131   5.053
  928   2HA   GLY  31           HA1      GLY  31 155.728  10.020   6.463
  929    H    LYS  32           HN       LYS  32 156.629  12.736   6.456
  930    HA   LYS  32           HA       LYS  32 154.550  13.969   7.973
  931   1HB   LYS  32           HB2      LYS  32 156.996  14.499   8.158
  932   2HB   LYS  32           HB1      LYS  32 156.878  15.357   6.621
  933   1HG   LYS  32           HG2      LYS  32 155.161  16.849   7.581
  934   2HG   LYS  32           HG1      LYS  32 155.280  15.995   9.119
  935   1HD   LYS  32           HD2      LYS  32 157.671  16.623   9.273
  936   2HD   LYS  32           HD1      LYS  32 157.526  17.511   7.755
  937   1HE   LYS  32           HE2      LYS  32 155.881  18.081  10.238
  938   2HE   LYS  32           HE1      LYS  32 157.316  18.988   9.762
  939   1HZ   LYS  32           HZ2      LYS  32 155.509  18.748   7.589
  940   2HZ   LYS  32           HZ1      LYS  32 154.725  19.429   8.935
  941   3HZ   LYS  32           HZ3      LYS  32 156.130  20.151   8.318
  942    H    LYS  33           HN       LYS  33 155.511  14.397   4.553
  943    HA   LYS  33           HA       LYS  33 153.740  16.623   4.107
  944   1HB   LYS  33           HB2      LYS  33 154.952  14.593   2.214
  945   2HB   LYS  33           HB1      LYS  33 153.994  15.970   1.670
  946   1HG   LYS  33           HG2      LYS  33 155.563  17.510   2.795
  947   2HG   LYS  33           HG1      LYS  33 156.525  16.134   3.335
  948   1HD   LYS  33           HD2      LYS  33 156.935  15.493   0.988
  949   2HD   LYS  33           HD1      LYS  33 155.976  16.870   0.444
  950   1HE   LYS  33           HE2      LYS  33 158.468  17.082   2.160
  951   2HE   LYS  33           HE1      LYS  33 158.431  17.335   0.416
  952   1HZ   LYS  33           HZ3      LYS  33 156.399  18.888   1.415
  953   2HZ   LYS  33           HZ2      LYS  33 157.682  19.110   2.508
  954   3HZ   LYS  33           HZ1      LYS  33 157.904  19.430   0.854
  955    H    LEU  34           HN       LEU  34 153.327  13.102   3.572
  956    HA   LEU  34           HA       LEU  34 150.667  13.324   2.518
  957   1HB   LEU  34           HB2      LEU  34 152.050  11.052   3.973
  958   2HB   LEU  34           HB1      LEU  34 150.454  10.909   3.252
  959    HG   LEU  34           HG       LEU  34 152.913  11.760   1.698
  960   1HD1  LEU  34          HD12      LEU  34 151.645   9.031   2.055
  961   2HD1  LEU  34          HD11      LEU  34 152.784   9.413   0.764
  962   3HD1  LEU  34          HD13      LEU  34 153.298   9.501   2.448
  963   1HD2  LEU  34          HD23      LEU  34 150.047  11.109   0.986
  964   2HD2  LEU  34          HD22      LEU  34 151.044  12.459   0.451
  965   3HD2  LEU  34          HD21      LEU  34 151.328  10.853  -0.198
  966    H    GLU  35           HN       GLU  35 151.945  13.032   5.782
  967    HA   GLU  35           HA       GLU  35 149.470  12.700   7.156
  968   1HB   GLU  35           HB2      GLU  35 151.672  12.431   8.243
  969   2HB   GLU  35           HB1      GLU  35 151.968  14.161   8.079
  970   1HG   GLU  35           HG2      GLU  35 150.005  14.634   9.504
  971   2HG   GLU  35           HG1      GLU  35 149.708  12.902   9.665
  972    H    GLU  36           HN       GLU  36 151.136  15.643   6.076
  973    HA   GLU  36           HA       GLU  36 149.244  17.482   7.250
  974   1HB   GLU  36           HB2      GLU  36 151.174  17.756   4.928
  975   2HB   GLU  36           HB1      GLU  36 150.190  19.089   5.529
  976   1HG   GLU  36           HG2      GLU  36 152.058  17.485   7.290
  977   2HG   GLU  36           HG1      GLU  36 152.528  18.988   6.493
  978    H    ARG  37           HN       ARG  37 149.178  15.399   4.520
  979    HA   ARG  37           HA       ARG  37 147.059  16.947   3.156
  980   1HB   ARG  37           HB2      ARG  37 148.460  14.344   2.506
  981   2HB   ARG  37           HB1      ARG  37 147.155  15.001   1.524
  982   1HG   ARG  37           HG2      ARG  37 149.575  16.675   2.183
  983   2HG   ARG  37           HG1      ARG  37 149.628  15.519   0.857
  984   1HD   ARG  37           HD2      ARG  37 147.506  17.676   1.086
  985   2HD   ARG  37           HD1      ARG  37 148.996  17.871   0.182
  986    HE   ARG  37           HE       ARG  37 147.860  15.493  -0.767
