*HEADER    HORMONE                                 23-JUL-08   2K6T              
*TITLE     SOLUTION STRUCTURE OF THE RELAXIN-LIKE FACTOR                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN-LIKE 3 A CHAIN;                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 106-131;                                      
*COMPND   5 SYNONYM: LEYDIG INSULIN-LIKE PEPTIDE, LEY-I-L, RELAXIN-              
*COMPND   6 LIKE FACTOR, RLF;                                                    
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MOL_ID: 2;                                                           
*COMPND   9 MOLECULE: INSULIN-LIKE 3 B CHAIN;                                    
*COMPND  10 CHAIN: B;                                                            
*COMPND  11 FRAGMENT: UNP RESIDUES 25-55;                                        
*COMPND  12 SYNONYM: LEYDIG INSULIN-LIKE PEPTIDE, LEY-I-L, RELAXIN-              
*COMPND  13 LIKE FACTOR, RLF;                                                    
*COMPND  14 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HUMANS.;            
*SOURCE   4 MOL_ID: 2;                                                           
*SOURCE   5 SYNTHETIC: YES;                                                      
*SOURCE   6 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HUMANS.             
*KEYWDS    PROTEIN, CLEAVAGE ON PAIR OF BASIC RESIDUES, DISEASE                  
*KEYWDS   2 MUTATION, HORMONE, POLYMORPHISM, SECRETED                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    E.E.BULLESBACH, M.A.S.HASS, M.R.JENSEN, D.F.HANSEN,                   
*AUTHOR   2 S.M.KRISTENSEN, C.SCHWABE, J.J.LED                                   
*REVDAT   2   30-DEC-08 2K6T    1       FIXED FORMAT                                     
*REVDAT   1   16-DEC-08 2K6T    0                                                

assign (residue 114 and name HN) (residue 110 and name O) 1.80 0.00 0.50
assign (residue 114 and name N)  (residue 110 and name O) 2.80 0.00 0.50

assign (residue 117 and name HN) (residue 113 and name O) 1.80 0.00 0.50
assign (residue 117 and name N)  (residue 113 and name O) 2.80 0.00 0.50

assign (residue 126 and name HN) (residue 123 and name O) 1.80 0.00 0.50
assign (residue 127 and name N)  (residue 123 and name O) 2.80 0.00 0.50

assign (residue 127 and name HN) (residue 123 and name O) 1.80 0.00 0.50
assign (residue 127 and name N)  (residue 123 and name O) 2.80 0.00 0.50

assign (residue 128 and name HN) (residue 124 and name O) 1.80 0.00 0.50
assign (residue 128 and name N)  (residue 124 and name O) 2.80 0.00 0.50

assign (residue 129 and name HN) (residue 125 and name O) 1.80 0.00 0.50
assign (residue 129 and name N)  (residue 125 and name O) 2.80 0.00 0.50

assign (residue 40 and name HN) (residue 36 and name O) 1.80 0.00 0.50
assign (residue 40 and name N)  (residue 36 and name O) 2.80 0.00 0.50

assign (residue 41 and name HN) (residue 37 and name O) 1.80 0.00 0.50
assign (residue 41 and name N)  (residue 37 and name O) 2.80 0.00 0.50

assign (residue 42 and name HN) (residue 38 and name O) 1.80 0.00 0.50
assign (residue 42 and name N)  (residue 38 and name O) 2.80 0.00 0.50

assign (residue 43 and name HN) (residue 39 and name O) 1.80 0.00 0.50
assign (residue 43 and name N)  (residue 39 and name O) 2.80 0.00 0.50

assign (residue 44 and name HN) (residue 40 and name O) 1.80 0.00 0.50
assign (residue 44 and name N)  (residue 40 and name O) 2.80 0.00 0.50

assign (residue 45 and name HN) (residue 41 and name O) 1.80 0.00 0.50
assign (residue 45 and name N)  (residue 41 and name O) 2.80 0.00 0.50

assign (residue 46 and name HN) (residue 42 and name O) 1.80 0.00 0.50
assign (residue 46 and name N)  (residue 42 and name O) 2.80 0.00 0.50
!J coupling data

assign (resid 107 and name C  ) ( resi 108 and name N  )
       (resi 108 and name CA )    ( resi 108 and name C )     9.63  3.20
assign (resid 108 and name C  ) ( resi 109 and name N  )
       (resi 109 and name CA )    ( resi 109 and name C )     6.52  1.58
assign (resid 109 and name C  ) ( resi 110 and name N  )
       (resi 110 and name CA )    ( resi 110 and name C )     7.13  0.64
assign (resid 112 and name C  ) ( resi 113 and name N  )
       (resi 113 and name CA )    ( resi 113 and name C )     6.81  0.52
assign (resid 116 and name C  ) ( resi 117 and name N  )
       (resi 117 and name CA )    ( resi 117 and name C )     6.80  1.66
assign (resid 117 and name C  ) ( resi 118 and name N  )
       (resi 118 and name CA )    ( resi 118 and name C )     9.33  1.14
assign (resid 127 and name C  ) ( resi 128 and name N  )
       (resi 128 and name CA )    ( resi 128 and name C )     8.35  1.88


assign (resid 25 and name C  ) ( resi 26 and name N  )
       (resi 26 and name CA )    ( resi 26 and name C )     6.00  1.32
assign (resid 27 and name C  ) ( resi 28 and name N  )
       (resi 28 and name CA )    ( resi 28 and name C )     7.21  0.64
assign (resid 28 and name C  ) ( resi 29 and name N  )
       (resi 29 and name CA )    ( resi 29 and name C )     6.91  0.78
assign (resid 29 and name C  ) ( resi 30 and name N  )
       (resi 30 and name CA )    ( resi 30 and name C )     6.31  1.08
assign (resid 32 and name C  ) ( resi 33 and name N  )
       (resi 33 and name CA )    ( resi 33 and name C )     9.79  1.06
assign (resid 33 and name C  ) ( resi 34 and name N  )
       (resi 34 and name CA )    ( resi 34 and name C )     8.71  2.10
assign (resid 38 and name C  ) ( resi 39 and name N  )
       (resi 39 and name CA )    ( resi 39 and name C )     5.56  1.44
assign (resid 44 and name C  ) ( resi 45 and name N  )
       (resi 45 and name CA )    ( resi 45 and name C )     5.27  1.10
assign (resid 49 and name C  ) ( resi 50 and name N  )
       (resi 50 and name CA )    ( resi 50 and name C )     6.60  1.08
assign (resid 50 and name C  ) ( resi 51 and name N  )
       (resi 51 and name CA )    ( resi 51 and name C )     6.63  1.24
assign (resid 52 and name C  ) ( resi 53 and name N  )
       (resi 53 and name CA )    ( resi 53 and name C )     6.87  3.20
assign (resid 53 and name C  ) ( resi 54 and name N  )
       (resi 54 and name CA )    ( resi 54 and name C )     7.12  0.54
assign (resid 54 and name C  ) ( resi 55 and name N  )
       (resi 55 and name CA )    ( resi 55 and name C )     6.41  0.38


!restraints dihedral 


assign(resid 112 and name C) (resid 113 and name N)
      (resid 113 and name CA) (resid 113 and name C)     0     -64.61  40  2

assign(resid 113 and name C) (resid 114 and name N)
      (resid 114 and name CA) (resid 114 and name C)     0     -71.22  40  2

assign(resid 114 and name C) (resid 115 and name N)
      (resid 115 and name CA) (resid 115 and name C)     0     -61.27  40  2

assign(resid 115 and name C) (resid 116 and name N)
      (resid 116 and name CA) (resid 116 and name C)     0     -68.36  40  2

assign(resid 116 and name C) (resid 117 and name N)
      (resid 117 and name CA) (resid 117 and name C)     0     -63.42  40  2

assign(resid 122 and name C) (resid 123 and name N)
      (resid 123 and name CA) (resid 123 and name C)     0     -63.27  40  2

assign(resid 123 and name C) (resid 124 and name N)
      (resid 124 and name CA) (resid 124 and name C)     0     -66.41  40  2

assign(resid 124 and name C) (resid 125 and name N)
      (resid 125 and name CA) (resid 125 and name C)     0     -61.88  40  2
 
assign(resid 125 and name C) (resid 126 and name N)
      (resid 126 and name CA) (resid 126 and name C)     0     -64.41  40  2

assign(resid 126 and name C) (resid 127 and name N)
      (resid 127 and name CA) (resid 127 and name C)     0     -65.83  40  2

assign(resid 127 and name C) (resid 128 and name N)
      (resid 128 and name CA) (resid 128 and name C)     0     -89.85  40  2

assign(resid 128 and name C) (resid 129 and name N)
      (resid 129 and name CA) (resid 129 and name C)     0     -65  40  2

assign(resid 36 and name C) (resid 37 and name N)
      (resid 37 and name CA) (resid 37 and name C)     0     -63.34  40  2

assign(resid 37 and name C) (resid 38 and name N)
      (resid 38 and name CA) (resid 38 and name C)     0     -63.85  40  2

assign(resid 38 and name C) (resid 39 and name N)
      (resid 39 and name CA) (resid 39 and name C)     0     -64.12  40  2

assign(resid 39 and name C) (resid 40 and name N)
      (resid 40 and name CA) (resid 40 and name C)     0     -61.64  40  2

assign(resid 40 and name C) (resid 41 and name N)
      (resid 41 and name CA) (resid 41 and name C)     0     -62.12  40  2

assign(resid 41 and name C) (resid 42 and name N)
      (resid 42 and name CA) (resid 42 and name C)     0     -62.55  40  2

assign(resid 42 and name C) (resid 43 and name N)
      (resid 43 and name CA) (resid 43 and name C)     0     -63.67  40  2

assign(resid 43 and name C) (resid 44 and name N)
      (resid 44 and name CA) (resid 44 and name C)     0     -66.28  40  2

assign(resid 44 and name C) (resid 45 and name N)
      (resid 45 and name CA) (resid 45 and name C)     0     -65.37  40  2

assign(resid 45 and name C) (resid 46 and name N)
      (resid 46 and name CA) (resid 46 and name C)     0     -65.37  40  2



assign(resid 112 and name N) (resid 112 and name CA)
      (resid 112 and name C) (resid 113 and name N)     0     -40.54  40  2

assign(resid 113 and name N) (resid 113 and name CA)
      (resid 113 and name C) (resid 114 and name N)     0     -33.85  40  2

assign(resid 114 and name N) (resid 114 and name CA)
      (resid 114 and name C) (resid 115 and name N)     0     -40.22  40  2

assign(resid 115 and name N) (resid 115 and name CA)
      (resid 115 and name C) (resid 116 and name N)     0     -44.89  40  2

assign(resid 116 and name N) (resid 116 and name CA)
      (resid 116 and name C) (resid 117 and name N)     0     -38.34  40  2

assign(resid 122 and name N) (resid 122 and name CA)
      (resid 122 and name C) (resid 123 and name N)     0     -35.87  40  2

assign(resid 123 and name N) (resid 123 and name CA)
      (resid 123 and name C) (resid 124 and name N)     0     -42.83  40  2

assign(resid 124 and name N) (resid 124 and name CA)
      (resid 124 and name C) (resid 125 and name N)     0     -41.10  40  2

assign(resid 125 and name N) (resid 125 and name CA)
      (resid 125 and name C) (resid 126 and name N)     0     -40.35  40  2

assign(resid 126 and name N) (resid 126 and name CA)
      (resid 126 and name C) (resid 127 and name N)     0     -31.73  40  2

assign(resid 36 and name N) (resid 36 and name CA)
      (resid 36 and name C) (resid 37 and name N)     0     -39.50  40  2

assign(resid 37 and name N) (resid 37 and name CA)
      (resid 37 and name C) (resid 38 and name N)     0     -42.49  40  2

assign(resid 38 and name N) (resid 38 and name CA)
      (resid 38 and name C) (resid 39 and name N)     0     -42.20  40  2

assign(resid 39 and name N) (resid 39 and name CA)
      (resid 39 and name C) (resid 40 and name N)     0     -44.14  40  2

assign(resid 40 and name N) (resid 40 and name CA)
      (resid 40 and name C) (resid 41 and name N)     0     -38.85  40  2

assign(resid 41 and name N) (resid 41 and name CA)
      (resid 41 and name C) (resid 42 and name N)     0     -42.64  40  2

assign(resid 42 and name N) (resid 42 and name CA)
      (resid 42 and name C) (resid 43 and name N)     0     -41.56  40  2

assign(resid 43 and name N) (resid 43 and name CA)
      (resid 43 and name C) (resid 44 and name N)     0     -41.37  40  2

assign(resid 44 and name N) (resid 44 and name CA)
      (resid 44 and name C) (resid 45 and name N)     0     -40.46  40  2


assign(resid 125 and name N) (resid 125 and name CA)
      (resid 125 and name CB) (resid 125 and name CG)     0     -60  40  2

assign(resid 126 and name N) (resid 126 and name CA)
      (resid 126 and name CB) (resid 126 and name CG)     0     -60  40  2

assign(resid 128 and name N) (resid 128 and name CA)
      (resid 128 and name CB) (resid 128 and name CG)     0     -60  40  2

assign(resid 31 and name N) (resid 31 and name CA)
      (resid 31 and name CB) (resid 31 and name CG)     0      60  40  2

assign(resid 32 and name N) (resid 32 and name CA)
      (resid 32 and name CB) (resid 32 and name CG)     0      -60  40  2

assign(resid 33 and name N) (resid 33 and name CA)
      (resid 33 and name CB) (resid 33 and name CG)     0      -60  40  2

assign(resid 37 and name N) (resid 37 and name CA)
      (resid 37 and name CB) (resid 37 and name CG)     0      -60  40  2

assign(resid 40 and name N) (resid 40 and name CA)
      (resid 40 and name CB) (resid 40 and name CG)     0      -60  40  2

assign(resid 44 and name N) (resid 44 and name CA)
      (resid 44 and name CB) (resid 44 and name CG)     0      -60  40  2

assign(resid 39 and name N) (resid 39 and name CA)
      (resid 39 and name CB) (resid 39 and name CG1)     0     180.00  40  2

assign(resid 43 and name N) (resid 43 and name CA)
      (resid 43 and name CB) (resid 43 and name CG1)     0     180.00  40  2

assign(resid 45 and name N) (resid 45 and name CA)
      (resid 45 and name CB) (resid 45 and name CG1)     0     180.00  40  2


end#
# List of assignments
#
# Created by Aria 2.0a, Tue Apr  8 22:46:44 2008
#
# Author:  erika
# Date:    
# Project: rlf
# Run:     080408a
# Path:    /kl5/erika/rlf_aria/rlf/data/run080408a
#
# Abbreviations:
#
# Restraint:
#
# ref_spec: Spectrum name
# ref_no:   Reference peak number (as in spectrum)
# id:       Internal ARIA restraint-id (unique over all spectra)
# d:        Average distance found in ensemble [A].
# u:        Upper bound [A]
# u_viol:   Average upper-bound violation [A]
# %_viol:   Percentage of structures in which restraint was violated.
# viol:     yes/no. According to violation analysis, the restraint has (not) been violated.
# a_type:   Assignment type. Valid types are:
#           M (manual):         Restraint stems from existing (complete) cross-peak assignment.
#           S (semi-automatic): Reference cross-peak is only partially assigned. ARIA has
#                               completed the assignment.
#           A (automatic):      Reference cross-peak has not been assigned. ARIA has generated
#                               a list of probable assignments.
#
# reliable: yes(no): Reference peak is (not) marked as 'reliable'. Reliable crosspeaks always
#           enter structure calculation.
#
# Contributions: residue1 atom1  -  residue2 atom2
#
# d:        Average distance found in the structure ensemble [A] +/- standard deviation.
#           If standard-deviation could not be calculated (e.g. if there is only 1 distance),
#           it is set to 'N/A'.
# weight:   The weight which is assigned to every contribution by the 'Partial Assignment'
#           step. The sum of weights over all contributions in a restraint is always greater
#           or equal to the parameter 'weight_threshold' which is defined in the section
#            in the project's xml file.
#

ref_spec: d2o-noesy, ref_peak: 1, id: 570, d: 2.16, u: 3.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA3 -   LYS32   HA    d: 2.23 +/- 0.16, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 2, id: 571, d: 4.83, u: 5.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR26 HG21 -   PRO27  HD2    d: 4.75 +/- 0.50, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 3, id: 572, d: 2.68, u: 3.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HB2 -   PRO27   HA    d: 2.67 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 4, id: 573, d: 3.78, u: 4.58, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HB2 -   PRO27  HD2    d: 3.78 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 5, id: 574, d: 4.09, u: 5.72, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HB2 -   PRO27  HD3    d: 4.10 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 6, id: 575, d: 3.92, u: 3.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HB3 -   PRO27  HD2    d: 3.92 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 7, id: 576, d: 3.46, u: 4.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HB3 -   PRO27  HD3    d: 3.46 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 8, id: 577, d: 2.76, u: 2.96, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HD2 -   THR26   HA    d: 2.81 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 9, id: 578, d: 3.29, u: 4.81, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HD2 -   THR26   HB    d: 3.59 +/- 0.62, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 10, id: 579, d: 3.96, u: 5.15, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HD2 -   PRO27   HA    d: 3.96 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 11, id: 580, d: 1.91, u: 3.26, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HD3 -   THR26   HA    d: 1.90 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 12, id: 581, d: 3.70, u: 3.92, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HD3 -   THR26   HB    d: 3.80 +/- 0.28, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 13, id: 582, d: 3.99, u: 5.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HD3 -   PRO27   HA    d: 4.00 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 14, id: 583, d: 1.78, u: 2.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      PRO27  HD2 -   PRO27  HD3    d: 1.78 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 15, id: 584, d: 2.83, u: 2.79, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: S
      MET29  HB2 -   PRO27  HD2    d: 2.87 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 16, id: 585, d: 4.51, u: 6.16, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109   HA -  ASN110   HA    d: 4.47 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 18, id: 587, d: 2.51, u: 2.64, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      THR53 HG21 -   THR53   HB    d: 2.56 +/- 0.00, weight: 0.9
      THR53 HG22 -   THR53   HB
      THR53 HG23 -   THR53   HB

ref_spec: d2o-noesy, ref_peak: 19, id: 588, d: 2.68, u: 2.91, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109 HG21 -  THR109   HB    d: 2.92 +/- 0.17, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 20, id: 589, d: 5.07, u: 5.51, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109 HG21 -  ASN110   HA    d: 5.26 +/- 0.57, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 21, id: 590, d: 2.61, u: 2.64, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -  THR121   HB    d: 2.63 +/- 0.14, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 22, id: 591, d: 2.31, u: 3.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HB3 -   GLU28   HA    d: 2.26 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 23, id: 592, d: 2.98, u: 3.58, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB2 -  ASN110   HA    d: 2.95 +/- 0.13, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 26, id: 595, d: 3.96, u: 4.65, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HB2 -  THR121   HA    d: 4.19 +/- 0.82, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 27, id: 596, d: 2.50, u: 3.66, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HB2 -  THR121   HB    d: 2.92 +/- 0.53, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 28, id: 597, d: 3.07, u: 4.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HG2 -   MET29   HA    d: 2.80 +/- 0.44, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 29, id: 598, d: 2.52, u: 4.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HG3 -   MET29   HA    d: 2.83 +/- 0.55, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 30, id: 599, d: 5.49, u: 5.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111  HB2 -  ASN110   HA    d: 5.51 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 31, id: 600, d: 2.73, u: 3.25, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111  HB2 -  PRO111   HA    d: 2.72 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 32, id: 601, d: 3.96, u: 4.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HB2 -  PRO111  HD2    d: 3.97 +/- 0.02, weight: 1.0
     PRO111  HB2 -  PRO111  HD3

ref_spec: d2o-noesy, ref_peak: 33, id: 602, d: 2.27, u: 3.28, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111  HB3 -  PRO111   HA    d: 2.29 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 34, id: 603, d: 2.14, u: 2.67, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HD2 -  ASN110   HA    d: 2.18 +/- 0.06, weight: 1.0
     PRO111  HD3 -  ASN110   HA

ref_spec: d2o-noesy, ref_peak: 35, id: 604, d: 3.68, u: 3.93, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HD2 -  PRO111   HA    d: 3.73 +/- 0.11, weight: 1.0
     PRO111  HD3 -  PRO111   HA

ref_spec: d2o-noesy, ref_peak: 36, id: 605, d: 3.80, u: 3.81, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HG2 -  ASN110   HA    d: 4.18 +/- 0.14, weight: 0.6

     PRO111  HG3 -  ASN110   HA    d: 4.48 +/- 0.04, weight: 0.4

ref_spec: d2o-noesy, ref_peak: 37, id: 606, d: 3.48, u: 3.69, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HG2 -  PRO111   HA    d: 3.85 +/- 0.02, weight: 0.6

     PRO111  HG3 -  PRO111   HA    d: 4.00 +/- 0.04, weight: 0.4

ref_spec: d2o-noesy, ref_peak: 38, id: 607, d: 3.10, u: 4.51, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB2 -   ARG30  HD2    d: 3.23 +/- 0.33, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 39, id: 608, d: 3.61, u: 3.79, u_viol: 0.10, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB2 -   ARG30  HD3    d: 3.63 +/- 0.14, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 40, id: 609, d: 4.82, u: 6.00, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB2 -  THR121   HA    d: 4.72 +/- 1.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 41, id: 610, d: 2.40, u: 2.82, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB3 -   ARG30  HD2    d: 2.42 +/- 0.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 42, id: 611, d: 4.86, u: 5.92, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB3 -  CYS120   HA    d: 4.45 +/- 1.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 43, id: 612, d: 5.16, u: 6.02, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB3 -  THR121   HA    d: 4.95 +/- 0.94, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 44, id: 613, d: 2.99, u: 3.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG2 -   ARG30  HD2    d: 3.00 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 45, id: 614, d: 2.40, u: 3.28, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG2 -   ARG30  HD3    d: 2.40 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 46, id: 615, d: 3.26, u: 4.85, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG2 -  CYS120   HA    d: 3.98 +/- 0.94, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 47, id: 616, d: 3.46, u: 5.76, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG2 -  THR121   HA    d: 3.53 +/- 0.89, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 48, id: 617, d: 2.23, u: 4.65, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -   ARG30  HB2    d: 2.27 +/- 0.11, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 49, id: 618, d: 2.46, u: 3.44, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -   ARG30  HD2    d: 2.46 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 50, id: 619, d: 2.99, u: 3.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -   ARG30  HD3    d: 3.00 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 51, id: 620, d: 4.33, u: 4.84, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -  CYS120   HA    d: 4.68 +/- 0.45, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 52, id: 621, d: 4.41, u: 5.82, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -  THR121   HA    d: 4.46 +/- 1.40, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 53, id: 622, d: 2.58, u: 3.13, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HB2 -   GLU31   HA    d: 2.55 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 54, id: 623, d: 2.47, u: 3.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HB3 -   GLU31   HA    d: 2.54 +/- 0.33, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 56, id: 625, d: 5.17, u: 5.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HG -  CYS120   HA    d: 4.91 +/- 0.42, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 57, id: 626, d: 3.64, u: 3.80, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HG2 -   GLU31   HA    d: 3.67 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 58, id: 627, d: 3.61, u: 3.62, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HG3 -   GLU31   HA    d: 3.57 +/- 0.35, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 59, id: 628, d: 2.57, u: 3.75, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB2 -  ASN110  HB2    d: 2.69 +/- 0.32, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 60, id: 629, d: 2.90, u: 2.96, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB2 -  ARG113   HA    d: 2.97 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 61, id: 630, d: 3.01, u: 3.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB2 -   LYS32   HA    d: 3.01 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 62, id: 631, d: 4.06, u: 4.68, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB2 -   LYS32  HE2    d: 3.85 +/- 0.54, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 63, id: 632, d: 2.68, u: 4.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HB3 -  THR121   HB    d: 3.11 +/- 1.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 64, id: 633, d: 5.58, u: 5.54, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB3 -   GLU31   HA    d: 5.59 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 65, id: 634, d: 2.39, u: 3.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB3 -   LYS32   HA    d: 2.39 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 66, id: 635, d: 2.95, u: 4.53, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB3 -   LYS32  HE2    d: 2.66 +/- 0.75, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 67, id: 636, d: 4.16, u: 4.25, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG30  HB3 -   GLU31   HA    d: 4.61 +/- 0.25, weight: 0.6

      LEU33   HG -   GLU31   HA    d: 5.06 +/- 0.19, weight: 0.4

ref_spec: d2o-noesy, ref_peak: 68, id: 637, d: 3.61, u: 3.82, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HD2 -   LYS32   HA    d: 4.86 +/- 0.06, weight: 0.2

      LEU33   HG -   LYS32   HA    d: 3.90 +/- 0.13, weight: 0.7

ref_spec: d2o-noesy, ref_peak: 69, id: 638, d: 3.89, u: 5.34, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HE2 -   LYS32   HA    d: 3.92 +/- 0.33, weight: 0.9

ref_spec: d2o-noesy, ref_peak: 70, id: 639, d: 4.89, u: 5.08, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HE2 -  LEU117   HA    d: 4.84 +/- 0.31, weight: 0.9

ref_spec: d2o-noesy, ref_peak: 71, id: 640, d: 3.00, u: 4.02, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HE2 -  SER118   HA    d: 3.57 +/- 0.29, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 72, id: 641, d: 4.28, u: 4.14, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG2 -   GLU31   HA    d: 4.32 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 73, id: 642, d: 2.51, u: 3.76, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG2 -   LYS32   HA    d: 2.54 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 74, id: 643, d: 2.39, u: 3.55, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG2 -   LYS32  HE2    d: 2.39 +/- 0.18, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 75, id: 644, d: 3.36, u: 3.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG3 -   LYS32   HA    d: 3.34 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 76, id: 645, d: 2.98, u: 3.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG3 -   LYS32  HB3    d: 2.99 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 77, id: 646, d: 3.48, u: 3.38, u_viol: 0.10, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG3 -   LYS32  HE2    d: 3.51 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 78, id: 647, d: 1.75, u: 2.64, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG3 -   LYS32  HG2    d: 1.75 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 79, id: 648, d: 2.98, u: 3.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB2 -   LEU33   HA    d: 2.98 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 80, id: 649, d: 1.94, u: 3.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB2 -  CYS115  HB2    d: 2.08 +/- 0.13, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 81, id: 650, d: 2.90, u: 3.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB2 -   PHE38   HA    d: 2.90 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 82, id: 651, d: 4.13, u: 4.08, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB2 -   PHE38  HB3    d: 4.13 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 83, id: 652, d: 3.84, u: 6.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33 HD21 -   GLU31  HG2    d: 3.78 +/- 0.28, weight: 1.0
      LEU33 HD22 -   GLU31  HG2
      LEU33 HD23 -   GLU31  HG2

ref_spec: d2o-noesy, ref_peak: 84, id: 653, d: 2.31, u: 3.13, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   LEU33   HA    d: 2.34 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 85, id: 654, d: 1.73, u: 2.60, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   LEU33  HB2    d: 1.73 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 86, id: 655, d: 2.23, u: 2.78, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33 HD21 -   LEU33   HG    d: 2.55 +/- 0.02, weight: 0.4
      LEU33 HD22 -   LEU33   HG
      LEU33 HD23 -   LEU33   HG

      LEU33  HB2 -   LEU33   HG    d: 2.41 +/- 0.04, weight: 0.6

ref_spec: d2o-noesy, ref_peak: 87, id: 656, d: 3.47, u: 3.39, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -  CYS115  HB2    d: 3.54 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 88, id: 657, d: 1.63, u: 3.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   PHE38   HA    d: 1.65 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 89, id: 658, d: 3.26, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   PHE38  HB3    d: 3.24 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 90, id: 659, d: 5.62, u: 5.48, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD11 -  CYS120   HA    d: 5.57 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 91, id: 660, d: 3.05, u: 3.01, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33 HD21 -   ALA41  HB1    d: 3.24 +/- 0.26, weight: 0.9
      LEU33 HD22 -   ALA41  HB1
      LEU33 HD23 -   ALA41  HB1

ref_spec: d2o-noesy, ref_peak: 92, id: 661, d: 4.56, u: 4.73, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   GLU31  HG2    d: 4.54 +/- 0.57, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 93, id: 662, d: 2.01, u: 2.81, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   LEU33   HA    d: 1.91 +/- 0.11, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 94, id: 663, d: 2.79, u: 3.05, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33 HD21 -   LEU33  HB3    d: 2.92 +/- 0.13, weight: 0.9

ref_spec: d2o-noesy, ref_peak: 95, id: 664, d: 2.53, u: 2.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33 HD11 -   LEU33   HG    d: 2.55 +/- 0.01, weight: 1.0
      LEU33 HD12 -   LEU33   HG
      LEU33 HD13 -   LEU33   HG

ref_spec: d2o-noesy, ref_peak: 96, id: 665, d: 4.48, u: 4.55, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   HIS37   HA    d: 4.48 +/- 0.20, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 97, id: 666, d: 3.54, u: 3.78, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   HIS37  HB2    d: 3.50 +/- 0.46, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 98, id: 667, d: 2.02, u: 3.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   HIS37  HB3    d: 2.04 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 99, id: 668, d: 3.86, u: 3.75, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   PHE38   HA    d: 3.87 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 100, id: 669, d: 2.25, u: 3.12, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33 HD11 -   ALA41  HB1    d: 2.12 +/- 0.19, weight: 1.0
      LEU33 HD12 -   ALA41  HB1
      LEU33 HD13 -   ALA41  HB1

ref_spec: d2o-noesy, ref_peak: 101, id: 670, d: 3.23, u: 3.59, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HG -   LEU33   HA    d: 3.29 +/- 0.08, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 102, id: 671, d: 2.73, u: 3.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB2 -   CYS34   HA    d: 2.70 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 103, id: 672, d: 3.63, u: 3.92, u_viol: 0.17, %_viol: 0.0, viol: no, reliable: no, a_type: S
      CYS34  HB2 -  CYS116   HA    d: 3.71 +/- 0.35, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 104, id: 673, d: 2.87, u: 3.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB3 -   CYS34   HA    d: 2.94 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 105, id: 674, d: 1.76, u: 2.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB3 -   CYS34  HB2    d: 1.76 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 106, id: 675, d: 3.22, u: 4.01, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS116   HA -   CYS34   HA    d: 3.58 +/- 0.30, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 107, id: 676, d: 3.32, u: 4.69, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB2 -  ARG113   HA    d: 3.44 +/- 0.59, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 108, id: 677, d: 1.72, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB2 -   CYS34   HA    d: 1.72 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 109, id: 678, d: 2.52, u: 3.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS116  HB2 -  CYS116   HA    d: 2.54 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 110, id: 679, d: 2.70, u: 4.15, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB3 -  ARG113   HA    d: 3.11 +/- 0.52, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 111, id: 680, d: 3.04, u: 3.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS116  HB3 -  CYS116   HA    d: 3.03 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 112, id: 681, d: 1.76, u: 2.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB3 -  CYS116  HB2    d: 1.76 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 113, id: 682, d: 1.75, u: 2.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY35  HA3 -   GLY35  HA2    d: 1.75 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 114, id: 683, d: 2.66, u: 3.01, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB3 -  LEU117   HA    d: 2.63 +/- 0.08, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 115, id: 684, d: 2.33, u: 2.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU117 HD21 -  LEU117   HA    d: 2.33 +/- 0.04, weight: 1.0
     LEU117 HD22 -  LEU117   HA
     LEU117 HD23 -  LEU117   HA

ref_spec: d2o-noesy, ref_peak: 116, id: 685, d: 2.97, u: 2.90, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB2 -  LEU117   HA    d: 2.98 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 117, id: 686, d: 2.27, u: 2.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      HIS36  HB2 -   HIS36   HA    d: 2.39 +/- 0.06, weight: 0.8

      HIS36  HB3 -   HIS36   HA    d: 3.01 +/- 0.01, weight: 0.2

ref_spec: d2o-noesy, ref_peak: 118, id: 687, d: 2.59, u: 3.44, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     SER118  HB2 -  SER118   HA    d: 2.58 +/- 0.19, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 119, id: 688, d: 2.47, u: 3.81, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB2 -   LEU33   HA    d: 2.53 +/- 0.37, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 120, id: 689, d: 2.95, u: 3.13, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB2 -   HIS37   HA    d: 2.93 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 121, id: 690, d: 2.00, u: 3.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB3 -   LEU33   HA    d: 2.01 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 122, id: 691, d: 2.74, u: 3.05, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB3 -   HIS37   HA    d: 2.75 +/- 0.11, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 123, id: 692, d: 1.76, u: 2.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB3 -   HIS37  HB2    d: 1.76 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 124, id: 693, d: 3.01, u: 3.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38  HB3 -   PHE38   HA    d: 3.00 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 125, id: 694, d: 4.13, u: 5.46, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -  CYS120   HA    d: 4.23 +/- 0.65, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 126, id: 695, d: 2.75, u: 3.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -  THR121   HA    d: 3.11 +/- 0.52, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 127, id: 696, d: 4.67, u: 4.64, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -  THR121   HB    d: 4.78 +/- 0.11, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 128, id: 697, d: 4.41, u: 5.60, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA3 -  CYS120   HA    d: 4.44 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 129, id: 698, d: 4.20, u: 5.38, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     GLN122   HA -  THR121   HA    d: 4.40 +/- 0.27, weight: 0.8

ref_spec: d2o-noesy, ref_peak: 130, id: 699, d: 4.37, u: 5.08, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     GLN122   HA -  THR121   HB    d: 4.73 +/- 0.19, weight: 0.7

     GLN123   HA -  THR121   HB    d: 5.33 +/- 0.26, weight: 0.3

ref_spec: d2o-noesy, ref_peak: 131, id: 700, d: 3.85, u: 3.85, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL39   HB -   HIS36  HB2    d: 4.35 +/- 0.13, weight: 0.6

      VAL39   HB -   HIS36  HB3    d: 4.84 +/- 0.12, weight: 0.3

ref_spec: d2o-noesy, ref_peak: 132, id: 701, d: 2.86, u: 3.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39   HB -   VAL39   HA    d: 2.92 +/- 0.08, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 133, id: 702, d: 2.45, u: 2.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL39 HG21 -   VAL39   HA    d: 2.51 +/- 0.08, weight: 1.0
      VAL39 HG22 -   VAL39   HA
      VAL39 HG23 -   VAL39   HA

ref_spec: d2o-noesy, ref_peak: 134, id: 703, d: 2.13, u: 2.46, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL45 HG21 -   VAL45   HB    d: 2.50 +/- 0.03, weight: 0.4
      VAL45 HG22 -   VAL45   HB
      VAL45 HG23 -   VAL45   HB