  987   1HH1  ARG  37          HH21      ARG  37 146.988  18.812  -0.430
  988   2HH1  ARG  37          HH22      ARG  37 145.925  18.812  -1.797
  989   1HH2  ARG  37          HH11      ARG  37 146.470  15.469  -2.551
  990   2HH2  ARG  37          HH12      ARG  37 145.630  16.917  -2.998
  991    H    GLY  38           HN       GLY  38 147.060  15.011   5.814
  992   1HA   GLY  38           HA2      GLY  38 144.979  14.433   6.885
  993   2HA   GLY  38           HA1      GLY  38 144.228  14.235   5.309
  994    H    PHE  39           HN       PHE  39 147.266  12.675   5.348
  995    HA   PHE  39           HA       PHE  39 145.901  10.043   5.834
  996   1HB   PHE  39           HB2      PHE  39 148.443  10.695   4.323
  997   2HB   PHE  39           HB1      PHE  39 147.745   9.086   4.498
  998    HD1  PHE  39           HD2      PHE  39 145.669   8.483   3.352
  999    HD2  PHE  39           HD1      PHE  39 147.397  12.374   2.923
 1000    HE1  PHE  39           HE2      PHE  39 144.172   8.932   1.422
 1001    HE2  PHE  39           HE1      PHE  39 145.916  12.834   0.992
 1002    HZ   PHE  39           HZ       PHE  39 144.297  11.110   0.240
 1003    H    ASP  40           HN       ASP  40 146.221  10.587   8.186
 1004    HA   ASP  40           HA       ASP  40 148.950  10.650   9.207
 1005   1HB   ASP  40           HB2      ASP  40 147.902  10.675  11.408
 1006   2HB   ASP  40           HB1      ASP  40 147.061  11.800  10.341
 1007    H    LYS  41           HN       LYS  41 146.949   8.101   8.162
 1008    HA   LYS  41           HA       LYS  41 148.720   6.161   9.587
 1009   1HB   LYS  41           HB2      LYS  41 145.698   5.984   9.448
 1010   2HB   LYS  41           HB1      LYS  41 146.754   4.671   9.978
 1011   1HG   LYS  41           HG2      LYS  41 147.669   6.132  11.754
 1012   2HG   LYS  41           HG1      LYS  41 146.592   7.428  11.236
 1013   1HD   LYS  41           HD2      LYS  41 144.637   5.995  11.729
 1014   2HD   LYS  41           HD1      LYS  41 145.727   4.713  12.259
 1015   1HE   LYS  41           HE2      LYS  41 145.831   7.461  13.497
 1016   2HE   LYS  41           HE1      LYS  41 144.724   6.224  14.090
 1017   1HZ   LYS  41           HZ1      LYS  41 147.665   5.901  13.836
 1018   2HZ   LYS  41           HZ3      LYS  41 146.841   6.221  15.283
 1019   3HZ   LYS  41           HZ2      LYS  41 146.580   4.754  14.465
 1020    H    ALA  42           HN       ALA  42 148.789   4.057   8.553
 1021    HA   ALA  42           HA       ALA  42 149.153   4.275   5.730
 1022   1HB   ALA  42           HB1      ALA  42 149.089   1.919   7.611
 1023   2HB   ALA  42           HB3      ALA  42 149.422   1.739   5.889
 1024   3HB   ALA  42           HB2      ALA  42 150.496   2.708   6.898
 1025    H    TYR  43           HN       TYR  43 146.485   2.689   7.561
 1026    HA   TYR  43           HA       TYR  43 145.311   1.515   5.262
 1027   1HB   TYR  43           HB2      TYR  43 143.282   1.214   6.511
 1028   2HB   TYR  43           HB1      TYR  43 144.647   0.926   7.582
 1029    HD1  TYR  43           HD1      TYR  43 142.187   3.560   6.550
 1030    HD2  TYR  43           HD2      TYR  43 144.834   2.107   9.606
 1031    HE1  TYR  43           HE1      TYR  43 141.279   5.228   8.133
 1032    HE2  TYR  43           HE2      TYR  43 143.917   3.777  11.185
 1033    HH   TYR  43           HH       TYR  43 141.176   5.236  10.941
 1034    H    VAL  44           HN       VAL  44 145.381   4.858   6.132
 1035    HA   VAL  44           HA       VAL  44 143.005   5.527   4.528
 1036    HB   VAL  44           HB       VAL  44 145.241   7.389   5.401
 1037   1HG1  VAL  44          HG12      VAL  44 143.423   8.024   3.615
 1038   2HG1  VAL  44          HG11      VAL  44 142.339   8.109   5.000
 1039   3HG1  VAL  44          HG13      VAL  44 143.761   9.149   4.930
 1040   1HG2  VAL  44          HG22      VAL  44 142.723   6.527   6.853
 1041   2HG2  VAL  44          HG21      VAL  44 144.389   6.326   7.399
 1042   3HG2  VAL  44          HG23      VAL  44 143.680   7.937   7.309
 1043    H    VAL  45           HN       VAL  45 146.442   5.271   4.190
 1044    HA   VAL  45           HA       VAL  45 146.614   6.421   1.512
 1045    HB   VAL  45           HB       VAL  45 148.533   4.631   3.041