      VAL39 HG21 -   VAL39   HB    d: 2.51 +/- 0.01, weight: 0.4
      VAL39 HG22 -   VAL39   HB
      VAL39 HG23 -   VAL39   HB

ref_spec: d2o-noesy, ref_peak: 136, id: 705, d: 2.53, u: 2.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL39 HG11 -   VAL39   HB    d: 2.53 +/- 0.01, weight: 1.0
      VAL39 HG12 -   VAL39   HB
      VAL39 HG13 -   VAL39   HB

ref_spec: d2o-noesy, ref_peak: 137, id: 706, d: 4.32, u: 5.93, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HA -  CYS120   HA    d: 4.35 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 138, id: 707, d: 2.44, u: 2.78, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HB -  THR121   HA    d: 2.45 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 139, id: 708, d: 3.28, u: 3.69, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   GLU28  HB2    d: 3.38 +/- 0.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 140, id: 709, d: 2.74, u: 3.14, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   ARG30   HA    d: 2.62 +/- 0.33, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 141, id: 710, d: 3.28, u: 4.03, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   ARG30  HB2    d: 3.31 +/- 1.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 142, id: 711, d: 4.05, u: 4.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   ARG30  HB3    d: 3.92 +/- 0.43, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 143, id: 712, d: 4.27, u: 4.19, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   ARG30  HD2    d: 4.33 +/- 0.13, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 144, id: 713, d: 2.99, u: 4.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     THR109 HG21 -  TYR114  HB2    d: 3.40 +/- 0.74, weight: 0.8
     THR109 HG21 -  TYR114  HB3
     THR109 HG22 -  TYR114  HB2
     THR109 HG22 -  TYR114  HB3
     THR109 HG23 -  TYR114  HB2
     THR109 HG23 -  TYR114  HB3

ref_spec: d2o-noesy, ref_peak: 145, id: 714, d: 2.26, u: 4.10, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   ARG30  HG2    d: 2.17 +/- 0.33, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 146, id: 715, d: 4.40, u: 4.37, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -  CYS120   HA    d: 4.44 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 147, id: 716, d: 2.33, u: 2.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -  THR121   HA    d: 2.32 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 148, id: 717, d: 2.60, u: 2.91, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG40  HB2 -   ARG40   HA    d: 2.61 +/- 0.18, weight: 1.0
      ARG40  HB3 -   ARG40   HA

ref_spec: d2o-noesy, ref_peak: 149, id: 718, d: 2.60, u: 2.87, u_viol: 0.40, %_viol: 10.0, viol: no, reliable: no, a_type: S
      ARG40  HB2 -   ARG40  HD2    d: 2.69 +/- 0.33, weight: 1.0
      ARG40  HB3 -   ARG40  HD2

ref_spec: d2o-noesy, ref_peak: 150, id: 719, d: 3.07, u: 3.56, u_viol: 0.16, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40  HG2 -   ARG40   HA    d: 3.34 +/- 0.49, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 151, id: 720, d: 2.80, u: 2.90, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40  HG2 -   ARG40  HD2    d: 2.78 +/- 0.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 152, id: 721, d: 3.04, u: 3.63, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40  HG3 -   ARG40   HA    d: 2.94 +/- 0.62, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 153, id: 722, d: 2.51, u: 3.04, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB3 -   ARG30  HD3    d: 2.66 +/- 0.36, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 154, id: 723, d: 4.60, u: 5.89, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HB2 -  THR121   HA    d: 4.79 +/- 0.64, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 155, id: 724, d: 3.01, u: 3.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HB2 -  GLN122   HA    d: 2.90 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 156, id: 725, d: 2.81, u: 3.64, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG2 -  GLN123   HA    d: 2.77 +/- 0.57, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 157, id: 726, d: 4.47, u: 5.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      GLU28  HG3 -  THR121   HB    d: 4.74 +/- 0.53, weight: 0.8

ref_spec: d2o-noesy, ref_peak: 158, id: 727, d: 2.58, u: 3.81, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG3 -  GLN122   HA    d: 2.75 +/- 0.45, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 159, id: 728, d: 5.51, u: 5.26, u_viol: 0.25, %_viol: 5.0, viol: no, reliable: no, a_type: M
      ALA41  HB1 -   LEU33   HA    d: 5.54 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 160, id: 729, d: 2.57, u: 2.56, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ALA41  HB1 -   ALA41   HA    d: 2.56 +/- 0.02, weight: 1.0
      ALA41  HB2 -   ALA41   HA
      ALA41  HB3 -   ALA41   HA

ref_spec: d2o-noesy, ref_peak: 161, id: 730, d: 4.37, u: 4.67, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG30  HG3 -  CYS120  HB3    d: 6.70 +/- 0.60, weight: 0.1

      ALA41  HB1 -   LEU42   HA    d: 4.56 +/- 0.04, weight: 0.8
      ALA41  HB2 -   LEU42   HA
      ALA41  HB3 -   LEU42   HA

ref_spec: d2o-noesy, ref_peak: 162, id: 731, d: 2.62, u: 2.80, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HB3 -  GLN123   HA    d: 2.69 +/- 0.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 163, id: 732, d: 3.25, u: 3.54, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG3 -  GLN123   HA    d: 2.97 +/- 0.57, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 164, id: 733, d: 2.56, u: 3.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB2 -   VAL39   HA    d: 2.47 +/- 0.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 165, id: 734, d: 2.77, u: 3.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB2 -   LEU42   HA    d: 2.76 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 166, id: 735, d: 3.26, u: 3.80, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB3 -   VAL39   HA    d: 3.11 +/- 0.32, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 167, id: 736, d: 2.93, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB3 -   LEU42   HA    d: 2.94 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 168, id: 737, d: 1.75, u: 2.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB3 -   LEU42  HB2    d: 1.74 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 169, id: 738, d: 3.57, u: 3.50, u_viol: 0.16, %_viol: 10.0, viol: no, reliable: no, a_type: S
      LEU42 HD11 -   VAL39   HA    d: 3.44 +/- 0.25, weight: 0.9
      LEU42 HD12 -   VAL39   HA
      LEU42 HD13 -   VAL39   HA

ref_spec: d2o-noesy, ref_peak: 170, id: 739, d: 2.71, u: 2.93, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      LEU42 HD21 -   LEU42   HA    d: 2.78 +/- 0.20, weight: 0.9
      LEU42 HD22 -   LEU42   HA
      LEU42 HD23 -   LEU42   HA

ref_spec: d2o-noesy, ref_peak: 171, id: 740, d: 2.81, u: 3.00, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU42 HD11 -   LEU42  HB2    d: 2.87 +/- 0.05, weight: 0.8
      LEU42 HD12 -   LEU42  HB2
      LEU42 HD13 -   LEU42  HB2

ref_spec: d2o-noesy, ref_peak: 172, id: 741, d: 2.25, u: 2.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU42 HD11 -   LEU42   HG    d: 2.53 +/- 0.02, weight: 0.5
      LEU42 HD12 -   LEU42   HG
      LEU42 HD13 -   LEU42   HG

      LEU42 HD21 -   LEU42   HG    d: 2.51 +/- 0.01, weight: 0.5
      LEU42 HD22 -   LEU42   HG
      LEU42 HD23 -   LEU42   HG

ref_spec: d2o-noesy, ref_peak: 173, id: 742, d: 3.52, u: 3.61, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU42 HD21 -  LEU125   HA    d: 4.31 +/- 1.12, weight: 0.8
      LEU42 HD22 -  LEU125   HA
      LEU42 HD23 -  LEU125   HA

ref_spec: d2o-noesy, ref_peak: 174, id: 743, d: 3.16, u: 3.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      LEU42 HD21 -   VAL45   HB    d: 4.75 +/- 0.47, weight: 0.2
      LEU42 HD22 -   VAL45   HB
      LEU42 HD23 -   VAL45   HB

      LEU42 HD21 -  LEU125  HB3    d: 3.80 +/- 0.93, weight: 0.7
      LEU42 HD22 -  LEU125  HB3
      LEU42 HD23 -  LEU125  HB3

ref_spec: d2o-noesy, ref_peak: 175, id: 744, d: 3.07, u: 4.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -  CYS129   HA    d: 3.44 +/- 0.75, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 176, id: 745, d: 3.07, u: 3.25, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   GLU31  HG3    d: 3.10 +/- 0.20, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 177, id: 746, d: 3.49, u: 3.35, u_viol: 0.22, %_viol: 20.0, viol: no, reliable: no, a_type: S
      LEU42 HD21 -  LEU128  HB3    d: 4.35 +/- 0.68, weight: 0.5
      LEU42 HD22 -  LEU128  HB3
      LEU42 HD23 -  LEU128  HB3

      LEU42 HD11 -  LEU128  HB3    d: 4.47 +/- 1.32, weight: 0.5
      LEU42 HD12 -  LEU128  HB3
      LEU42 HD13 -  LEU128  HB3

ref_spec: d2o-noesy, ref_peak: 178, id: 747, d: 3.65, u: 4.11, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB2 -  CYS120   HA    d: 3.78 +/- 0.29, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 179, id: 748, d: 2.77, u: 3.22, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB2 -  ASP124   HA    d: 2.80 +/- 0.22, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 180, id: 749, d: 4.01, u: 4.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB3 -  CYS120   HA    d: 4.00 +/- 0.31, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 181, id: 750, d: 2.90, u: 3.11, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB3 -  ASP124   HA    d: 2.73 +/- 0.23, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 182, id: 751, d: 3.50, u: 3.26, u_viol: 0.24, %_viol: 5.0, viol: no, reliable: no, a_type: M
      VAL43   HB -   ARG40   HA    d: 3.44 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 183, id: 752, d: 2.97, u: 3.67, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43   HB -   VAL43   HA    d: 3.00 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 184, id: 753, d: 3.25, u: 3.12, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL43 HG21 -   VAL43   HA    d: 3.12 +/- 0.20, weight: 1.0
      VAL43 HG22 -   VAL43   HA
      VAL43 HG23 -   VAL43   HA

ref_spec: d2o-noesy, ref_peak: 185, id: 754, d: 2.53, u: 2.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL43 HG21 -   VAL43   HB    d: 2.52 +/- 0.02, weight: 1.0
      VAL43 HG22 -   VAL43   HB
      VAL43 HG23 -   VAL43   HB

ref_spec: d2o-noesy, ref_peak: 186, id: 755, d: 3.80, u: 3.99, u_viol: 0.41, %_viol: 30.0, viol: no, reliable: no, a_type: S
     LEU126 HD21 -   CYS46   HA    d: 4.19 +/- 0.58, weight: 0.9
     LEU126 HD22 -   CYS46   HA
     LEU126 HD23 -   CYS46   HA

ref_spec: d2o-noesy, ref_peak: 187, id: 756, d: 3.70, u: 3.83, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   ARG40   HA    d: 3.90 +/- 0.46, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 188, id: 757, d: 2.59, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL43 HG11 -   VAL43   HA    d: 2.68 +/- 0.15, weight: 1.0
      VAL43 HG12 -   VAL43   HA
      VAL43 HG13 -   VAL43   HA

ref_spec: d2o-noesy, ref_peak: 189, id: 758, d: 2.55, u: 2.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL43 HG11 -   VAL43   HB    d: 2.54 +/- 0.01, weight: 1.0
      VAL43 HG12 -   VAL43   HB
      VAL43 HG13 -   VAL43   HB

ref_spec: d2o-noesy, ref_peak: 190, id: 759, d: 3.02, u: 3.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB2 -  LEU125   HA    d: 3.02 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 191, id: 760, d: 3.96, u: 3.77, u_viol: 0.19, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB3 -  GLN122   HA    d: 4.71 +/- 2.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 192, id: 761, d: 2.49, u: 3.29, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB3 -  LEU125   HA    d: 2.47 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 193, id: 762, d: 2.73, u: 2.69, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125  HB3 -   VAL45   HB    d: 2.65 +/- 0.26, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 194, id: 763, d: 2.86, u: 3.60, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB3 -  LEU125   HG    d: 2.88 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 195, id: 764, d: 5.55, u: 5.78, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD11 -  CYS120   HA    d: 5.57 +/- 0.41, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 196, id: 765, d: 2.73, u: 4.38, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD11 -   ALA41  HB1    d: 2.98 +/- 0.34, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 197, id: 766, d: 3.89, u: 3.80, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD11 -   LEU42   HA    d: 4.52 +/- 0.38, weight: 0.5

     LEU125 HD11 -  CYS120  HB3    d: 4.60 +/- 0.88, weight: 0.5

ref_spec: d2o-noesy, ref_peak: 198, id: 767, d: 2.47, u: 3.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD21 -  LEU125  HB3    d: 2.49 +/- 0.10, weight: 1.0
     LEU125 HD22 -  LEU125  HB3
     LEU125 HD23 -  LEU125  HB3

ref_spec: d2o-noesy, ref_peak: 200, id: 769, d: 2.53, u: 2.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD21 -  LEU125   HG    d: 2.54 +/- 0.00, weight: 1.0
     LEU125 HD22 -  LEU125   HG
     LEU125 HD23 -  LEU125   HG

ref_spec: d2o-noesy, ref_peak: 201, id: 770, d: 2.20, u: 3.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD11 -   LEU33 HD11    d: 2.55 +/- 0.63, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 202, id: 771, d: 2.44, u: 3.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU125 HD11 -  GLN122   HA    d: 3.44 +/- 2.51, weight: 0.9
     LEU125 HD12 -  GLN122   HA
     LEU125 HD13 -  GLN122   HA

ref_spec: d2o-noesy, ref_peak: 203, id: 772, d: 5.68, u: 5.55, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD21 -  GLN122  HG2    d: 5.70 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 204, id: 773, d: 5.65, u: 5.59, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD21 -  GLN122  HG3    d: 5.70 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 205, id: 774, d: 1.95, u: 3.11, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD21 -   ALA41  HB1    d: 2.44 +/- 0.58, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 206, id: 775, d: 3.37, u: 4.09, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU125 HD11 -   LEU42   HA    d: 4.65 +/- 0.70, weight: 0.3
     LEU125 HD12 -   LEU42   HA
     LEU125 HD13 -   LEU42   HA

     LEU125 HD11 -  CYS120  HB3    d: 4.10 +/- 0.99, weight: 0.7
     LEU125 HD12 -  CYS120  HB3
     LEU125 HD13 -  CYS120  HB3

ref_spec: d2o-noesy, ref_peak: 208, id: 777, d: 2.32, u: 2.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD11 -  LEU125  HB2    d: 2.41 +/- 0.13, weight: 1.0
     LEU125 HD12 -  LEU125  HB2
     LEU125 HD13 -  LEU125  HB2

ref_spec: d2o-noesy, ref_peak: 209, id: 778, d: 3.47, u: 3.19, u_viol: 0.28, %_viol: 35.0, viol: no, reliable: no, a_type: S
     LEU125 HD11 -  LEU125  HB3    d: 3.42 +/- 0.11, weight: 1.0
     LEU125 HD12 -  LEU125  HB3
     LEU125 HD13 -  LEU125  HB3

ref_spec: d2o-noesy, ref_peak: 210, id: 779, d: 2.51, u: 2.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD11 -  LEU125   HG    d: 2.52 +/- 0.01, weight: 1.0
     LEU125 HD12 -  LEU125   HG
     LEU125 HD13 -  LEU125   HG

ref_spec: d2o-noesy, ref_peak: 211, id: 780, d: 3.17, u: 3.11, u_viol: 0.24, %_viol: 25.0, viol: no, reliable: no, a_type: S
     LEU125 HD21 -   VAL45 HG21    d: 3.56 +/- 0.84, weight: 1.0
     LEU125 HD21 -   VAL45 HG22
     LEU125 HD21 -   VAL45 HG23

ref_spec: d2o-noesy, ref_peak: 212, id: 781, d: 2.87, u: 2.83, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD21 -   LEU33 HD11    d: 2.90 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 213, id: 782, d: 2.22, u: 3.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB2 -   ALA41   HA    d: 2.14 +/- 0.22, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 214, id: 783, d: 3.02, u: 3.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB2 -   ARG44   HA    d: 3.01 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 215, id: 784, d: 3.11, u: 4.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB2 -   ARG44  HD2    d: 3.32 +/- 0.41, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 216, id: 785, d: 3.83, u: 3.94, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB2 -   ARG44  HD3    d: 3.89 +/- 0.24, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 217, id: 786, d: 3.65, u: 3.42, u_viol: 0.23, %_viol: 5.0, viol: no, reliable: no, a_type: M
      ARG44  HB3 -   ALA41   HA    d: 3.58 +/- 0.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 218, id: 787, d: 2.44, u: 2.87, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB3 -   ARG44   HA    d: 2.42 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 219, id: 788, d: 2.22, u: 3.93, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB3 -   ARG44  HD2    d: 2.30 +/- 0.32, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 220, id: 789, d: 2.91, u: 3.44, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB3 -   ARG44  HD3    d: 3.11 +/- 0.39, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 221, id: 790, d: 3.85, u: 4.22, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD2 -   ARG44   HA    d: 3.52 +/- 0.57, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 222, id: 791, d: 3.71, u: 3.93, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD3 -   ARG44   HA    d: 3.64 +/- 0.72, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 223, id: 792, d: 2.60, u: 3.33, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG2 -   ARG44   HA    d: 2.65 +/- 0.38, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 224, id: 793, d: 2.87, u: 3.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG2 -   ARG44  HD2    d: 2.77 +/- 0.20, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 225, id: 794, d: 2.31, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG2 -   ARG44  HD3    d: 2.34 +/- 0.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 226, id: 795, d: 3.71, u: 3.79, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG3 -   ARG44   HA    d: 3.69 +/- 0.08, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 227, id: 796, d: 2.70, u: 3.53, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG3 -   ARG44  HD2    d: 2.76 +/- 0.28, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 228, id: 797, d: 2.86, u: 3.19, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG3 -   ARG44  HD3    d: 2.76 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 229, id: 798, d: 2.13, u: 3.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB2 -  GLN123   HA    d: 2.35 +/- 0.44, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 230, id: 799, d: 2.95, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB2 -  LEU126   HA    d: 2.96 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 231, id: 800, d: 3.60, u: 3.56, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB3 -  GLN123   HA    d: 3.82 +/- 0.39, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 232, id: 801, d: 2.73, u: 3.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB3 -  LEU126   HA    d: 2.70 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 233, id: 802, d: 2.92, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD21 -  PRO111  HB2    d: 3.11 +/- 0.59, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 234, id: 803, d: 2.68, u: 2.96, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU126 HD11 -  GLN123   HA    d: 2.75 +/- 0.31, weight: 1.0
     LEU126 HD12 -  GLN123   HA
     LEU126 HD13 -  GLN123   HA

ref_spec: d2o-noesy, ref_peak: 235, id: 804, d: 4.27, u: 4.41, u_viol: 0.53, %_viol: 20.0, viol: no, reliable: no, a_type: S
     LEU126 HD11 -  GLN123  HG2    d: 4.21 +/- 1.10, weight: 1.0
     LEU126 HD12 -  GLN123  HG2
     LEU126 HD13 -  GLN123  HG2

ref_spec: d2o-noesy, ref_peak: 236, id: 805, d: 4.92, u: 4.92, u_viol: 0.47, %_viol: 50.0, viol: no, reliable: no, a_type: S
     LEU126 HD11 -  GLN123  HG3    d: 4.62 +/- 0.86, weight: 1.0
     LEU126 HD12 -  GLN123  HG3
     LEU126 HD13 -  GLN123  HG3

ref_spec: d2o-noesy, ref_peak: 237, id: 806, d: 2.28, u: 2.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU126 HD21 -  LEU126   HA    d: 2.31 +/- 0.10, weight: 1.0
     LEU126 HD22 -  LEU126   HA
     LEU126 HD23 -  LEU126   HA

ref_spec: d2o-noesy, ref_peak: 238, id: 807, d: 2.53, u: 2.81, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU126 HD11 -  LEU126  HB3    d: 2.85 +/- 0.05, weight: 0.5
     LEU126 HD12 -  LEU126  HB3
     LEU126 HD13 -  LEU126  HB3

     LEU126 HD21 -  LEU126  HB3    d: 2.87 +/- 0.04, weight: 0.5
     LEU126 HD22 -  LEU126  HB3
     LEU126 HD23 -  LEU126  HB3

ref_spec: d2o-noesy, ref_peak: 239, id: 808, d: 2.74, u: 2.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU126 HD11 -  LEU126  HB2    d: 2.80 +/- 0.04, weight: 0.9
     LEU126 HD12 -  LEU126  HB2
     LEU126 HD13 -  LEU126  HB2

ref_spec: d2o-noesy, ref_peak: 240, id: 809, d: 2.27, u: 2.42, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU126 HD11 -  LEU126   HG    d: 2.55 +/- 0.00, weight: 0.5
     LEU126 HD12 -  LEU126   HG
     LEU126 HD13 -  LEU126   HG

     LEU126 HD21 -  LEU126   HG    d: 2.56 +/- 0.00, weight: 0.5
     LEU126 HD22 -  LEU126   HG
     LEU126 HD23 -  LEU126   HG

ref_spec: d2o-noesy, ref_peak: 241, id: 810, d: 4.73, u: 4.58, u_viol: 0.17, %_viol: 10.0, viol: no, reliable: no, a_type: S
     LEU126 HD21 -   VAL45   HA    d: 4.78 +/- 0.60, weight: 0.8
     LEU126 HD22 -   VAL45   HA
     LEU126 HD23 -   VAL45   HA

ref_spec: d2o-noesy, ref_peak: 242, id: 811, d: 2.74, u: 3.60, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126   HG -  LEU126   HA    d: 2.78 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 243, id: 812, d: 3.00, u: 3.25, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45   HB -   VAL45   HA    d: 2.99 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 244, id: 813, d: 3.69, u: 3.55, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45 HG11 -  GLN122   HA    d: 4.44 +/- 2.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 245, id: 814, d: 2.25, u: 4.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -  GLN122  HG2    d: 3.06 +/- 1.94, weight: 1.0
      VAL45 HG22 -  GLN122  HG2
      VAL45 HG23 -  GLN122  HG2

ref_spec: d2o-noesy, ref_peak: 246, id: 815, d: 3.73, u: 3.78, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD11 -  PRO111  HB2    d: 3.79 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 247, id: 816, d: 3.48, u: 3.54, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -   LEU42   HA    d: 3.72 +/- 0.44, weight: 1.0
      VAL45 HG22 -   LEU42   HA
      VAL45 HG23 -   LEU42   HA

ref_spec: d2o-noesy, ref_peak: 249, id: 818, d: 2.85, u: 3.05, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL45 HG21 -   VAL45   HA    d: 2.98 +/- 0.24, weight: 1.0
      VAL45 HG22 -   VAL45   HA
      VAL45 HG23 -   VAL45   HA

ref_spec: d2o-noesy, ref_peak: 250, id: 819, d: 2.94, u: 3.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45 HG21 -  GLN122   HA    d: 4.28 +/- 2.23, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 251, id: 820, d: 3.22, u: 4.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45 HG21 -  GLN122  HG2    d: 3.98 +/- 1.24, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 252, id: 821, d: 4.84, u: 4.53, u_viol: 0.54, %_viol: 55.0, viol: yes, reliable: no, a_type: S
      VAL45 HG11 -  GLN122  HG3    d: 4.84 +/- 0.94, weight: 0.9
      VAL45 HG12 -  GLN122  HG3
      VAL45 HG13 -  GLN122  HG3

ref_spec: d2o-noesy, ref_peak: 254, id: 823, d: 3.47, u: 3.53, u_viol: 0.22, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD11 -  CYS120  HB2    d: 3.48 +/- 0.40, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 255, id: 824, d: 2.60, u: 3.74, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45 HG21 -  LEU125  HB3    d: 2.64 +/- 0.26, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 256, id: 825, d: 2.53, u: 3.52, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG11 -  LEU126   HA    d: 2.70 +/- 0.32, weight: 1.0
      VAL45 HG12 -  LEU126   HA
      VAL45 HG13 -  LEU126   HA

ref_spec: d2o-noesy, ref_peak: 257, id: 826, d: 3.86, u: 4.18, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG11 -  LEU126  HB2    d: 3.98 +/- 0.28, weight: 1.0
      VAL45 HG12 -  LEU126  HB2
      VAL45 HG13 -  LEU126  HB2

ref_spec: d2o-noesy, ref_peak: 258, id: 827, d: 2.19, u: 3.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL45 HG11 -  LEU126   HG    d: 2.30 +/- 0.16, weight: 1.0
      VAL45 HG12 -  LEU126   HG
      VAL45 HG13 -  LEU126   HG

ref_spec: d2o-noesy, ref_peak: 259, id: 828, d: 2.91, u: 3.14, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL45 HG11 -   VAL45   HA    d: 2.73 +/- 0.28, weight: 1.0
      VAL45 HG12 -   VAL45   HA
      VAL45 HG13 -   VAL45   HA

ref_spec: d2o-noesy, ref_peak: 260, id: 829, d: 2.50, u: 2.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG11 -   VAL45   HB    d: 2.49 +/- 0.02, weight: 1.0
      VAL45 HG12 -   VAL45   HB
      VAL45 HG13 -   VAL45   HB

ref_spec: d2o-noesy, ref_peak: 261, id: 830, d: 2.88, u: 2.93, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127 HG21 -  THR127   HA    d: 2.79 +/- 0.22, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 262, id: 831, d: 2.61, u: 2.58, u_viol: 0.04, %_viol: 5.0, viol: no, reliable: no, a_type: M
     THR127 HG21 -  THR127   HB    d: 2.72 +/- 0.16, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 263, id: 832, d: 2.51, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      CYS46  HB2 -   CYS46   HA    d: 2.65 +/- 0.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 264, id: 833, d: 2.83, u: 3.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      CYS46  HB3 -   CYS46   HA    d: 2.88 +/- 0.23, weight: 0.9

ref_spec: d2o-noesy, ref_peak: 265, id: 834, d: 1.75, u: 2.81, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46  HB3 -   CYS46  HB2    d: 1.75 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 266, id: 835, d: 3.76, u: 3.43, u_viol: 0.41, %_viol: 60.0, viol: yes, reliable: no, a_type: S
      VAL39 HG21 -   HIS36   HA    d: 3.52 +/- 0.59, weight: 1.0
      VAL39 HG22 -   HIS36   HA
      VAL39 HG23 -   HIS36   HA

ref_spec: d2o-noesy, ref_peak: 268, id: 837, d: 2.28, u: 3.04, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD11 -  LEU128  HB2    d: 2.24 +/- 0.14, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 269, id: 838, d: 2.63, u: 2.89, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128 HD21 -  LEU128  HB3    d: 2.53 +/- 0.19, weight: 1.0
     LEU128 HD22 -  LEU128  HB3
     LEU128 HD23 -  LEU128  HB3

ref_spec: d2o-noesy, ref_peak: 270, id: 839, d: 2.54, u: 2.65, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128 HD21 -  LEU128   HG    d: 2.54 +/- 0.01, weight: 1.0
     LEU128 HD22 -  LEU128   HG
     LEU128 HD23 -  LEU128   HG

ref_spec: d2o-noesy, ref_peak: 271, id: 840, d: 2.96, u: 2.90, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD21 -  LEU128   HA    d: 3.30 +/- 0.66, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 272, id: 841, d: 3.54, u: 3.35, u_viol: 0.18, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD21 -  LEU128  HB2    d: 3.38 +/- 0.26, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 273, id: 842, d: 2.53, u: 2.71, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128 HD11 -  LEU128   HG    d: 2.53 +/- 0.02, weight: 1.0
     LEU128 HD12 -  LEU128   HG
     LEU128 HD13 -  LEU128   HG

ref_spec: d2o-noesy, ref_peak: 274, id: 843, d: 2.47, u: 3.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS129  HB2 -  CYS129   HA    d: 2.55 +/- 0.26, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 275, id: 844, d: 3.12, u: 3.82, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS129  HB2 -  PRO130  HD3    d: 3.13 +/- 0.50, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 276, id: 845, d: 2.71, u: 3.61, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS129  HB3 -  CYS129   HA    d: 2.71 +/- 0.27, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 277, id: 846, d: 1.75, u: 2.74, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY48  HA3 -   GLY48  HA2    d: 1.75 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 278, id: 847, d: 2.83, u: 3.12, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO130  HB2 -  PRO130   HA    d: 2.77 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 279, id: 848, d: 1.95, u: 3.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39   HB -   HIS36   HA    d: 2.14 +/- 0.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 280, id: 849, d: 2.50, u: 3.36, u_viol: 0.33, %_viol: 25.0, viol: no, reliable: no, a_type: M
     PRO130  HD3 -  CYS129   HA    d: 3.11 +/- 0.81, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 281, id: 850, d: 3.93, u: 4.90, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO130  HD3 -  PRO130   HA    d: 3.93 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 282, id: 851, d: 3.69, u: 4.33, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128  HB2 -  CYS129   HA    d: 4.44 +/- 0.10, weight: 0.6

     PRO130  HG3 -  CYS129   HA    d: 5.15 +/- 0.88, weight: 0.2

ref_spec: d2o-noesy, ref_peak: 283, id: 852, d: 2.19, u: 3.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO130  HG2 -  PRO130  HD3    d: 2.80 +/- 0.11, weight: 0.2

     PRO130  HG3 -  PRO130  HD3    d: 2.29 +/- 0.02, weight: 0.8

ref_spec: d2o-noesy, ref_peak: 284, id: 853, d: 2.68, u: 2.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HB2 -   PRO49   HA    d: 2.72 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 285, id: 854, d: 4.02, u: 4.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HB2 -   PRO49  HD2    d: 3.93 +/- 0.20, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 286, id: 855, d: 3.94, u: 4.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HB2 -   PRO49  HD3    d: 3.96 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 287, id: 856, d: 2.31, u: 3.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HB3 -   PRO49   HA    d: 2.29 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 288, id: 857, d: 2.13, u: 3.49, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HD2 -   GLY48  HA2    d: 2.67 +/- 0.70, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 289, id: 858, d: 3.60, u: 3.47, u_viol: 0.15, %_viol: 5.0, viol: no, reliable: no, a_type: M
      PRO49  HD2 -   GLY48  HA3    d: 3.38 +/- 0.73, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 290, id: 859, d: 2.36, u: 3.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HD3 -   GLY48  HA2    d: 2.76 +/- 0.63, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 291, id: 860, d: 3.22, u: 3.40, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HD3 -   GLY48  HA3    d: 3.19 +/- 0.36, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 292, id: 861, d: 2.29, u: 3.61, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HG2 -   PRO49  HD2    d: 2.29 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 293, id: 862, d: 2.98, u: 3.58, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HG2 -   PRO49  HD3    d: 2.94 +/- 0.08, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 294, id: 863, d: 2.72, u: 3.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HG3 -   PRO49  HD2    d: 2.75 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 295, id: 864, d: 2.30, u: 3.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HG3 -   PRO49  HD3    d: 2.31 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 296, id: 865, d: 3.02, u: 3.15, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR131  HB2 -  TYR131   HA    d: 3.02 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 297, id: 866, d: 2.51, u: 3.30, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR131  HB3 -  TYR131   HA    d: 2.50 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 298, id: 867, d: 2.82, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB2 -   ARG50   HA    d: 3.00 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 299, id: 868, d: 3.04, u: 4.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HB2 -   ARG50  HD2    d: 3.29 +/- 0.48, weight: 1.0
      ARG50  HB2 -   ARG50  HD3

ref_spec: d2o-noesy, ref_peak: 300, id: 869, d: 2.52, u: 3.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB3 -   ARG50   HA    d: 2.44 +/- 0.11, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 301, id: 870, d: 2.99, u: 3.77, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HB3 -   ARG50  HD2    d: 2.96 +/- 0.31, weight: 1.0
      ARG50  HB3 -   ARG50  HD3

ref_spec: d2o-noesy, ref_peak: 302, id: 871, d: 2.59, u: 2.96, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HG2 -   ARG50  HD2    d: 2.50 +/- 0.10, weight: 1.0
      ARG50  HG2 -   ARG50  HD3

ref_spec: d2o-noesy, ref_peak: 303, id: 872, d: 2.99, u: 3.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB2 -   TRP51   HA    d: 2.92 +/- 0.20, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 304, id: 873, d: 2.33, u: 3.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB3 -   TRP51   HA    d: 2.39 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 305, id: 874, d: 3.02, u: 3.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB2 -   SER52   HA    d: 3.01 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 306, id: 875, d: 4.54, u: 4.65, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB2 -   THR53   HA    d: 4.54 +/- 0.23, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 307, id: 876, d: 2.44, u: 3.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB3 -   SER52   HA    d: 2.51 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 308, id: 877, d: 1.76, u: 2.64, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB3 -   SER52  HB2    d: 1.76 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 309, id: 878, d: 4.42, u: 4.76, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB3 -   THR53   HA    d: 4.44 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 310, id: 879, d: 2.87, u: 3.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53 HG21 -   THR53   HA    d: 2.91 +/- 0.26, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 311, id: 880, d: 2.82, u: 3.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HB2 -   GLU54   HA    d: 2.60 +/- 0.29, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 312, id: 881, d: 2.57, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HB3 -   GLU54   HA    d: 2.66 +/- 0.28, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 313, id: 882, d: 3.01, u: 3.38, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128  HB2 -  LEU128   HA    d: 2.99 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 314, id: 883, d: 2.28, u: 3.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO130  HB3 -  PRO130   HA    d: 2.29 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 315, id: 884, d: 4.35, u: 4.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU128  HB2 -  PRO111  HB3    d: 5.35 +/- 0.32, weight: 0.4

     LEU126   HG -  GLN122  HG2    d: 5.10 +/- 0.81, weight: 0.5

ref_spec: d2o-noesy, ref_peak: 316, id: 885, d: 5.48, u: 5.45, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG44  HG3 -  GLN122  HG3    d: 7.62 +/- 2.17, weight: 0.2

     LEU126   HG -  GLN122  HG3    d: 5.97 +/- 0.29, weight: 0.8

ref_spec: d2o-noesy, ref_peak: 317, id: 886, d: 2.19, u: 4.92, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128  HB2 -  LEU125   HA    d: 2.93 +/- 1.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 318, id: 887, d: 3.14, u: 3.66, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41  HB1 -   PHE38   HA    d: 3.19 +/- 0.05, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 319, id: 888, d: 2.95, u: 3.39, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HG2 -   ARG50   HA    d: 2.74 +/- 0.30, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 321, id: 890, d: 3.65, u: 4.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL43 HG11 -   GLY47  HA2    d: 3.97 +/- 0.98, weight: 0.9
      VAL43 HG12 -   GLY47  HA2
      VAL43 HG13 -   GLY47  HA2

ref_spec: d2o-noesy, ref_peak: 322, id: 891, d: 3.72, u: 4.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL39 HG11 -   HIS36   HA    d: 4.06 +/- 0.48, weight: 1.0
      VAL39 HG12 -   HIS36   HA
      VAL39 HG13 -   HIS36   HA

ref_spec: d2o-noesy, ref_peak: 323, id: 892, d: 3.15, u: 3.20, u_viol: 0.30, %_viol: 25.0, viol: no, reliable: no, a_type: S
      ARG40  HB2 -   HIS37   HA    d: 3.20 +/- 0.43, weight: 1.0
      ARG40  HB3 -   HIS37   HA

ref_spec: d2o-noesy, ref_peak: 324, id: 893, d: 2.85, u: 3.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB2 -   ARG30   HA    d: 2.84 +/- 0.16, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 325, id: 894, d: 3.24, u: 3.47, u_viol: 0.17, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -   ARG30   HA    d: 3.41 +/- 0.31, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 326, id: 895, d: 4.91, u: 5.15, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   MET29   HA    d: 4.53 +/- 0.53, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 327, id: 896, d: 4.76, u: 5.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53 HG21 -   SER52   HA    d: 4.70 +/- 0.74, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 329, id: 898, d: 4.24, u: 5.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53 HG21 -   SER52  HB2    d: 4.57 +/- 0.78, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 330, id: 899, d: 6.32, u: 6.65, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   MET29  HB3    d: 6.00 +/- 0.58, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 331, id: 900, d: 4.32, u: 4.66, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   GLU28  HB3    d: 4.33 +/- 0.53, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 332, id: 901, d: 4.47, u: 4.68, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -   ALA41  HB1    d: 4.68 +/- 0.49, weight: 0.9
      VAL45 HG22 -   ALA41  HB1
      VAL45 HG23 -   ALA41  HB1

ref_spec: d2o-noesy, ref_peak: 333, id: 902, d: 2.38, u: 3.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38  HB2 -   PHE38   HA    d: 2.36 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 334, id: 903, d: 3.94, u: 4.81, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HG -   PHE38   HA    d: 3.86 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 335, id: 904, d: 2.96, u: 3.70, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS120  HB2 -  CYS120   HA    d: 2.88 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 336, id: 905, d: 2.44, u: 4.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS120  HB3 -  CYS120   HA    d: 2.35 +/- 0.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 337, id: 906, d: 4.27, u: 5.96, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HD2 -  CYS120   HA    d: 4.39 +/- 1.41, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 338, id: 907, d: 3.21, u: 6.42, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HD3 -  CYS120   HA    d: 3.63 +/- 1.64, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 339, id: 908, d: 2.53, u: 3.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA2 -   LYS32   HA    d: 2.65 +/- 0.14, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 340, id: 909, d: 1.76, u: 2.69, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA3 -  GLY119  HA2    d: 1.76 +/- 0.00, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 341, id: 910, d: 2.53, u: 3.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB3 -  ASN110   HA    d: 2.54 +/- 0.14, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 342, id: 911, d: 3.87, u: 4.76, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD2 -   ALA41   HA    d: 4.23 +/- 0.62, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 343, id: 912, d: 4.55, u: 4.54, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD3 -   ALA41   HA    d: 4.57 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 344, id: 913, d: 4.14, u: 4.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      HIS37  HB2 -   PHE38   HA    d: 4.72 +/- 0.23, weight: 0.5