 1046   1HG1  VAL  45          HG11      VAL  45 148.853   6.213   0.477
 1047   2HG1  VAL  45          HG13      VAL  45 150.205   5.552   1.395
 1048   3HG1  VAL  45          HG12      VAL  45 149.013   4.469   0.678
 1049   1HG2  VAL  45          HG22      VAL  45 148.294   7.630   2.701
 1050   2HG2  VAL  45          HG21      VAL  45 148.277   6.710   4.205
 1051   3HG2  VAL  45          HG23      VAL  45 149.768   6.851   3.275
 1052    H    LEU  46           HN       LEU  46 146.409   3.144   2.885
 1053    HA   LEU  46           HA       LEU  46 146.672   1.714   0.430
 1054   1HB   LEU  46           HB2      LEU  46 146.726   0.593   2.645
 1055   2HB   LEU  46           HB1      LEU  46 145.024   0.989   2.882
 1056    HG   LEU  46           HG       LEU  46 144.434  -0.351   0.895
 1057   1HD1  LEU  46          HD11      LEU  46 147.417  -0.628   0.704
 1058   2HD1  LEU  46          HD13      LEU  46 146.395  -1.937   0.115
 1059   3HD1  LEU  46          HD12      LEU  46 146.244  -0.327  -0.572
 1060   1HD2  LEU  46          HD23      LEU  46 144.799  -1.324   3.304
 1061   2HD2  LEU  46          HD22      LEU  46 144.545  -2.421   1.949
 1062   3HD2  LEU  46          HD21      LEU  46 146.174  -2.144   2.558
 1063    H    GLY  47           HN       GLY  47 143.937   3.234   2.035
 1064   1HA   GLY  47           HA2      GLY  47 141.818   2.288   0.423
 1065   2HA   GLY  47           HA1      GLY  47 141.828   3.868   1.206
 1066    H    GLN  48           HN       GLN  48 144.017   5.054  -0.130
 1067    HA   GLN  48           HA       GLN  48 142.784   6.005  -2.523
 1068   1HB   GLN  48           HB2      GLN  48 144.575   7.212  -1.272
 1069   2HB   GLN  48           HB1      GLN  48 145.739   6.007  -1.817
 1070   1HG   GLN  48           HG2      GLN  48 145.893   7.932  -3.283
 1071   2HG   GLN  48           HG1      GLN  48 145.158   6.615  -4.192
 1072   1HE2  GLN  48          HE22      GLN  48 142.217   8.435  -4.819
 1073   2HE2  GLN  48          HE21      GLN  48 143.203   7.107  -5.207
 1074    H    PHE  49           HN       PHE  49 145.278   3.528  -2.013
 1075    HA   PHE  49           HA       PHE  49 145.838   2.943  -4.745
 1076   1HB   PHE  49           HB2      PHE  49 147.165   2.126  -2.808
 1077   2HB   PHE  49           HB1      PHE  49 145.825   1.079  -2.356
 1078    HD1  PHE  49           HD1      PHE  49 147.866   1.902  -5.396
 1079    HD2  PHE  49           HD2      PHE  49 145.934  -1.148  -3.067
 1080    HE1  PHE  49           HE1      PHE  49 148.742   0.168  -6.938
 1081    HE2  PHE  49           HE2      PHE  49 146.807  -2.879  -4.609
 1082    HZ   PHE  49           HZ       PHE  49 148.212  -2.222  -6.544
 1083    H    LEU  50           HN       LEU  50 143.376   1.726  -2.527
 1084    HA   LEU  50           HA       LEU  50 142.284  -0.238  -4.345
 1085   1HB   LEU  50           HB2      LEU  50 140.901   1.247  -2.082
 1086   2HB   LEU  50           HB1      LEU  50 140.308  -0.220  -2.858
 1087    HG   LEU  50           HG       LEU  50 142.917   0.038  -1.328
 1088   1HD1  LEU  50          HD12      LEU  50 140.766   0.061   0.010
 1089   2HD1  LEU  50          HD11      LEU  50 140.436  -1.550  -0.619
 1090   3HD1  LEU  50          HD13      LEU  50 141.855  -1.273   0.393
 1091   1HD2  LEU  50          HD22      LEU  50 141.667  -2.195  -2.930
 1092   2HD2  LEU  50          HD21      LEU  50 143.345  -1.650  -2.908
 1093   3HD2  LEU  50          HD23      LEU  50 142.704  -2.570  -1.555
 1094    H    VAL  51           HN       VAL  51 141.585   3.183  -3.785
 1095    HA   VAL  51           HA       VAL  51 139.292   3.326  -5.492
 1096    HB   VAL  51           HB       VAL  51 141.304   5.458  -4.714
 1097   1HG1  VAL  51          HG11      VAL  51 138.642   5.607  -6.149
 1098   2HG1  VAL  51          HG13      VAL  51 139.360   6.995  -5.330
 1099   3HG1  VAL  51          HG12      VAL  51 140.197   6.242  -6.687
 1100   1HG2  VAL  51          HG23      VAL  51 139.961   4.329  -2.892
 1101   2HG2  VAL  51          HG22      VAL  51 139.672   6.063  -3.035
 1102   3HG2  VAL  51          HG21      VAL  51 138.502   4.917  -3.689
 1103    H    LEU  52           HN       LEU  52 142.733   3.300  -6.186
 1104    HA   LEU  52           HA       LEU  52 142.307   4.230  -8.962