     CYS115  HB3 -   PHE38   HA    d: 4.63 +/- 0.12, weight: 0.5

ref_spec: d2o-noesy, ref_peak: 346, id: 915, d: 2.43, u: 3.03, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR114  HB2 -  TYR114   HA    d: 2.42 +/- 0.03, weight: 1.0
     TYR114  HB3 -  TYR114   HA

ref_spec: d2o-noesy, ref_peak: 348, id: 917, d: 2.41, u: 3.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109   HB -  THR109   HA    d: 2.29 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 349, id: 918, d: 2.27, u: 2.82, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127   HA -  THR127   HB    d: 2.32 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 350, id: 919, d: 4.54, u: 6.05, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117   HA -  SER118   HA    d: 4.55 +/- 0.02, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 351, id: 920, d: 3.75, u: 4.34, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38   HA -   LEU33   HA    d: 3.79 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 352, id: 921, d: 4.77, u: 4.62, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38  HB3 -   LEU33   HA    d: 4.85 +/- 0.07, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 353, id: 922, d: 4.56, u: 5.66, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -   GLU31   HA    d: 4.53 +/- 0.13, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 354, id: 923, d: 4.68, u: 5.91, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -   MET29   HA    d: 4.54 +/- 0.32, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 355, id: 924, d: 3.44, u: 3.70, u_viol: 0.22, %_viol: 5.0, viol: no, reliable: no, a_type: M
     PRO130  HD2 -  CYS129   HA    d: 3.66 +/- 0.36, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 356, id: 925, d: 4.10, u: 3.92, u_viol: 0.30, %_viol: 50.0, viol: no, reliable: no, a_type: M
      ARG40  HD2 -   ARG40   HA    d: 3.85 +/- 0.69, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 357, id: 926, d: 3.82, u: 3.64, u_viol: 0.18, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HB3 -   PRO49  HD2    d: 3.85 +/- 0.04, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 358, id: 927, d: 3.97, u: 4.69, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HG -  CYS115  HB2    d: 4.09 +/- 0.16, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 359, id: 928, d: 4.35, u: 4.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU128 HD21 -  PRO111   HA    d: 5.44 +/- 1.08, weight: 0.4
     LEU128 HD22 -  PRO111   HA
     LEU128 HD23 -  PRO111   HA

     LEU128 HD21 -  THR127   HA    d: 6.33 +/- 0.32, weight: 0.2
     LEU128 HD22 -  THR127   HA
     LEU128 HD23 -  THR127   HA

     ALA112  HB1 -  PRO111   HA    d: 5.45 +/- 0.38, weight: 0.4
     ALA112  HB2 -  PRO111   HA
     ALA112  HB3 -  PRO111   HA

ref_spec: d2o-noesy, ref_peak: 361, id: 930, d: 2.00, u: 3.09, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG44  HG3 -   ALA41   HA    d: 2.17 +/- 0.24, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 362, id: 931, d: 3.29, u: 4.00, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HD2 -  ARG113   HA    d: 3.02 +/- 0.56, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 363, id: 932, d: 3.32, u: 5.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HB3 -  CYS116   HA    d: 3.01 +/- 0.51, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 364, id: 933, d: 4.53, u: 5.03, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HG -   GLU31  HG2    d: 4.37 +/- 0.52, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 365, id: 934, d: 5.27, u: 5.38, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HG2 -  CYS116   HA    d: 4.96 +/- 0.48, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 366, id: 935, d: 3.36, u: 4.18, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG2 -  GLY119  HA2    d: 3.47 +/- 0.23, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 367, id: 936, d: 2.99, u: 3.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG2 -   LYS32  HB2    d: 3.00 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 368, id: 937, d: 4.09, u: 4.14, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HG -  GLY119  HA2    d: 4.22 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 369, id: 938, d: 2.43, u: 3.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128  HB3 -  LEU128   HA    d: 2.38 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 370, id: 939, d: 4.96, u: 5.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB2 -  THR127   HA    d: 4.89 +/- 0.22, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 371, id: 940, d: 4.14, u: 5.25, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB3 -  THR127   HA    d: 4.23 +/- 0.20, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 372, id: 941, d: 3.98, u: 5.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG30  HB2 -   MET29   HA    d: 4.29 +/- 0.29, weight: 0.8

ref_spec: d2o-noesy, ref_peak: 373, id: 942, d: 2.72, u: 3.66, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB3 -  ARG113   HA    d: 2.68 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 374, id: 943, d: 4.30, u: 5.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ALA41  HB1 -  GLN122   HA    d: 6.42 +/- 2.36, weight: 0.1
      ALA41  HB2 -  GLN122   HA
      ALA41  HB3 -  GLN122   HA

     THR127 HG21 -  GLN123   HA    d: 4.96 +/- 0.29, weight: 0.7
     THR127 HG22 -  GLN123   HA
     THR127 HG23 -  GLN123   HA

ref_spec: d2o-noesy, ref_peak: 375, id: 944, d: 3.85, u: 4.84, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45   HB -  LEU126   HA    d: 3.96 +/- 0.42, weight: 0.7

     LEU125  HB3 -  LEU126   HA    d: 4.60 +/- 0.23, weight: 0.3

ref_spec: d2o-noesy, ref_peak: 376, id: 945, d: 2.88, u: 3.47, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HG2 -   GLU54   HA    d: 3.10 +/- 0.54, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 377, id: 946, d: 3.46, u: 3.96, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HG2 -   GLU28   HA    d: 3.37 +/- 0.31, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 378, id: 947, d: 4.44, u: 4.33, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG3 -  GLY119  HA2    d: 4.49 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 379, id: 948, d: 3.13, u: 3.57, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45 HG11 -  LEU125  HB3    d: 3.39 +/- 0.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 380, id: 949, d: 3.64, u: 5.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG40  HG2 -   HIS37   HA    d: 3.47 +/- 1.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 381, id: 950, d: 3.47, u: 3.34, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB3 -  TYR114   HA    d: 3.50 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 382, id: 951, d: 3.83, u: 4.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   HIS37  HB2    d: 3.85 +/- 0.28, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 383, id: 952, d: 2.98, u: 3.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HB3 -   PRO49  HD3    d: 3.12 +/- 0.28, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 384, id: 953, d: 3.83, u: 4.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO130  HB3 -  PRO130  HD3    d: 3.67 +/- 0.32, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 385, id: 954, d: 2.96, u: 3.66, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: A
     CYS129  HB2 -  PRO130  HD2    d: 3.89 +/- 1.14, weight: 0.5

     TYR131  HB2 -  PRO130  HD2    d: 3.96 +/- 0.59, weight: 0.5

ref_spec: d2o-noesy, ref_peak: 386, id: 955, d: 4.29, u: 5.08, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      PHE38  HB3 -   CYS34   HA    d: 4.54 +/- 0.18, weight: 0.7

     ARG113  HD2 -   CYS34   HA    d: 6.01 +/- 0.77, weight: 0.1

ref_spec: d2o-noesy, ref_peak: 387, id: 956, d: 4.07, u: 6.02, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      LYS32  HE2 -  CYS116   HA    d: 4.58 +/- 0.51, weight: 0.5

     CYS115  HB2 -  CYS116   HA    d: 4.65 +/- 0.28, weight: 0.5

ref_spec: d2o-noesy, ref_peak: 388, id: 957, d: 4.08, u: 5.27, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG44  HB2 -   VAL45   HA    d: 4.33 +/- 0.39, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 389, id: 958, d: 2.03, u: 4.25, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33  HB2 -  CYS115  HB3    d: 1.93 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 390, id: 959, d: 3.68, u: 3.31, u_viol: 0.37, %_viol: 20.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   GLU31  HB2    d: 3.93 +/- 0.81, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 391, id: 960, d: 2.91, u: 5.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU42   HG -  LEU128  HB2    d: 3.61 +/- 1.32, weight: 0.9

ref_spec: d2o-noesy, ref_peak: 393, id: 962, d: 3.72, u: 3.73, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ALA41  HB1 -   LEU33  HB3    d: 4.65 +/- 0.11, weight: 0.3
      ALA41  HB2 -   LEU33  HB3
      ALA41  HB3 -   LEU33  HB3

      ALA41  HB1 -   ARG44  HB2    d: 4.26 +/- 0.19, weight: 0.4
      ALA41  HB2 -   ARG44  HB2
      ALA41  HB3 -   ARG44  HB2

      ALA41  HB1 -  LEU125   HG    d: 4.86 +/- 0.14, weight: 0.2
      ALA41  HB2 -  LEU125   HG
      ALA41  HB3 -  LEU125   HG

ref_spec: d2o-noesy, ref_peak: 394, id: 963, d: 4.60, u: 4.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HG -   VAL39   HA    d: 4.54 +/- 0.25, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 395, id: 964, d: 4.83, u: 5.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     ASN110  HB2 -  THR109   HB    d: 5.07 +/- 0.84, weight: 0.6

     ASN110  HB2 -  PRO111   HA    d: 5.41 +/- 0.23, weight: 0.4

ref_spec: d2o-noesy, ref_peak: 396, id: 965, d: 5.21, u: 5.13, u_viol: 0.38, %_viol: 35.0, viol: no, reliable: no, a_type: A
     LEU125 HD11 -  GLN122  HB3    d: 5.71 +/- 1.27, weight: 1.0
     LEU125 HD12 -  GLN122  HB3
     LEU125 HD13 -  GLN122  HB3

ref_spec: d2o-noesy, ref_peak: 397, id: 966, d: 4.59, u: 5.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD21 -  LEU128  HB2    d: 5.06 +/- 1.15, weight: 1.0
     LEU125 HD22 -  LEU128  HB2
     LEU125 HD23 -  LEU128  HB2

ref_spec: d2o-noesy, ref_peak: 398, id: 967, d: 2.40, u: 4.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     ARG113  HG2 -  ARG113   HA    d: 3.31 +/- 0.50, weight: 0.2

     ARG113  HG3 -  ARG113   HA    d: 2.73 +/- 0.62, weight: 0.8

ref_spec: d2o-noesy, ref_peak: 399, id: 968, d: 3.42, u: 3.41, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB3 -   CYS34   HA    d: 3.35 +/- 0.18, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 400, id: 969, d: 2.00, u: 4.03, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB2 -  TYR114   HA    d: 2.08 +/- 0.20, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 401, id: 970, d: 5.53, u: 5.33, u_viol: 0.20, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46  HB2 -   VAL43   HA    d: 5.07 +/- 0.88, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 402, id: 971, d: 4.33, u: 4.83, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46  HB3 -   VAL43   HA    d: 4.54 +/- 0.38, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 404, id: 973, d: 5.93, u: 5.97, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   GLU28  HG2    d: 5.96 +/- 0.26, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 405, id: 974, d: 5.31, u: 6.20, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   GLU28  HG3    d: 5.36 +/- 0.67, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 406, id: 975, d: 2.66, u: 2.72, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU117 HD11 -  LEU117  HB2    d: 2.79 +/- 0.03, weight: 0.9
     LEU117 HD12 -  LEU117  HB2
     LEU117 HD13 -  LEU117  HB2

ref_spec: d2o-noesy, ref_peak: 407, id: 976, d: 2.28, u: 2.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU117 HD11 -  LEU117   HG    d: 2.55 +/- 0.00, weight: 0.5
     LEU117 HD12 -  LEU117   HG
     LEU117 HD13 -  LEU117   HG

     LEU117 HD21 -  LEU117   HG    d: 2.56 +/- 0.00, weight: 0.5
     LEU117 HD22 -  LEU117   HG
     LEU117 HD23 -  LEU117   HG

ref_spec: d2o-noesy, ref_peak: 408, id: 977, d: 4.98, u: 5.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA3 -   GLU31   HA    d: 4.99 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 409, id: 978, d: 5.06, u: 4.98, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41  HB1 -   HIS37  HB3    d: 5.09 +/- 0.06, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 410, id: 979, d: 5.02, u: 5.65, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB2 -  ASN110   HA    d: 5.24 +/- 0.18, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 411, id: 980, d: 5.08, u: 5.17, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111  HB3 -  ASN110   HA    d: 5.07 +/- 0.15, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 412, id: 981, d: 3.17, u: 3.65, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HB3 -  PRO111  HD2    d: 3.22 +/- 0.04, weight: 1.0
     PRO111  HB3 -  PRO111  HD3

ref_spec: d2o-noesy, ref_peak: 413, id: 982, d: 2.22, u: 2.74, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     PRO111  HG2 -  PRO111  HD2    d: 2.51 +/- 0.01, weight: 0.5
     PRO111  HG2 -  PRO111  HD3

     PRO111  HG3 -  PRO111  HD2    d: 2.46 +/- 0.00, weight: 0.5
     PRO111  HG3 -  PRO111  HD3

ref_spec: d2o-noesy, ref_peak: 414, id: 983, d: 3.02, u: 3.66, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB3 -   LEU42   HG    d: 3.02 +/- 0.01, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 415, id: 984, d: 3.03, u: 4.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG40  HB2 -   ARG40  HD3    d: 3.11 +/- 0.54, weight: 1.0
      ARG40  HB3 -   ARG40  HD3

ref_spec: d2o-noesy, ref_peak: 416, id: 985, d: 2.39, u: 3.02, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40  HG2 -   ARG40  HD3    d: 2.39 +/- 0.17, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 417, id: 986, d: 4.55, u: 5.07, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG40  HD3 -   ARG40   HA    d: 4.56 +/- 0.53, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 418, id: 987, d: 3.40, u: 3.62, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: A
     CYS120  HB2 -  ASP124  HB3    d: 3.56 +/- 0.38, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 419, id: 988, d: 3.53, u: 3.35, u_viol: 0.18, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD21 -  LEU125  HB2    d: 3.57 +/- 0.10, weight: 1.0
     LEU125 HD22 -  LEU125  HB2
     LEU125 HD23 -  LEU125  HB2

ref_spec: d2o-noesy, ref_peak: 420, id: 989, d: 2.49, u: 3.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HG -  LEU125   HA    d: 2.57 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 421, id: 990, d: 4.16, u: 4.18, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: A
     CYS120  HB2 -  ASP124  HB2    d: 3.75 +/- 0.68, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 422, id: 991, d: 3.26, u: 4.08, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HG -  ASP124  HB3    d: 3.77 +/- 0.49, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 423, id: 992, d: 4.71, u: 5.72, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   PRO49  HD2    d: 5.17 +/- 0.54, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 424, id: 993, d: 5.80, u: 5.66, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   PRO49  HD3    d: 5.85 +/- 0.11, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 425, id: 994, d: 6.04, u: 6.25, u_viol: 0.21, %_viol: 10.0, viol: no, reliable: no, a_type: A
     ALA108  HB1 -  ASN110   HA    d: 6.25 +/- 0.80, weight: 0.9
     ALA108  HB2 -  ASN110   HA
     ALA108  HB3 -  ASN110   HA

ref_spec: d2o-noesy, ref_peak: 426, id: 995, d: 2.40, u: 3.73, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33  HB2 -   PHE38  HB2    d: 2.42 +/- 0.09, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 427, id: 996, d: 3.25, u: 4.15, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40  HD3 -   HIS37   HA    d: 2.75 +/- 0.89, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 428, id: 997, d: 3.39, u: 3.52, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40  HD2 -   HIS37   HA    d: 3.25 +/- 0.45, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 429, id: 998, d: 2.98, u: 2.95, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HB2 -  GLN123   HA    d: 2.93 +/- 0.11, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 430, id: 999, d: 2.75, u: 4.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HG -  CYS120  HB2    d: 2.56 +/- 0.53, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 431, id: 1000, d: 2.70, u: 4.58, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG2 -  GLN122   HA    d: 2.73 +/- 0.46, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 432, id: 1001, d: 4.61, u: 5.42, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB3 -   VAL45   HA    d: 4.70 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 433, id: 1002, d: 3.37, u: 5.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -   CYS46  HB3    d: 3.37 +/- 0.38, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 434, id: 1003, d: 5.03, u: 4.76, u_viol: 0.27, %_viol: 20.0, viol: no, reliable: no, a_type: M
      ALA41  HB1 -  LEU125  HB2    d: 5.37 +/- 0.57, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 435, id: 1004, d: 4.08, u: 4.53, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -   VAL43   HA    d: 4.21 +/- 0.27, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 436, id: 1005, d: 6.33, u: 8.28, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HG -   VAL43   HA    d: 6.30 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 437, id: 1006, d: 3.57, u: 3.88, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: A
     ARG113  HB3 -  ASN110  HB2    d: 3.95 +/- 0.03, weight: 0.9

ref_spec: d2o-noesy, ref_peak: 438, id: 1007, d: 4.76, u: 4.62, u_viol: 0.18, %_viol: 5.0, viol: no, reliable: no, a_type: A
      ARG30  HB3 -   MET29   HA    d: 5.28 +/- 0.33, weight: 0.6

      LEU33   HG -  CYS116   HA    d: 5.68 +/- 0.29, weight: 0.4

ref_spec: d2o-noesy, ref_peak: 439, id: 1008, d: 2.92, u: 4.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45   HB -   LEU42   HA    d: 3.32 +/- 0.59, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 440, id: 1009, d: 3.50, u: 3.41, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB2 -   LEU42   HA    d: 3.85 +/- 0.79, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 441, id: 1010, d: 5.11, u: 5.82, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     ASN110  HB3 -  PRO111   HA    d: 5.30 +/- 0.39, weight: 0.7

     ASN110  HB3 -  THR109   HB    d: 6.19 +/- 0.45, weight: 0.3

ref_spec: d2o-noesy, ref_peak: 442, id: 1011, d: 5.49, u: 5.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     ASN110  HB3 -  THR109   HA    d: 6.06 +/- 0.28, weight: 0.5

     ASN110  HB3 -  TYR114   HA    d: 6.27 +/- 0.48, weight: 0.4

ref_spec: d2o-noesy, ref_peak: 443, id: 1012, d: 4.71, u: 4.63, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127 HG21 -  GLN123  HB3    d: 4.53 +/- 0.63, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 444, id: 1013, d: 3.82, u: 4.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117   HG -  CYS116  HB3    d: 3.67 +/- 0.26, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 445, id: 1014, d: 2.66, u: 3.16, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD11 -  LEU125   HG    d: 4.35 +/- 2.47, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 446, id: 1015, d: 3.46, u: 3.09, u_viol: 0.57, %_viol: 80.0, viol: yes, reliable: no, a_type: S
      VAL45 HG21 -  LEU125 HD11    d: 3.45 +/- 0.47, weight: 1.0
      VAL45 HG22 -  LEU125 HD11
      VAL45 HG23 -  LEU125 HD11

ref_spec: d2o-noesy, ref_peak: 447, id: 1016, d: 2.75, u: 2.93, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HD2 -   LYS32  HE2    d: 2.81 +/- 0.21, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 448, id: 1017, d: 2.55, u: 4.03, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HG -   LEU42   HA    d: 2.56 +/- 0.10, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 449, id: 1018, d: 1.88, u: 3.80, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125  HB3 -   LEU42   HA    d: 2.30 +/- 0.76, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 450, id: 1019, d: 4.70, u: 5.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS115  HB3 -   PHE38   HA    d: 4.63 +/- 0.12, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 451, id: 1020, d: 4.16, u: 5.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG30  HD2 -   ARG30   HA    d: 3.91 +/- 0.63, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 452, id: 1021, d: 3.42, u: 3.59, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG30  HD3 -   ARG30   HA    d: 3.07 +/- 0.85, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 453, id: 1022, d: 2.34, u: 3.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB2 -  GLN122   HA    d: 3.22 +/- 2.46, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 454, id: 1023, d: 2.46, u: 2.85, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     GLN122  HB2 -  GLN122   HA    d: 2.90 +/- 0.21, weight: 0.4

     GLN123  HB3 -  GLN123   HA    d: 2.69 +/- 0.15, weight: 0.6

ref_spec: d2o-noesy, ref_peak: 455, id: 1024, d: 5.23, u: 5.47, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: A
      LEU42   HG -   CYS46  HB2    d: 6.08 +/- 1.27, weight: 0.4

     LEU125  HB2 -   CYS46  HB2    d: 5.71 +/- 0.61, weight: 0.6

ref_spec: d2o-noesy, ref_peak: 456, id: 1025, d: 2.95, u: 3.63, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: A
     CYS129  HB3 -  PRO130  HD3    d: 3.02 +/- 1.19, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 1, id: 0, d: 2.79, u: 4.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB2 -   PHE38    H    d: 2.85 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 2, id: 1, d: 2.81, u: 4.85, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS36   HA -   VAL39    H    d: 2.88 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 3, id: 2, d: 2.57, u: 4.34, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB2 -  CYS116    H    d: 2.67 +/- 0.35, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 4, id: 3, d: 2.33, u: 4.51, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43   HA -   GLY47    H    d: 2.35 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 5, id: 4, d: 3.88, u: 3.67, u_viol: 0.23, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB3 -   TRP51    H    d: 3.82 +/- 0.20, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 6, id: 5, d: 3.87, u: 3.95, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR131  HB3 -  TYR131    H    d: 3.86 +/- 0.17, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 7, id: 6, d: 2.31, u: 3.67, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB3 -  ASN110 HD21    d: 2.40 +/- 0.48, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 8, id: 7, d: 2.56, u: 4.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB3 -  CYS116    H    d: 2.77 +/- 0.44, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 9, id: 8, d: 3.05, u: 4.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG3 -  GLN123 HE21    d: 3.32 +/- 0.26, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 10, id: 9, d: 3.00, u: 4.30, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG3 -  GLN122 HE21    d: 2.89 +/- 0.51, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 11, id: 10, d: 2.56, u: 4.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG3 -   ARG44    H    d: 2.64 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 12, id: 11, d: 3.56, u: 3.71, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB3 -  LEU125    H    d: 3.65 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 13, id: 12, d: 3.11, u: 3.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HB3 -  ASP124    H    d: 3.12 +/- 0.54, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 14, id: 13, d: 3.78, u: 4.29, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HB2 -   ALA55    H    d: 3.60 +/- 0.83, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 15, id: 14, d: 5.24, u: 5.09, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -  ASP124    H    d: 5.27 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 17, id: 16, d: 4.50, u: 4.42, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB2 -   ARG30   HE    d: 4.55 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 18, id: 17, d: 3.13, u: 4.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG40  HG2 -   ARG40   HE    d: 3.18 +/- 0.47, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 19, id: 18, d: 2.54, u: 4.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -   ARG30   HE    d: 2.55 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 20, id: 19, d: 2.62, u: 3.14, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41  HB1 -   LEU42    H    d: 2.60 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 21, id: 20, d: 3.45, u: 3.53, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB3 -  LEU126    H    d: 3.45 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 22, id: 21, d: 3.28, u: 3.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB2 -   VAL43    H    d: 3.28 +/- 0.18, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 23, id: 22, d: 3.65, u: 3.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB3 -   VAL45    H    d: 3.81 +/- 0.22, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 24, id: 23, d: 2.95, u: 4.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HB2 -   GLU54    H    d: 3.35 +/- 0.56, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 25, id: 24, d: 3.49, u: 3.75, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB2 -   SER52    H    d: 3.35 +/- 0.92, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 26, id: 25, d: 2.86, u: 3.85, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43   HA -   VAL43    H    d: 2.84 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 27, id: 26, d: 3.49, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB3 -   HIS37    H    d: 3.46 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 28, id: 27, d: 4.14, u: 4.92, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HD2 -   GLY48    H    d: 3.94 +/- 1.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 29, id: 28, d: 2.78, u: 3.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HA -  LEU125    H    d: 2.72 +/- 0.21, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 30, id: 29, d: 3.82, u: 4.02, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB3 -   SER52    H    d: 3.75 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 31, id: 30, d: 4.01, u: 4.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109    H -  ALA108    H    d: 4.45 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 32, id: 31, d: 4.93, u: 5.08, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HG2 -   LYS32    H    d: 4.84 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 33, id: 32, d: 4.68, u: 5.19, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY47  HA2 -   CYS46    H    d: 4.67 +/- 0.23, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 34, id: 33, d: 3.27, u: 5.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43   HA -   CYS46    H    d: 3.32 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 35, id: 34, d: 4.75, u: 4.96, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG3 -  GLN123    H    d: 4.80 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 36, id: 35, d: 3.18, u: 3.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     ASP124   HA -  THR127    H    d: 3.69 +/- 0.56, weight: 0.5

     THR127   HB -  THR127    H    d: 3.65 +/- 0.03, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 37, id: 36, d: 4.56, u: 4.35, u_viol: 0.21, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB2 -   GLY35    H    d: 4.58 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 38, id: 37, d: 2.80, u: 3.04, u_viol: 0.34, %_viol: 10.0, viol: no, reliable: no, a_type: M
     ALA108   HA -  THR109    H    d: 2.34 +/- 0.20, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 39, id: 38, d: 3.96, u: 3.94, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB2 -  ASN110 HD22    d: 3.89 +/- 0.21, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 40, id: 39, d: 2.30, u: 4.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG3 -   ARG44   HE    d: 2.34 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 41, id: 40, d: 2.48, u: 3.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113    H -  TYR114    H    d: 2.43 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 42, id: 41, d: 3.86, u: 5.92, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   TRP51  HE1    d: 3.54 +/- 0.73, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 43, id: 42, d: 2.60, u: 4.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG11 -   TRP51  HE1    d: 2.88 +/- 0.70, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 44, id: 43, d: 3.58, u: 4.22, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB3 -  THR121    H    d: 3.36 +/- 0.52, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 45, id: 44, d: 2.88, u: 4.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HA -  THR121    H    d: 2.89 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 46, id: 45, d: 4.57, u: 5.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124    H -  GLN122    H    d: 4.37 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 47, id: 46, d: 4.28, u: 5.65, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119    H -  CYS120    H    d: 4.35 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 48, id: 47, d: 3.82, u: 4.22, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HB3 -   LYS32    H    d: 3.90 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 49, id: 48, d: 5.04, u: 4.85, u_viol: 0.22, %_viol: 25.0, viol: no, reliable: no, a_type: S
     LEU126 HD11 -  GLN123    H    d: 5.34 +/- 0.41, weight: 0.8
     LEU126 HD12 -  GLN123    H
     LEU126 HD13 -  GLN123    H

ref_spec: h2o-noesy, ref_peak: 50, id: 49, d: 3.30, u: 5.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA107  HB1 -  ALA107    H    d: 3.01 +/- 0.48, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 51, id: 50, d: 5.01, u: 5.31, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA108  HB1 -  ASN110    H    d: 5.20 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 52, id: 51, d: 4.17, u: 4.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL43 HG21 -   GLY47    H    d: 4.69 +/- 0.17, weight: 0.7

      VAL43 HG21 -   GLY48    H    d: 5.28 +/- 0.72, weight: 0.3

ref_spec: h2o-noesy, ref_peak: 53, id: 52, d: 3.57, u: 4.55, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HB3 -   ALA55    H    d: 3.75 +/- 0.64, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 54, id: 53, d: 4.53, u: 5.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HG2 -   ALA55    H    d: 4.22 +/- 0.82, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 55, id: 54, d: 3.48, u: 4.42, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46  HB2 -   GLY47    H    d: 3.11 +/- 0.62, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 56, id: 55, d: 2.52, u: 4.72, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      HIS36  HB3 -   HIS37    H    d: 2.54 +/- 0.08, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 57, id: 56, d: 4.73, u: 5.02, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HD3 -   GLY48    H    d: 4.08 +/- 1.42, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 58, id: 57, d: 2.90, u: 5.11, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB3 -   THR53    H    d: 2.86 +/- 0.86, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 59, id: 58, d: 2.36, u: 2.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      GLY47  HA2 -   GLY47    H    d: 2.83 +/- 0.23, weight: 0.3

      GLY47  HA2 -   GLY48    H    d: 2.55 +/- 0.57, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 60, id: 59, d: 3.77, u: 4.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38   HA -   LEU42    H    d: 3.73 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 61, id: 60, d: 3.12, u: 4.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR114   HA -  LEU117    H    d: 3.11 +/- 0.51, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 62, id: 61, d: 2.87, u: 4.61, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31   HA -   GLU31    H    d: 2.89 +/- 0.07, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 63, id: 62, d: 4.43, u: 4.74, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52   HA -   GLU54    H    d: 4.42 +/- 0.33, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 64, id: 63, d: 4.74, u: 4.69, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HE3 -   TRP51    H    d: 4.89 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 65, id: 64, d: 4.59, u: 5.37, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49   HA -   TRP51    H    d: 4.77 +/- 0.66, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 66, id: 65, d: 3.77, u: 4.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40   HA -   ARG44    H    d: 3.97 +/- 0.15, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 67, id: 66, d: 2.49, u: 3.93, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB3 -  LEU125    H    d: 3.11 +/- 0.72, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 68, id: 67, d: 4.77, u: 5.44, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG2 -  ASP124    H    d: 4.73 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 69, id: 68, d: 4.74, u: 5.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG3 -  ASP124    H    d: 4.82 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 70, id: 69, d: 5.03, u: 5.12, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HG -  ASP124    H    d: 5.07 +/- 0.25, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 71, id: 70, d: 3.21, u: 4.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB2 -   TRP51    H    d: 2.74 +/- 0.87, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 72, id: 71, d: 4.37, u: 4.81, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB2 -  ASN110 HD21    d: 4.05 +/- 0.90, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 73, id: 72, d: 3.84, u: 5.53, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HG2 -   TRP51    H    d: 4.69 +/- 0.37, weight: 0.4

      ARG50  HG3 -   TRP51    H    d: 4.52 +/- 0.46, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 74, id: 73, d: 5.26, u: 5.43, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA112  HB1 -  ASN110 HD21    d: 5.45 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 75, id: 74, d: 5.53, u: 5.49, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128 HD21 -  CYS129    H    d: 5.72 +/- 0.15, weight: 0.8
     LEU128 HD22 -  CYS129    H
     LEU128 HD23 -  CYS129    H

ref_spec: h2o-noesy, ref_peak: 76, id: 75, d: 3.93, u: 5.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB3 -   ARG44   HE    d: 3.70 +/- 0.70, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 77, id: 76, d: 2.85, u: 5.10, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB3 -  ARG113    H    d: 3.04 +/- 0.72, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 78, id: 77, d: 3.12, u: 4.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS129  HB2 -  CYS129    H    d: 3.14 +/- 0.55, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 79, id: 78, d: 2.40, u: 5.09, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA3 -  GLY119    H    d: 2.43 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 80, id: 79, d: 4.53, u: 4.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123   HA -  THR127    H    d: 4.65 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 81, id: 80, d: 3.78, u: 6.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37   HA -   ALA41    H    d: 3.89 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 82, id: 81, d: 2.95, u: 4.16, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA2 -  GLY119    H    d: 2.94 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 83, id: 82, d: 3.99, u: 5.16, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110   HA -  ASN110 HD22    d: 4.15 +/- 0.50, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 84, id: 83, d: 3.85, u: 5.73, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG2 -  GLN123 HE22    d: 3.79 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 85, id: 84, d: 3.86, u: 5.53, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG3 -  GLN123 HE22    d: 3.98 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 86, id: 85, d: 2.67, u: 4.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   PHE38    H    d: 2.64 +/- 0.07, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 87, id: 86, d: 5.83, u: 6.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -  GLN122 HE22    d: 5.98 +/- 1.17, weight: 1.0
      VAL45 HG22 -  GLN122 HE22
      VAL45 HG23 -  GLN122 HE22

ref_spec: h2o-noesy, ref_peak: 88, id: 87, d: 3.72, u: 4.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG2 -  GLN122 HE22    d: 3.61 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 89, id: 88, d: 2.70, u: 2.76, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27   HA -   GLU28    H    d: 2.66 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 90, id: 89, d: 5.24, u: 5.32, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO27  HD3 -   GLU28    H    d: 5.06 +/- 0.35, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 91, id: 90, d: 2.70, u: 3.89, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28   HA -   GLU28    H    d: 2.54 +/- 0.33, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 92, id: 91, d: 2.42, u: 2.88, u_viol: 0.28, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28   HA -   MET29    H    d: 2.35 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 93, id: 92, d: 3.14, u: 3.31, u_viol: 0.23, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HB3 -   GLU28    H    d: 3.24 +/- 0.31, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 94, id: 93, d: 4.38, u: 4.19, u_viol: 0.21, %_viol: 10.0, viol: no, reliable: no, a_type: M
      GLU28  HB3 -   MET29    H    d: 4.40 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 95, id: 94, d: 2.36, u: 4.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HG2 -   GLU28    H    d: 2.38 +/- 0.45, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 96, id: 95, d: 5.07, u: 5.36, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HG2 -   MET29    H    d: 5.02 +/- 0.25, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 97, id: 96, d: 2.83, u: 3.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29   HA -   MET29    H    d: 2.89 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 98, id: 97, d: 2.55, u: 2.94, u_viol: 0.10, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29   HA -   ARG30    H    d: 2.37 +/- 0.46, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 99, id: 98, d: 2.45, u: 3.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HB2 -   MET29    H    d: 2.33 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 100, id: 99, d: 3.88, u: 3.78, u_viol: 0.12, %_viol: 10.0, viol: no, reliable: no, a_type: M
      MET29  HB3 -   ARG30    H    d: 3.91 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 101, id: 100, d: 4.34, u: 4.72, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HG3 -   MET29    H    d: 4.34 +/- 0.34, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 102, id: 101, d: 2.57, u: 3.72, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -   ARG30    H    d: 2.69 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 103, id: 102, d: 2.43, u: 2.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -   GLU31    H    d: 2.50 +/- 0.34, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 104, id: 103, d: 3.59, u: 3.63, u_viol: 0.14, %_viol: 5.0, viol: no, reliable: no, a_type: M
      ARG30  HB3 -   ARG30    H    d: 3.50 +/- 0.27, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 105, id: 104, d: 4.34, u: 4.59, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB3 -   ARG30   HE    d: 4.37 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 106, id: 105, d: 2.82, u: 5.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HD2 -   ARG30   HE    d: 2.83 +/- 0.07, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 107, id: 106, d: 3.75, u: 4.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG3 -   ARG30    H    d: 3.69 +/- 0.73, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 108, id: 107, d: 2.16, u: 2.85, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31   HA -   LYS32    H    d: 2.16 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 109, id: 108, d: 3.20, u: 4.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HB2 -   LYS32    H    d: 3.32 +/- 0.57, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 110, id: 109, d: 3.13, u: 5.33, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HB3 -   GLU31    H    d: 2.89 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 111, id: 110, d: 4.16, u: 4.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HG3 -   LYS32    H    d: 3.98 +/- 0.85, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 112, id: 111, d: 2.81, u: 4.02, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32   HA -   LYS32    H    d: 2.82 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 113, id: 112, d: 2.10, u: 3.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32   HA -   LEU33    H    d: 2.11 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 114, id: 113, d: 2.58, u: 3.84, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB2 -   LYS32    H    d: 2.59 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 115, id: 114, d: 3.64, u: 4.38, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LYS32  HD2 -   LYS32    H    d: 4.31 +/- 0.05, weight: 0.4