 1105   1HB   LEU  52           HB2      LEU  52 144.814   3.289  -7.542
 1106   2HB   LEU  52           HB1      LEU  52 144.758   3.996  -9.156
 1107    HG   LEU  52           HG       LEU  52 143.824   5.387  -6.622
 1108   1HD1  LEU  52          HD12      LEU  52 146.389   5.499  -8.213
 1109   2HD1  LEU  52          HD11      LEU  52 145.880   6.845  -7.195
 1110   3HD1  LEU  52          HD13      LEU  52 146.188   5.264  -6.476
 1111   1HD2  LEU  52          HD23      LEU  52 143.871   6.128  -9.548
 1112   2HD2  LEU  52          HD22      LEU  52 142.616   6.425  -8.344
 1113   3HD2  LEU  52          HD21      LEU  52 144.083   7.393  -8.338
 1114    H    LYS  53           HN       LYS  53 141.462   1.437  -7.706
 1115    HA   LYS  53           HA       LYS  53 141.417  -0.794  -8.469
 1116   1HB   LYS  53           HB2      LYS  53 141.630   0.746 -11.070
 1117   2HB   LYS  53           HB1      LYS  53 141.171  -0.952 -10.948
 1118   1HG   LYS  53           HG2      LYS  53 139.247  -0.333  -9.527
 1119   2HG   LYS  53           HG1      LYS  53 139.707   1.366  -9.657
 1120   1HD   LYS  53           HD2      LYS  53 139.420   1.272 -12.099
 1121   2HD   LYS  53           HD1      LYS  53 138.963  -0.428 -11.986
 1122   1HE   LYS  53           HE2      LYS  53 137.012   0.146 -10.641
 1123   2HE   LYS  53           HE1      LYS  53 137.489   1.843 -10.619
 1124   1HZ   LYS  53           HZ2      LYS  53 137.483   1.220 -13.258
 1125   2HZ   LYS  53           HZ1      LYS  53 136.153   0.344 -12.668
 1126   3HZ   LYS  53           HZ3      LYS  53 136.234   2.022 -12.434
 1127    H    LYS  54           HN       LYS  54 144.049   0.025  -7.711
 1128    HA   LYS  54           HA       LYS  54 146.273  -0.686  -7.883
 1129   1HB   LYS  54           HB2      LYS  54 145.069  -2.790  -9.717
 1130   2HB   LYS  54           HB1      LYS  54 146.677  -2.843  -9.008
 1131   1HG   LYS  54           HG2      LYS  54 145.696  -2.848  -6.752
 1132   2HG   LYS  54           HG1      LYS  54 144.078  -2.784  -7.451
 1133   1HD   LYS  54           HD2      LYS  54 144.486  -4.933  -8.596
 1134   2HD   LYS  54           HD1      LYS  54 146.103  -4.999  -7.895
 1135   1HE   LYS  54           HE2      LYS  54 145.265  -5.276  -5.698
 1136   2HE   LYS  54           HE1      LYS  54 143.648  -4.742  -6.155
 1137   1HZ   LYS  54           HZ3      LYS  54 143.497  -6.732  -7.585
 1138   2HZ   LYS  54           HZ2      LYS  54 144.989  -7.263  -6.971
 1139   3HZ   LYS  54           HZ1      LYS  54 143.648  -7.108  -5.939
 1140    H    ASP  55           HN       ASP  55 144.971   1.157 -10.054
 1141    HA   ASP  55           HA       ASP  55 146.454   0.596 -12.473
 1142   1HB   ASP  55           HB2      ASP  55 144.509   2.074 -12.540
 1143   2HB   ASP  55           HB1      ASP  55 145.295   3.200 -11.436
 1144    H    GLU  56           HN       GLU  56 148.620   0.566 -12.516
 1145    HA   GLU  56           HA       GLU  56 150.323   1.636 -10.515
 1146   1HB   GLU  56           HB2      GLU  56 150.911  -0.243 -11.993
 1147   2HB   GLU  56           HB1      GLU  56 150.976   0.857 -13.367
 1148   1HG   GLU  56           HG2      GLU  56 152.803   2.118 -12.287
 1149   2HG   GLU  56           HG1      GLU  56 152.728   1.036 -10.895
 1150    H    ASP  57           HN       ASP  57 149.535   3.000 -13.735
 1151    HA   ASP  57           HA       ASP  57 151.457   5.143 -13.496
 1152   1HB   ASP  57           HB2      ASP  57 149.016   4.791 -15.249
 1153   2HB   ASP  57           HB1      ASP  57 150.114   6.166 -15.379
 1154    H    LEU  58           HN       LEU  58 148.016   4.903 -12.742
 1155    HA   LEU  58           HA       LEU  58 147.741   7.725 -12.143
 1156   1HB   LEU  58           HB2      LEU  58 146.091   5.355 -11.237
 1157   2HB   LEU  58           HB1      LEU  58 145.644   7.032 -10.953
 1158    HG   LEU  58           HG       LEU  58 146.136   5.831 -13.697
 1159   1HD1  LEU  58          HD12      LEU  58 143.607   6.275 -12.104
 1160   2HD1  LEU  58          HD11      LEU  58 143.590   6.161 -13.863
 1161   3HD1  LEU  58          HD13      LEU  58 144.155   4.799 -12.897
 1162   1HD2  LEU  58          HD22      LEU  58 145.385   8.568 -12.687
 1163   2HD2  LEU  58          HD21      LEU  58 146.452   8.119 -14.016
 1164   3HD2  LEU  58          HD23      LEU  58 144.706   8.024 -14.220
 1165    H    PHE  59           HN       PHE  59 148.498   4.889 -10.145
 1166    HA   PHE  59           HA       PHE  59 148.475   6.303  -7.641
 1167   1HB   PHE  59           HB2      PHE  59 148.419   3.871  -7.683
 1168   2HB   PHE  59           HB1      PHE  59 149.981   3.816  -8.498
 1169    HD1  PHE  59           HD1      PHE  59 148.286   4.879  -5.347
 1170    HD2  PHE  59           HD2      PHE  59 152.010   3.924  -7.267
 1171    HE1  PHE  59           HE1      PHE  59 149.432   4.921  -3.146
 1172    HE2  PHE  59           HE2      PHE  59 153.154   3.969  -5.069
 1173    HZ   PHE  59           HZ       PHE  59 151.867   4.467  -3.008
 1174    H    ARG  60           HN       ARG  60 151.092   5.608  -9.973
 1175    HA   ARG  60           HA       ARG  60 153.194   6.754  -8.449
 1176   1HB   ARG  60           HB2      ARG  60 152.824   6.506 -11.438
 1177   2HB   ARG  60           HB1      ARG  60 154.303   7.125 -10.707
 1178   1HG   ARG  60           HG2      ARG  60 154.567   5.015  -9.452
 1179   2HG   ARG  60           HG1      ARG  60 153.093   4.392 -10.186
 1180   1HD   ARG  60           HD2      ARG  60 154.125   4.673 -12.437
 1181   2HD   ARG  60           HD1      ARG  60 155.608   5.222 -11.665
 1182    HE   ARG  60           HE       ARG  60 155.074   2.733 -10.512
 1183   1HH1  ARG  60          HH21      ARG  60 155.513   4.060 -13.665
 1184   2HH1  ARG  60          HH22      ARG  60 156.147   2.596 -14.339
 1185   1HH2  ARG  60          HH11      ARG  60 155.902   0.810 -11.379
 1186   2HH2  ARG  60          HH12      ARG  60 156.365   0.758 -13.047
 1187    H    GLU  61           HN       GLU  61 151.112   8.349 -10.935
 1188    HA   GLU  61           HA       GLU  61 152.395  10.902 -10.634
 1189   1HB   GLU  61           HB2      GLU  61 149.686  10.057 -11.676
 1190   2HB   GLU  61           HB1      GLU  61 150.149  11.756 -11.593
 1191   1HG   GLU  61           HG2      GLU  61 150.712  11.042 -13.798
 1192   2HG   GLU  61           HG1      GLU  61 152.240  11.106 -12.924
 1193    H    TRP  62           HN       TRP  62 149.627   9.385  -8.981
 1194    HA   TRP  62           HA       TRP  62 148.779  11.704  -7.581
 1195   1HB   TRP  62           HB2      TRP  62 147.354   9.771  -7.571
 1196   2HB   TRP  62           HB1      TRP  62 148.617   8.770  -6.854
 1197    HD1  TRP  62           HD1      TRP  62 146.224  11.647  -5.984
 1198    HE1  TRP  62           HE1      TRP  62 145.998  11.786  -3.416
 1199    HE3  TRP  62           HE3      TRP  62 149.712   8.177  -4.595
 1200    HZ2  TRP  62           HZ2      TRP  62 147.138  10.582  -1.087
 1201    HZ3  TRP  62           HZ3      TRP  62 150.109   7.691  -2.199
 1202    HH2  TRP  62           HH2      TRP  62 148.833   8.890  -0.445
 1203    H    LEU  63           HN       LEU  63 151.064   9.158  -6.535
 1204    HA   LEU  63           HA       LEU  63 151.615  10.418  -4.015
 1205   1HB   LEU  63           HB2      LEU  63 152.047   8.024  -4.448
 1206   2HB   LEU  63           HB1      LEU  63 153.296   8.463  -5.611
 1207    HG   LEU  63           HG       LEU  63 154.560   9.598  -3.814
 1208   1HD1  LEU  63          HD13      LEU  63 152.136   8.833  -2.217
 1209   2HD1  LEU  63          HD12      LEU  63 153.702   8.887  -1.408
 1210   3HD1  LEU  63          HD11      LEU  63 153.065  10.330  -2.192
 1211   1HD2  LEU  63          HD22      LEU  63 153.756   6.731  -3.262
 1212   2HD2  LEU  63          HD21      LEU  63 155.087   7.275  -4.284
 1213   3HD2  LEU  63          HD23      LEU  63 155.156   7.522  -2.539
 1214    H    LYS  64           HN       LYS  64 153.404  10.399  -7.092
 1215    HA   LYS  64           HA       LYS  64 155.539  12.096  -6.198
 1216   1HB   LYS  64           HB2      LYS  64 155.682  10.771  -8.280
 1217   2HB   LYS  64           HB1      LYS  64 154.428  11.778  -9.004
 1218   1HG   LYS  64           HG2      LYS  64 155.875  13.768  -8.749
 1219   2HG   LYS  64           HG1      LYS  64 157.128  12.763  -8.023
 1220   1HD   LYS  64           HD2      LYS  64 157.148  11.392 -10.131
 1221   2HD   LYS  64           HD1      LYS  64 156.039  12.565 -10.844
 1222   1HE   LYS  64           HE2      LYS  64 158.827  13.133  -9.795
 1223   2HE   LYS  64           HE1      LYS  64 158.324  13.133 -11.485