      LYS32  HD3 -   LYS32    H    d: 4.22 +/- 0.21, weight: 0.4

      LEU33   HG -   LYS32    H    d: 4.83 +/- 0.16, weight: 0.2

ref_spec: h2o-noesy, ref_peak: 116, id: 115, d: 2.84, u: 3.92, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG2 -   LYS32    H    d: 2.88 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 117, id: 116, d: 2.91, u: 3.80, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HA -   LEU33    H    d: 2.92 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 118, id: 117, d: 2.17, u: 3.10, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HA -   CYS34    H    d: 2.15 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 119, id: 118, d: 2.55, u: 2.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB2 -   LEU33    H    d: 2.52 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 120, id: 119, d: 3.58, u: 3.61, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   LEU33    H    d: 3.59 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 121, id: 120, d: 4.45, u: 4.24, u_viol: 0.21, %_viol: 5.0, viol: no, reliable: no, a_type: M
      LEU33 HD11 -   ALA41    H    d: 4.49 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 122, id: 121, d: 4.80, u: 4.80, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   ALA41    H    d: 4.85 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 123, id: 122, d: 2.93, u: 4.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34   HA -   CYS34    H    d: 2.93 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 124, id: 123, d: 2.29, u: 3.58, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34   HA -   GLY35    H    d: 2.28 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 125, id: 124, d: 2.48, u: 3.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB2 -   CYS34    H    d: 2.45 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 126, id: 125, d: 2.85, u: 3.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY35  HA2 -   GLY35    H    d: 2.84 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 127, id: 126, d: 3.99, u: 5.64, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS36   HA -   ARG40    H    d: 4.10 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 128, id: 127, d: 3.73, u: 5.09, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HD2 -   HIS37    H    d: 3.67 +/- 0.72, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 129, id: 128, d: 3.44, u: 4.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37   HA -   PHE38    H    d: 3.45 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 130, id: 129, d: 3.30, u: 3.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37   HA -   ARG40    H    d: 3.26 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 131, id: 130, d: 2.05, u: 3.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB2 -   CYS34    H    d: 2.02 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 132, id: 131, d: 2.22, u: 3.72, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB2 -   HIS37    H    d: 2.22 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 133, id: 132, d: 3.11, u: 4.49, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB3 -   PHE38    H    d: 3.10 +/- 0.29, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 134, id: 133, d: 2.79, u: 3.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38   HA -   PHE38    H    d: 2.79 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 135, id: 134, d: 3.91, u: 4.29, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38   HA -   ALA41    H    d: 3.88 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 136, id: 135, d: 2.31, u: 3.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38  HB3 -   PHE38    H    d: 2.30 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 137, id: 136, d: 2.51, u: 3.89, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38    H -   HIS37    H    d: 2.52 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 138, id: 137, d: 2.04, u: 3.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL39   HB -   VAL39    H    d: 2.18 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 139, id: 138, d: 2.95, u: 3.74, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39   HB -   ARG40    H    d: 2.81 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 140, id: 139, d: 2.45, u: 3.27, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL39 HG11 -   ARG40    H    d: 2.77 +/- 0.47, weight: 1.0
      VAL39 HG12 -   ARG40    H
      VAL39 HG13 -   ARG40    H

ref_spec: h2o-noesy, ref_peak: 141, id: 140, d: 2.66, u: 3.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39    H -   ARG40    H    d: 2.68 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 142, id: 141, d: 2.74, u: 3.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40   HA -   ARG40    H    d: 2.74 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 143, id: 142, d: 3.61, u: 4.22, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40   HA -   ALA41    H    d: 3.61 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 144, id: 143, d: 3.45, u: 4.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40   HA -   VAL43    H    d: 3.58 +/- 0.20, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 145, id: 144, d: 2.67, u: 2.94, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG40  HB2 -   ARG40    H    d: 2.65 +/- 0.20, weight: 1.0
      ARG40  HB3 -   ARG40    H

ref_spec: h2o-noesy, ref_peak: 146, id: 145, d: 2.73, u: 3.03, u_viol: 0.59, %_viol: 25.0, viol: no, reliable: no, a_type: S
      ARG40  HB2 -   ALA41    H    d: 2.84 +/- 0.56, weight: 1.0
      ARG40  HB3 -   ALA41    H

ref_spec: h2o-noesy, ref_peak: 147, id: 146, d: 3.17, u: 3.64, u_viol: 0.20, %_viol: 5.0, viol: no, reliable: no, a_type: M
      ARG40  HG2 -   ARG40    H    d: 3.31 +/- 0.66, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 148, id: 147, d: 2.76, u: 3.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41   HA -   ALA41    H    d: 2.78 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 149, id: 148, d: 3.59, u: 4.59, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41   HA -   LEU42    H    d: 3.58 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 150, id: 149, d: 3.44, u: 3.66, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41   HA -   ARG44    H    d: 3.26 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 151, id: 150, d: 2.68, u: 2.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41  HB1 -   ALA41    H    d: 2.55 +/- 0.23, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 152, id: 151, d: 3.11, u: 3.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA41    H -   ARG40    H    d: 3.10 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 153, id: 152, d: 2.14, u: 3.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ALA41    H -   LEU42    H    d: 2.80 +/- 0.07, weight: 0.2

     ARG113    H -  ALA112    H    d: 2.42 +/- 0.35, weight: 0.5

     THR127    H -  LEU126    H    d: 2.60 +/- 0.08, weight: 0.3

ref_spec: h2o-noesy, ref_peak: 154, id: 153, d: 2.76, u: 3.59, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HA -   LEU42    H    d: 2.73 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 155, id: 154, d: 3.50, u: 4.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HA -   VAL43    H    d: 3.49 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 156, id: 155, d: 4.02, u: 4.15, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HA -   VAL45    H    d: 4.02 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 157, id: 156, d: 3.93, u: 5.35, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HA -   CYS46    H    d: 4.03 +/- 0.32, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 158, id: 157, d: 2.71, u: 4.84, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB3 -   VAL43    H    d: 2.65 +/- 0.29, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 159, id: 158, d: 3.46, u: 3.40, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33 HD21 -   LEU33    H    d: 3.50 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 160, id: 159, d: 3.54, u: 4.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43   HA -   ARG44    H    d: 3.53 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 161, id: 160, d: 3.01, u: 3.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43   HB -   VAL43    H    d: 2.89 +/- 0.23, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 162, id: 161, d: 2.10, u: 3.12, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43   HB -   ARG44    H    d: 2.12 +/- 0.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 163, id: 162, d: 2.12, u: 3.44, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL43 HG21 -   VAL43    H    d: 2.28 +/- 0.29, weight: 1.0
      VAL43 HG22 -   VAL43    H
      VAL43 HG23 -   VAL43    H

ref_spec: h2o-noesy, ref_peak: 165, id: 164, d: 4.13, u: 4.03, u_viol: 0.10, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   ARG44    H    d: 4.21 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 166, id: 165, d: 2.77, u: 3.16, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43    H -   LEU42    H    d: 2.84 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 167, id: 166, d: 2.66, u: 3.85, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44   HA -   ARG44    H    d: 2.67 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 168, id: 167, d: 3.45, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44   HA -   VAL45    H    d: 3.44 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 169, id: 168, d: 2.79, u: 3.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB2 -   ARG44    H    d: 2.64 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 170, id: 169, d: 2.43, u: 3.60, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB2 -   VAL45    H    d: 2.72 +/- 0.40, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 171, id: 170, d: 2.08, u: 4.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG2 -   ARG44    H    d: 2.11 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 172, id: 171, d: 3.33, u: 3.39, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB3 -  ARG113    H    d: 3.44 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 173, id: 172, d: 2.84, u: 3.49, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45   HA -   VAL45    H    d: 2.87 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 174, id: 173, d: 2.39, u: 3.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45   HB -   VAL45    H    d: 2.63 +/- 0.40, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 175, id: 174, d: 1.98, u: 3.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45   HB -   CYS46    H    d: 2.41 +/- 0.68, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 176, id: 175, d: 2.73, u: 3.08, u_viol: 0.31, %_viol: 5.0, viol: no, reliable: no, a_type: A
      LYS32  HG2 -   LEU33    H    d: 4.65 +/- 0.06, weight: 0.1

     ALA112  HB1 -  ALA112    H    d: 3.23 +/- 0.41, weight: 0.8
     ALA112  HB2 -  ALA112    H
     ALA112  HB3 -  ALA112    H

ref_spec: h2o-noesy, ref_peak: 177, id: 176, d: 4.27, u: 4.17, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -   CYS46    H    d: 4.29 +/- 0.13, weight: 1.0
      VAL45 HG22 -   CYS46    H
      VAL45 HG23 -   CYS46    H

ref_spec: h2o-noesy, ref_peak: 179, id: 178, d: 3.44, u: 4.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG11 -   CYS46    H    d: 3.96 +/- 0.81, weight: 1.0
      VAL45 HG12 -   CYS46    H
      VAL45 HG13 -   CYS46    H

ref_spec: h2o-noesy, ref_peak: 180, id: 179, d: 2.72, u: 3.60, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45    H -   CYS46    H    d: 2.48 +/- 0.36, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 181, id: 180, d: 2.95, u: 4.70, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46   HA -   CYS46    H    d: 2.94 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 182, id: 181, d: 3.49, u: 4.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      CYS46   HA -   GLY47    H    d: 3.53 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 183, id: 182, d: 2.88, u: 3.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46  HB2 -   CYS46    H    d: 2.82 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 184, id: 183, d: 2.14, u: 4.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46  HB3 -   GLY47    H    d: 2.33 +/- 0.55, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 185, id: 184, d: 2.40, u: 3.00, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      GLY47  HA3 -   GLY47    H    d: 2.63 +/- 0.17, weight: 0.7

      GLY47  HA3 -   GLY48    H    d: 3.07 +/- 0.58, weight: 0.3

ref_spec: h2o-noesy, ref_peak: 186, id: 185, d: 2.15, u: 3.61, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      GLY47    H -   CYS46    H    d: 2.27 +/- 0.17, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 187, id: 186, d: 2.72, u: 3.38, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY48  HA2 -   GLY48    H    d: 2.73 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 188, id: 187, d: 3.01, u: 3.47, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49   HA -   ARG50    H    d: 2.78 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 189, id: 188, d: 3.90, u: 5.10, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HD2 -   ARG50    H    d: 3.88 +/- 0.95, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 190, id: 189, d: 2.54, u: 3.71, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50   HA -   ARG50    H    d: 2.43 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 191, id: 190, d: 3.27, u: 3.45, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB2 -   ARG50    H    d: 3.30 +/- 0.47, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 192, id: 191, d: 3.30, u: 4.69, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB2 -   ARG50   HE    d: 3.15 +/- 0.86, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 193, id: 192, d: 3.71, u: 4.65, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB3 -   TRP51    H    d: 3.49 +/- 0.69, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 194, id: 193, d: 2.46, u: 3.92, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HD2 -   ARG50   HE    d: 2.80 +/- 0.14, weight: 0.5

      ARG50  HD3 -   ARG50   HE    d: 2.75 +/- 0.12, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 195, id: 194, d: 2.98, u: 3.82, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HG2 -   ARG50    H    d: 3.30 +/- 0.64, weight: 0.5

      ARG50  HG3 -   ARG50    H    d: 3.31 +/- 0.72, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 196, id: 195, d: 2.57, u: 3.19, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HD1 -   TRP51  HE1    d: 2.57 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 197, id: 196, d: 3.27, u: 4.58, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HD1 -   TRP51    H    d: 2.99 +/- 0.46, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 198, id: 197, d: 2.84, u: 3.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HZ2 -   TRP51  HE1    d: 2.84 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 199, id: 198, d: 2.27, u: 3.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51   HA -   TRP51    H    d: 2.35 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 200, id: 199, d: 3.08, u: 3.51, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51   HA -   SER52    H    d: 3.06 +/- 0.49, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 201, id: 200, d: 3.58, u: 3.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB2 -   TRP51    H    d: 3.51 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 202, id: 201, d: 2.73, u: 3.36, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52   HA -   THR53    H    d: 3.04 +/- 0.54, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 203, id: 202, d: 2.85, u: 3.43, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB2 -   SER52    H    d: 2.72 +/- 0.21, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 204, id: 203, d: 3.25, u: 4.18, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52  HB2 -   THR53    H    d: 2.88 +/- 1.00, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 205, id: 204, d: 3.07, u: 3.69, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52    H -   TRP51    H    d: 3.27 +/- 0.49, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 206, id: 205, d: 2.67, u: 3.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53   HA -   THR53    H    d: 2.71 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 207, id: 206, d: 3.88, u: 4.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53   HB -   THR53    H    d: 3.83 +/- 0.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 208, id: 207, d: 3.46, u: 3.85, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53   HB -   GLU54    H    d: 3.40 +/- 0.53, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 209, id: 208, d: 3.14, u: 4.16, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53 HG21 -   THR53    H    d: 3.02 +/- 0.49, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 210, id: 209, d: 2.51, u: 3.26, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54   HA -   ALA55    H    d: 2.52 +/- 0.52, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 211, id: 210, d: 3.57, u: 3.60, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HB3 -   GLU54    H    d: 3.43 +/- 0.32, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 212, id: 211, d: 3.16, u: 4.24, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54  HG2 -   GLU54    H    d: 3.61 +/- 0.84, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 213, id: 212, d: 3.05, u: 3.95, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU54    H -   THR53    H    d: 2.79 +/- 0.86, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 214, id: 213, d: 2.72, u: 3.90, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA55   HA -   ALA55    H    d: 2.69 +/- 0.29, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 215, id: 214, d: 3.21, u: 3.59, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA55  HB1 -   ALA55    H    d: 3.10 +/- 0.35, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 216, id: 215, d: 3.85, u: 4.29, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ALA55    H -   GLU54    H    d: 3.59 +/- 1.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 217, id: 216, d: 2.67, u: 3.40, u_viol: 0.10, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA107   HA -  ALA108    H    d: 2.19 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 218, id: 217, d: 2.94, u: 3.91, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA108   HA -  ALA108    H    d: 2.94 +/- 0.00, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 219, id: 218, d: 3.02, u: 3.20, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA108  HB1 -  ALA108    H    d: 3.01 +/- 0.27, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 220, id: 219, d: 2.57, u: 3.90, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA108  HB1 -  THR109    H    d: 3.36 +/- 0.61, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 221, id: 220, d: 2.78, u: 3.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109   HA -  THR109    H    d: 2.70 +/- 0.29, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 222, id: 221, d: 3.14, u: 3.37, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109   HA -  ASN110    H    d: 3.32 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 223, id: 222, d: 3.00, u: 3.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109   HB -  THR109    H    d: 3.26 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 224, id: 223, d: 3.57, u: 4.38, u_viol: 0.16, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109   HB -  ASN110    H    d: 3.24 +/- 0.35, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 225, id: 224, d: 2.37, u: 3.85, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109 HG21 -  THR109    H    d: 2.32 +/- 0.54, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 226, id: 225, d: 2.99, u: 4.36, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109 HG21 -  ASN110    H    d: 2.86 +/- 0.68, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 227, id: 226, d: 3.71, u: 4.41, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR109    H -  ASN110    H    d: 3.62 +/- 0.72, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 228, id: 227, d: 2.82, u: 3.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110   HA -  ASN110    H    d: 2.86 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 229, id: 228, d: 3.14, u: 5.29, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110   HA -  ASN110 HD21    d: 3.44 +/- 0.58, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 230, id: 229, d: 2.73, u: 3.84, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB2 -  ASN110    H    d: 2.77 +/- 0.40, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 231, id: 230, d: 3.31, u: 3.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB2 -  ASN110 HD21    d: 3.14 +/- 0.44, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 232, id: 231, d: 3.34, u: 4.52, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB2 -  ARG113    H    d: 3.32 +/- 0.45, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 233, id: 232, d: 3.51, u: 4.42, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB3 -  ASN110 HD22    d: 3.55 +/- 0.23, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 234, id: 233, d: 1.73, u: 2.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110 HD22 -  ASN110 HD21    d: 1.73 +/- 0.00, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 235, id: 234, d: 3.39, u: 3.75, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HB3 -  TYR114  HD2    d: 3.51 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 236, id: 235, d: 3.76, u: 4.30, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HD2 -  ASN110    H    d: 4.50 +/- 0.37, weight: 0.4

     PRO111  HD3 -  ASN110    H    d: 4.13 +/- 0.42, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 237, id: 236, d: 2.87, u: 4.15, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113   HA -  ARG113    H    d: 2.87 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 238, id: 237, d: 3.51, u: 4.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113   HA -  TYR114    H    d: 3.49 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 239, id: 238, d: 2.20, u: 2.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB2 -  ARG113    H    d: 2.16 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 240, id: 239, d: 2.97, u: 3.42, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB2 -  TYR114    H    d: 2.95 +/- 0.34, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 241, id: 240, d: 3.53, u: 4.26, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR114  HD1 -  TYR114    H    d: 4.80 +/- 0.19, weight: 0.2