 1224   1HZ   LYS  64           HZ3      LYS  64 156.810  14.949 -10.999
 1225   2HZ   LYS  64           HZ2      LYS  64 157.293  14.947  -9.371
 1226   3HZ   LYS  64           HZ1      LYS  64 158.400  15.372 -10.588
 1227    H    ASP  65           HN       ASP  65 152.522  12.826  -7.915
 1228    HA   ASP  65           HA       ASP  65 152.922  15.673  -7.971
 1229   1HB   ASP  65           HB2      ASP  65 151.315  14.340  -9.420
 1230   2HB   ASP  65           HB1      ASP  65 150.266  14.221  -8.008
 1231    H    THR  66           HN       THR  66 151.505  13.458  -5.631
 1232    HA   THR  66           HA       THR  66 150.323  15.582  -4.036
 1233    HB   THR  66           HB       THR  66 150.837  12.659  -3.417
 1234    HG1  THR  66           HG1      THR  66 148.479  14.073  -4.116
 1235   1HG2  THR  66          HG22      THR  66 149.252  14.775  -1.935
 1236   2HG2  THR  66          HG21      THR  66 149.131  13.045  -1.617
 1237   3HG2  THR  66          HG23      THR  66 150.651  13.888  -1.332
 1238    H    CYS  67           HN       CYS  67 153.413  13.781  -3.918
 1239    HA   CYS  67           HA       CYS  67 154.231  15.615  -1.679
 1240   1HB   CYS  67           HB2      CYS  67 155.447  13.775  -0.656
 1241   2HB   CYS  67           HB1      CYS  67 153.752  13.328  -0.852
 1242    HG   CYS  67           HG       CYS  67 154.570  11.392  -2.151
 1243    H    GLY  68           HN       GLY  68 155.235  13.874  -4.590
 1244   1HA   GLY  68           HA2      GLY  68 156.937  14.909  -6.032
 1245   2HA   GLY  68           HA1      GLY  68 157.754  15.500  -4.586
 1246    H    ALA  69           HN       ALA  69 156.519  12.300  -4.323
 1247    HA   ALA  69           HA       ALA  69 158.962  11.076  -3.711
 1248   1HB   ALA  69           HB3      ALA  69 156.524   9.854  -5.036
 1249   2HB   ALA  69           HB2      ALA  69 157.835   8.929  -4.307
 1250   3HB   ALA  69           HB1      ALA  69 156.823   9.966  -3.301
 1251    H    ASN  70           HN       ASN  70 160.423   9.736  -4.972
 1252    HA   ASN  70           HA       ASN  70 160.695  10.675  -7.762
 1253   1HB   ASN  70           HB2      ASN  70 162.466   9.017  -5.944
 1254   2HB   ASN  70           HB1      ASN  70 162.875   9.421  -7.612
 1255   1HD2  ASN  70          HD22      ASN  70 164.303  12.019  -5.265
 1256   2HD2  ASN  70          HD21      ASN  70 164.423  10.327  -5.323
 1257    H    ALA  71           HN       ALA  71 161.483   8.893  -9.335
 1258    HA   ALA  71           HA       ALA  71 159.391   7.024  -9.768
 1259   1HB   ALA  71           HB1      ALA  71 160.999   7.902 -11.499
 1260   2HB   ALA  71           HB3      ALA  71 162.215   6.810 -10.834
 1261   3HB   ALA  71           HB2      ALA  71 160.746   6.157 -11.561
 1262    H    LYS  72           HN       LYS  72 162.536   6.616  -8.146
 1263    HA   LYS  72           HA       LYS  72 162.329   3.743  -7.968
 1264   1HB   LYS  72           HB2      LYS  72 164.470   5.014  -7.750
 1265   2HB   LYS  72           HB1      LYS  72 163.903   5.637  -6.202
 1266   1HG   LYS  72           HG2      LYS  72 163.729   3.338  -5.329
 1267   2HG   LYS  72           HG1      LYS  72 164.294   2.705  -6.876
 1268   1HD   LYS  72           HD2      LYS  72 166.410   3.948  -6.616
 1269   2HD   LYS  72           HD1      LYS  72 165.851   4.578  -5.067
 1270   1HE   LYS  72           HE2      LYS  72 165.700   2.278  -4.183
 1271   2HE   LYS  72           HE1      LYS  72 166.254   1.647  -5.735
 1272   1HZ   LYS  72           HZ1      LYS  72 167.944   3.706  -4.651
 1273   2HZ   LYS  72           HZ3      LYS  72 167.857   2.327  -3.669
 1274   3HZ   LYS  72           HZ2      LYS  72 168.355   2.185  -5.287
 1275    H    GLN  73           HN       GLN  73 161.483   6.385  -5.773
 1276    HA   GLN  73           HA       GLN  73 160.727   4.705  -3.580
 1277   1HB   GLN  73           HB2      GLN  73 159.929   7.537  -4.309
 1278   2HB   GLN  73           HB1      GLN  73 159.537   6.763  -2.772
 1279   1HG   GLN  73           HG2      GLN  73 161.882   6.481  -2.242
 1280   2HG   GLN  73           HG1      GLN  73 162.358   7.049  -3.842
 1281   1HE2  GLN  73          HE22      GLN  73 162.694   9.971  -1.590
 1282   2HE2  GLN  73          HE21      GLN  73 163.461   8.469  -1.782
 1283    H    SER  74           HN       SER  74 158.895   6.028  -6.326
 1284    HA   SER  74           HA       SER  74 156.329   5.232  -5.339
 1285   1HB   SER  74           HB2      SER  74 155.513   5.876  -7.435
 1286   2HB   SER  74           HB1      SER  74 156.984   6.835  -7.307
 1287    HG   SER  74           HG       SER  74 157.712   5.794  -8.969
 1288    H    ARG  75           HN       ARG  75 158.764   3.555  -7.357
 1289    HA   ARG  75           HA       ARG  75 157.111   1.348  -8.070
 1290   1HB   ARG  75           HB2      ARG  75 160.105   1.584  -7.721
 1291   2HB   ARG  75           HB1      ARG  75 159.327   0.099  -8.271
 1292   1HG   ARG  75           HG2      ARG  75 158.312   1.329 -10.157
 1293   2HG   ARG  75           HG1      ARG  75 159.095   2.812  -9.609
 1294   1HD   ARG  75           HD2      ARG  75 160.525   0.270 -10.440
 1295   2HD   ARG  75           HD1      ARG  75 160.406   1.742 -11.406
 1296    HE   ARG  75           HE       ARG  75 161.510   2.623  -9.041
 1297   1HH1  ARG  75          HH21      ARG  75 162.189   0.102 -11.289
 1298   2HH1  ARG  75          HH22      ARG  75 163.901   0.146 -11.024
 1299   1HH2  ARG  75          HH11      ARG  75 163.739   2.701  -8.684
 1300   2HH2  ARG  75          HH12      ARG  75 164.778   1.619  -9.550
 1301    H    ASP  76           HN       ASP  76 159.116   1.902  -5.162
 1302    HA   ASP  76           HA       ASP  76 158.792  -0.738  -4.128
 1303   1HB   ASP  76           HB2      ASP  76 159.369   1.910  -2.785
 1304   2HB   ASP  76           HB1      ASP  76 159.390   0.368  -1.929
 1305    H    CYS  77           HN       CYS  77 156.854   2.227  -3.659
 1306    HA   CYS  77           HA       CYS  77 155.140   1.045  -1.670
 1307   1HB   CYS  77           HB2      CYS  77 154.817   3.409  -3.527
 1308   2HB   CYS  77           HB1      CYS  77 153.590   2.952  -2.345
 1309    HG   CYS  77           HG       CYS  77 155.214   3.514  -0.435
 1310    H    PHE  78           HN       PHE  78 154.929   1.302  -5.235
 1311    HA   PHE  78           HA       PHE  78 152.278   0.325  -5.465
 1312   1HB   PHE  78           HB2      PHE  78 153.453   1.250  -7.386
 1313   2HB   PHE  78           HB1      PHE  78 154.643  -0.050  -7.326
 1314    HD1  PHE  78           HD1      PHE  78 151.163   0.833  -8.156
 1315    HD2  PHE  78           HD2      PHE  78 154.081  -2.317  -8.026
 1316    HE1  PHE  78           HE1      PHE  78 149.696  -0.584  -9.566
 1317    HE2  PHE  78           HE2      PHE  78 152.613  -3.734  -9.437
 1318    HZ   PHE  78           HZ       PHE  78 150.421  -2.868 -10.206
 1319    H    GLY  79           HN       GLY  79 155.288  -1.587  -5.856
 1320   1HA   GLY  79           HA2      GLY  79 153.978  -4.110  -5.832
 1321   2HA   GLY  79           HA1      GLY  79 155.685  -3.858  -5.483
 1322    H    CYS  80           HN       CYS  80 155.151  -2.092  -3.178
 1323    HA   CYS  80           HA       CYS  80 154.950  -4.164  -1.163
 1324   1HB   CYS  80           HB2      CYS  80 156.272  -2.057  -0.879
 1325   2HB   CYS  80           HB1      CYS  80 154.754  -1.166  -0.771
 1326    HG   CYS  80           HG       CYS  80 155.977  -2.828   1.460
 1327    H    LEU  81           HN       LEU  81 152.747  -1.484  -2.098
 1328    HA   LEU  81           HA       LEU  81 150.684  -2.318  -0.247
 1329   1HB   LEU  81           HB2      LEU  81 150.483  -0.649  -2.776
 1330   2HB   LEU  81           HB1      LEU  81 149.229  -0.790  -1.547
 1331    HG   LEU  81           HG       LEU  81 152.015   0.326  -1.102
 1332   1HD1  LEU  81          HD12      LEU  81 150.488   1.761  -2.456
 1333   2HD1  LEU  81          HD11      LEU  81 149.320   1.712  -1.137
 1334   3HD1  LEU  81          HD13      LEU  81 150.889   2.480  -0.895
 1335   1HD2  LEU  81          HD23      LEU  81 149.709  -0.284   0.733
 1336   2HD2  LEU  81          HD22      LEU  81 151.435  -0.513   1.000
 1337   3HD2  LEU  81          HD21      LEU  81 150.740   1.101   1.086
 1338    H    ARG  82           HN       ARG  82 151.367  -2.954  -3.664
 1339    HA   ARG  82           HA       ARG  82 148.956  -4.346  -4.279
 1340   1HB   ARG  82           HB2      ARG  82 150.574  -3.613  -5.995
 1341   2HB   ARG  82           HB1      ARG  82 151.740  -4.792  -5.395
 1342   1HG   ARG  82           HG2      ARG  82 150.225  -6.628  -5.962
 1343   2HG   ARG  82           HG1      ARG  82 148.993  -5.479  -6.482
 1344   1HD   ARG  82           HD2      ARG  82 150.521  -4.634  -8.228
 1345   2HD   ARG  82           HD1      ARG  82 151.744  -5.799  -7.716
 1346    HE   ARG  82           HE       ARG  82 149.546  -7.381  -8.255
 1347   1HH1  ARG  82          HH21      ARG  82 151.300  -4.917  -9.914
 1348   2HH1  ARG  82          HH22      ARG  82 150.984  -5.567 -11.488
 1349   1HH2  ARG  82          HH11      ARG  82 149.129  -8.244 -10.304
 1350   2HH2  ARG  82          HH12      ARG  82 149.758  -7.447 -11.708
 1351    H    GLU  83           HN       GLU  83 152.016  -5.489  -2.883
 1352    HA   GLU  83           HA       GLU  83 151.277  -8.272  -2.875
 1353   1HB   GLU  83           HB2      GLU  83 153.363  -6.689  -1.369
 1354   2HB   GLU  83           HB1      GLU  83 153.168  -8.431  -1.173
 1355   1HG   GLU  83           HG2      GLU  83 153.521  -7.134  -3.882
 1356   2HG   GLU  83           HG1      GLU  83 154.887  -7.698  -2.916
 1357    H    TRP  84           HN       TRP  84 150.958  -5.692  -0.401
 1358    HA   TRP  84           HA       TRP  84 150.121  -7.429   1.706
 1359   1HB   TRP  84           HB2      TRP  84 150.774  -5.038   2.033
 1360   2HB   TRP  84           HB1      TRP  84 149.278  -4.552   1.235
 1361    HD1  TRP  84           HD1      TRP  84 150.631  -5.991   4.467
 1362    HE1  TRP  84           HE1      TRP  84 148.741  -6.100   6.214
 1363    HE3  TRP  84           HE3      TRP  84 146.637  -4.796   1.516
 1364    HZ2  TRP  84           HZ2      TRP  84 145.906  -5.736   6.343
 1365    HZ3  TRP  84           HZ3      TRP  84 144.355  -4.691   2.476
 1366    HH2  TRP  84           HH2      TRP  84 143.987  -5.167   4.881
 1367    H    CYS  85           HN       CYS  85 148.323  -5.737  -0.851
 1368    HA   CYS  85           HA       CYS  85 145.712  -6.438   0.038
 1369   1HB   CYS  85           HB2      CYS  85 146.816  -5.858  -2.716
 1370   2HB   CYS  85           HB1      CYS  85 145.102  -6.153  -2.422
 1371    HG   CYS  85           HG       CYS  85 144.935  -3.799  -1.696
 1372    H    ASP  86           HN       ASP  86 148.000  -8.167  -2.052
 1373    HA   ASP  86           HA       ASP  86 146.273 -10.267  -2.868
 1374   1HB   ASP  86           HB2      ASP  86 149.266 -10.214  -2.412
 1375   2HB   ASP  86           HB1      ASP  86 148.419 -11.588  -3.124
 1376    H    ALA  87           HN       ALA  87 147.978  -9.750   0.167
 1377    HA   ALA  87           HA       ALA  87 147.393 -12.514   1.066
 1378   1HB   ALA  87           HB1      ALA  87 149.552 -11.344   1.625
 1379   2HB   ALA  87           HB3      ALA  87 148.622 -10.243   2.645
 1380   3HB   ALA  87           HB2      ALA  87 148.678 -11.964   3.027
 1381    H    PHE  88           HN       PHE  88 146.302  -9.207   1.741
 1382    HA   PHE  88           HA       PHE  88 144.272 -10.310   3.659
 1383   1HB   PHE  88           HB2      PHE  88 145.353  -7.510   3.344
 1384   2HB   PHE  88           HB1      PHE  88 144.151  -8.007   4.531
 1385    HD1  PHE  88           HD2      PHE  88 144.773  -9.672   6.306
 1386    HD2  PHE  88           HD1      PHE  88 147.685  -7.939   3.666
 1387    HE1  PHE  88           HE2      PHE  88 146.587 -10.364   7.849
 1388    HE2  PHE  88           HE1      PHE  88 149.501  -8.631   5.211
 1389    HZ   PHE  88           HZ       PHE  88 148.947  -9.838   7.303
 1390    H    LEU  89           HN       LEU  89 144.409  -9.354   0.467
 1391    HA   LEU  89           HA       LEU  89 141.510  -8.776   0.462
 1392   1HB   LEU  89           HB2      LEU  89 142.575  -6.548   0.670
 1393   2HB   LEU  89           HB1      LEU  89 143.562  -6.888  -0.746
 1394    HG   LEU  89           HG       LEU  89 141.433  -7.126  -2.087
 1395   1HD1  LEU  89          HD12      LEU  89 140.261  -6.197   0.541
 1396   2HD1  LEU  89          HD11      LEU  89 139.429  -5.955  -0.991
 1397   3HD1  LEU  89          HD13      LEU  89 139.770  -7.587  -0.426
 1398   1HD2  LEU  89          HD21      LEU  89 142.778  -5.032  -2.013
 1399   2HD2  LEU  89          HD23      LEU  89 141.056  -4.709  -2.227
 1400   3HD2  LEU  89          HD22      LEU  89 141.804  -4.486  -0.644
   
  No H/Q in entry =        1400