     TYR114  HD2 -  TYR114    H    d: 3.74 +/- 0.18, weight: 0.7

ref_spec: h2o-noesy, ref_peak: 242, id: 241, d: 2.83, u: 3.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR114   HA -  TYR114    H    d: 2.82 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 243, id: 242, d: 3.73, u: 4.16, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111   HA -  TYR114    H    d: 3.99 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 244, id: 243, d: 2.75, u: 4.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR114    H -  CYS115    H    d: 2.72 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 245, id: 244, d: 2.87, u: 4.26, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS116   HA -  CYS116    H    d: 2.80 +/- 0.22, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 246, id: 245, d: 3.38, u: 4.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116   HA -  LEU117    H    d: 3.41 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 247, id: 246, d: 3.99, u: 4.10, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB2 -  LEU117    H    d: 3.87 +/- 0.15, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 248, id: 247, d: 2.27, u: 3.59, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116    H -  LEU117    H    d: 2.34 +/- 0.36, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 249, id: 248, d: 2.87, u: 3.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117   HA -  LEU117    H    d: 2.86 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 250, id: 249, d: 3.55, u: 4.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117   HA -  SER118    H    d: 3.52 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 251, id: 250, d: 2.14, u: 2.87, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB2 -  LEU117    H    d: 2.18 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 252, id: 251, d: 2.81, u: 3.34, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB2 -  SER118    H    d: 2.83 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 254, id: 253, d: 3.43, u: 3.36, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB3 -  LEU117    H    d: 3.46 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 255, id: 254, d: 3.30, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU117  HB3 -  SER118    H    d: 3.45 +/- 0.25, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 256, id: 255, d: 2.92, u: 3.67, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     SER118   HA -  SER118    H    d: 2.92 +/- 0.00, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 257, id: 256, d: 3.30, u: 4.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     SER118  HB2 -  SER118    H    d: 3.33 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 258, id: 257, d: 2.37, u: 3.51, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA3 -  CYS120    H    d: 2.50 +/- 0.23, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 259, id: 258, d: 1.78, u: 3.28, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119    H -  SER118    H    d: 1.94 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 260, id: 259, d: 2.93, u: 4.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS120   HA -  CYS120    H    d: 2.91 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 261, id: 260, d: 2.19, u: 3.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS120   HA -  THR121    H    d: 2.19 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 262, id: 261, d: 4.11, u: 4.52, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32   HA -  CYS120    H    d: 4.20 +/- 0.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 263, id: 262, d: 2.33, u: 3.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HA -  GLN122    H    d: 2.48 +/- 0.36, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 264, id: 263, d: 3.73, u: 4.82, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HA -  GLN123    H    d: 3.86 +/- 0.18, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 265, id: 264, d: 2.49, u: 3.19, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HB -  GLN122    H    d: 2.64 +/- 0.33, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 266, id: 265, d: 2.43, u: 3.74, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HB -  GLN123    H    d: 2.72 +/- 0.57, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 267, id: 266, d: 3.83, u: 4.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121   HB -  ASP124    H    d: 3.78 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 268, id: 267, d: 3.07, u: 3.78, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -  THR121    H    d: 3.23 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 269, id: 268, d: 4.13, u: 4.02, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -  GLN122    H    d: 4.16 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 270, id: 269, d: 4.77, u: 4.66, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -  GLN123    H    d: 5.05 +/- 0.49, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 271, id: 270, d: 2.80, u: 3.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122   HA -  GLN122    H    d: 2.78 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 272, id: 271, d: 2.28, u: 3.40, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HB2 -  GLN122    H    d: 2.41 +/- 0.48, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 273, id: 272, d: 3.34, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HB2 -  GLN123    H    d: 3.53 +/- 0.37, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 274, id: 273, d: 3.94, u: 4.27, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG2 -  GLN122    H    d: 3.75 +/- 0.73, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 275, id: 274, d: 2.75, u: 4.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG2 -  GLN122 HE21    d: 2.52 +/- 0.38, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 276, id: 275, d: 3.84, u: 5.11, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG3 -  GLN122 HE22    d: 3.78 +/- 0.23, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 277, id: 276, d: 1.73, u: 2.18, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122 HE22 -  GLN122 HE21    d: 1.73 +/- 0.00, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 278, id: 277, d: 2.72, u: 3.26, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     GLN122   HA -  GLN123    H    d: 3.28 +/- 0.29, weight: 0.3

     GLN123   HA -  GLN123    H    d: 2.82 +/- 0.21, weight: 0.7

ref_spec: h2o-noesy, ref_peak: 279, id: 278, d: 3.42, u: 3.89, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     GLN122   HA -  ASP124    H    d: 4.50 +/- 0.34, weight: 0.2

     GLN123   HA -  ASP124    H    d: 3.41 +/- 0.36, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 280, id: 279, d: 3.26, u: 3.23, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123   HA -  LEU126    H    d: 3.37 +/- 0.47, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 281, id: 280, d: 2.54, u: 3.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HB2 -  ASP124    H    d: 2.78 +/- 0.59, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 282, id: 281, d: 3.50, u: 3.37, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HB3 -  GLN123    H    d: 3.49 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 283, id: 282, d: 3.04, u: 5.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG2 -  GLN123 HE21    d: 2.91 +/- 0.51, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 284, id: 283, d: 3.69, u: 4.44, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG3 -  GLN123    H    d: 3.81 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 285, id: 284, d: 2.65, u: 3.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123    H -  GLN122    H    d: 2.83 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 286, id: 285, d: 1.73, u: 2.13, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123 HE22 -  GLN123 HE21    d: 1.73 +/- 0.00, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 287, id: 286, d: 2.80, u: 3.49, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124   HA -  ASP124    H    d: 2.75 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 288, id: 287, d: 3.54, u: 4.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124   HA -  LEU125    H    d: 3.30 +/- 0.59, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 289, id: 288, d: 2.65, u: 3.87, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB2 -  THR121    H    d: 2.64 +/- 0.68, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 290, id: 289, d: 2.22, u: 3.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB2 -  ASP124    H    d: 2.41 +/- 0.56, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 291, id: 290, d: 3.10, u: 3.87, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB2 -  LEU125    H    d: 3.09 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 292, id: 291, d: 2.51, u: 3.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124    H -  GLN123    H    d: 2.39 +/- 0.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 293, id: 292, d: 2.91, u: 4.78, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HA -  LEU128    H    d: 2.90 +/- 0.20, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 294, id: 293, d: 2.49, u: 3.27, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB2 -  LEU125    H    d: 2.67 +/- 0.40, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 296, id: 295, d: 3.02, u: 3.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD11 -  LEU125    H    d: 3.47 +/- 0.66, weight: 1.0
     LEU125 HD12 -  LEU125    H
     LEU125 HD13 -  LEU125    H

ref_spec: h2o-noesy, ref_peak: 297, id: 296, d: 2.49, u: 3.19, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU125   HG -  LEU125    H    d: 2.64 +/- 0.25, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 298, id: 297, d: 3.91, u: 5.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125    H -  GLN123    H    d: 3.91 +/- 0.79, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 299, id: 298, d: 2.71, u: 3.50, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125    H -  LEU126    H    d: 2.64 +/- 0.25, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 300, id: 299, d: 2.82, u: 3.30, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126   HA -  LEU126    H    d: 2.80 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 301, id: 300, d: 3.47, u: 4.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126   HA -  THR127    H    d: 3.46 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 302, id: 301, d: 4.00, u: 4.93, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126   HA -  CYS129    H    d: 4.27 +/- 0.63, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 303, id: 302, d: 2.14, u: 2.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB2 -  LEU126    H    d: 2.20 +/- 0.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 304, id: 303, d: 3.42, u: 4.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB3 -  THR127    H    d: 3.51 +/- 0.17, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 307, id: 306, d: 3.14, u: 3.07, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126   HG -  LEU126    H    d: 2.96 +/- 0.45, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 308, id: 307, d: 2.92, u: 3.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127   HA -  THR127    H    d: 2.91 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 309, id: 308, d: 2.48, u: 3.09, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127 HG21 -  THR127    H    d: 2.45 +/- 0.37, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 310, id: 309, d: 4.51, u: 5.19, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127 HG21 -  LEU128    H    d: 4.42 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 311, id: 310, d: 2.56, u: 3.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127    H -  LEU126    H    d: 2.60 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 312, id: 311, d: 2.33, u: 3.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127    H -  LEU128    H    d: 2.40 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 313, id: 312, d: 2.92, u: 3.58, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128   HA -  LEU128    H    d: 2.92 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 314, id: 313, d: 3.38, u: 4.61, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128   HA -  CYS129    H    d: 3.35 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 315, id: 314, d: 2.51, u: 3.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128  HB2 -  LEU128    H    d: 2.70 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 316, id: 315, d: 4.22, u: 3.89, u_viol: 0.33, %_viol: 85.0, viol: yes, reliable: no, a_type: S
     LEU128 HD11 -  LEU128    H    d: 4.08 +/- 0.55, weight: 0.9
     LEU128 HD12 -  LEU128    H
     LEU128 HD13 -  LEU128    H

ref_spec: h2o-noesy, ref_peak: 317, id: 316, d: 2.50, u: 3.28, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128   HG -  LEU128    H    d: 2.71 +/- 0.50, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 318, id: 317, d: 2.76, u: 4.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS129   HA -  CYS129    H    d: 2.64 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 319, id: 318, d: 2.68, u: 3.97, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS129  HB3 -  CYS129    H    d: 2.93 +/- 0.79, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 320, id: 319, d: 2.22, u: 3.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS129    H -  LEU128    H    d: 1.98 +/- 0.35, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 321, id: 320, d: 3.11, u: 3.30, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO130   HA -  TYR131    H    d: 3.12 +/- 0.46, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 322, id: 321, d: 2.77, u: 4.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR131   HA -  TYR131    H    d: 2.72 +/- 0.32, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 323, id: 322, d: 2.91, u: 4.38, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR131  HB2 -  TYR131    H    d: 2.93 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 324, id: 323, d: 3.28, u: 4.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   ARG30    H    d: 3.19 +/- 0.45, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 325, id: 324, d: 3.61, u: 5.26, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR121 HG21 -   ARG30   HE    d: 3.84 +/- 0.62, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 326, id: 325, d: 4.55, u: 4.54, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD11 -   LEU42    H    d: 4.60 +/- 0.22, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 327, id: 326, d: 2.51, u: 3.70, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD21 -   LEU42    H    d: 2.94 +/- 0.58, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 328, id: 327, d: 5.70, u: 5.72, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD11 -  LEU128    H    d: 6.37 +/- 1.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 329, id: 328, d: 4.59, u: 4.71, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -  LEU125    H    d: 4.90 +/- 0.25, weight: 0.9
      VAL45 HG22 -  LEU125    H
      VAL45 HG23 -  LEU125    H

ref_spec: h2o-noesy, ref_peak: 331, id: 330, d: 4.47, u: 4.69, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG11 -  LEU125    H    d: 4.56 +/- 0.38, weight: 1.0
      VAL45 HG12 -  LEU125    H
      VAL45 HG13 -  LEU125    H

ref_spec: h2o-noesy, ref_peak: 332, id: 331, d: 3.52, u: 3.40, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HB3 -  GLN122    H    d: 3.34 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 333, id: 332, d: 2.63, u: 4.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122  HG3 -  GLN122    H    d: 2.90 +/- 0.34, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 334, id: 333, d: 2.30, u: 3.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY35  HA3 -   GLY35    H    d: 2.30 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 335, id: 334, d: 2.85, u: 3.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119  HA2 -  CYS120    H    d: 2.74 +/- 0.21, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 336, id: 335, d: 3.92, u: 4.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30   HA -  CYS120    H    d: 3.81 +/- 0.67, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 337, id: 336, d: 3.53, u: 3.42, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB3 -   LYS32    H    d: 3.54 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 338, id: 337, d: 3.59, u: 3.93, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG2 -   ARG30    H    d: 3.35 +/- 0.77, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 339, id: 338, d: 2.50, u: 3.38, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HB2 -   ARG30    H    d: 2.45 +/- 0.34, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 340, id: 339, d: 3.75, u: 3.74, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB3 -   ARG50    H    d: 3.88 +/- 0.15, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 341, id: 340, d: 3.51, u: 3.56, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HB2 -   GLU28    H    d: 3.70 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 342, id: 341, d: 2.90, u: 3.21, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HB3 -   MET29    H    d: 2.89 +/- 0.22, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 343, id: 342, d: 2.25, u: 2.90, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HB2 -  GLN123    H    d: 2.35 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 344, id: 343, d: 4.78, u: 5.33, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HG3 -   MET29    H    d: 4.97 +/- 0.26, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 345, id: 344, d: 2.81, u: 4.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU28  HG3 -   GLU28    H    d: 2.96 +/- 0.52, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 346, id: 345, d: 3.45, u: 4.17, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN123  HG2 -  GLN123    H    d: 3.85 +/- 0.64, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 347, id: 346, d: 4.58, u: 4.78, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HG2 -   MET29    H    d: 4.44 +/- 0.18, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 348, id: 347, d: 3.68, u: 3.92, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110  HB3 -  ASN110    H    d: 3.62 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 349, id: 348, d: 2.67, u: 3.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS46  HB3 -   CYS46    H    d: 2.96 +/- 0.50, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 350, id: 349, d: 3.11, u: 3.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB3 -   CYS34    H    d: 3.02 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 351, id: 350, d: 3.19, u: 3.56, u_viol: 0.13, %_viol: 0.0, viol: no, reliable: no, a_type: M
     SER118  HB3 -  SER118    H    d: 3.15 +/- 0.37, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 352, id: 351, d: 2.04, u: 2.93, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR114  HB3 -  TYR114    H    d: 2.12 +/- 0.10, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 353, id: 352, d: 3.03, u: 3.86, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS116  HB3 -  LEU117    H    d: 2.89 +/- 0.22, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 354, id: 353, d: 2.92, u: 3.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB2 -  LEU126    H    d: 2.97 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 355, id: 354, d: 2.88, u: 3.85, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG40  HG3 -   ARG40    H    d: 3.18 +/- 0.82, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 356, id: 355, d: 3.16, u: 3.13, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB3 -   LEU42    H    d: 3.17 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 357, id: 356, d: 3.14, u: 3.67, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124  HB3 -  ASP124    H    d: 3.18 +/- 0.40, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 358, id: 357, d: 2.64, u: 3.16, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY48  HA3 -   GLY48    H    d: 2.63 +/- 0.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 359, id: 358, d: 3.63, u: 3.55, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128  HB3 -  LEU128    H    d: 3.72 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 360, id: 359, d: 2.50, u: 3.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      GLU54   HA -   GLU54    H    d: 2.70 +/- 0.30, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 361, id: 360, d: 2.85, u: 3.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44    H -   VAL45    H    d: 2.84 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 362, id: 361, d: 2.72, u: 4.12, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44    H -   VAL43    H    d: 2.71 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 363, id: 362, d: 2.03, u: 4.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HG3 -   LYS32    H    d: 2.00 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 364, id: 363, d: 4.27, u: 4.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB3 -   GLY35    H    d: 4.27 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 365, id: 364, d: 3.09, u: 6.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB3 -   ARG50   HE    d: 3.02 +/- 0.94, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 366, id: 365, d: 3.35, u: 5.21, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124    H -  THR121    H    d: 3.53 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 367, id: 366, d: 3.90, u: 5.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31    H -   ARG30    H    d: 3.94 +/- 0.64, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 368, id: 367, d: 4.29, u: 5.46, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33    H -   CYS34    H    d: 4.32 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 369, id: 368, d: 4.68, u: 6.08, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44    H -   CYS46    H    d: 4.55 +/- 0.20, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 370, id: 369, d: 3.72, u: 6.16, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HD2 -   CYS34    H    d: 3.74 +/- 0.22, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 371, id: 370, d: 3.47, u: 5.01, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR114  HD1 -  CYS115    H    d: 4.06 +/- 0.38, weight: 0.4

     TYR114  HD2 -  CYS115    H    d: 3.92 +/- 0.63, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 372, id: 371, d: 5.16, u: 5.72, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HD3 -   ARG30    H    d: 4.88 +/- 0.54, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 373, id: 372, d: 4.43, u: 5.38, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HG2 -   ARG30    H    d: 4.14 +/- 0.58, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 374, id: 373, d: 4.37, u: 5.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      MET29  HG3 -   ARG30    H    d: 4.47 +/- 0.78, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 375, id: 374, d: 4.93, u: 5.12, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ARG113  HB2 -  ASN110    H    d: 4.93 +/- 0.36, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 376, id: 375, d: 4.31, u: 5.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HD2 -   ARG50    H    d: 4.68 +/- 1.09, weight: 0.6

      ARG50  HD3 -   ARG50    H    d: 5.04 +/- 0.64, weight: 0.4

ref_spec: h2o-noesy, ref_peak: 377, id: 376, d: 5.21, u: 5.50, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HD2 -   ARG30    H    d: 5.07 +/- 0.39, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 378, id: 377, d: 4.60, u: 5.53, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PRO49  HD3 -   ARG50    H    d: 4.49 +/- 0.54, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 379, id: 378, d: 3.69, u: 6.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR114  HD1 -  SER118    H    d: 3.76 +/- 0.17, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 380, id: 379, d: 4.71, u: 6.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASN110 HD21 -  ASN110    H    d: 4.76 +/- 0.68, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 381, id: 380, d: 2.33, u: 3.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HG -   LEU33    H    d: 2.45 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 382, id: 381, d: 5.16, u: 5.70, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS120   HA -  ASP124    H    d: 5.41 +/- 0.20, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 383, id: 382, d: 4.40, u: 4.88, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39    H -   ALA41    H    d: 4.40 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 384, id: 383, d: 2.74, u: 2.78, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HD3 -   ARG30   HE    d: 2.72 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 385, id: 384, d: 3.16, u: 4.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128  HB2 -  CYS129    H    d: 3.19 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 386, id: 385, d: 3.90, u: 5.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HB2 -   ARG44   HE    d: 3.71 +/- 0.56, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 387, id: 386, d: 5.29, u: 5.74, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG44  HB2 -   TRP51  HH2    d: 8.81 +/- 0.31, weight: 0.2

      PRO49  HG2 -   TRP51  HH2    d: 7.07 +/- 2.64, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 388, id: 387, d: 4.54, u: 5.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      PRO49  HG2 -   TRP51  HD1    d: 4.70 +/- 0.91, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 389, id: 388, d: 3.13, u: 4.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HG2 -   ARG44   HE    d: 3.14 +/- 0.52, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 390, id: 389, d: 5.16, u: 5.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU126 HD21 -  CYS129    H    d: 6.59 +/- 0.85, weight: 0.2
     LEU126 HD22 -  CYS129    H
     LEU126 HD23 -  CYS129    H

     LEU128 HD11 -  CYS129    H    d: 5.33 +/- 1.00, weight: 0.7
     LEU128 HD12 -  CYS129    H
     LEU128 HD13 -  CYS129    H

ref_spec: h2o-noesy, ref_peak: 391, id: 390, d: 5.60, u: 5.41, u_viol: 0.18, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   TRP51  HD1    d: 5.38 +/- 0.53, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 392, id: 391, d: 3.63, u: 4.49, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG11 -   TRP51  HD1    d: 3.92 +/- 0.40, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 393, id: 392, d: 4.53, u: 5.07, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      THR53 HG21 -   GLU54    H    d: 4.43 +/- 0.28, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 394, id: 393, d: 2.49, u: 4.55, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HG2 -   ARG50   HE    d: 3.32 +/- 0.54, weight: 0.2

      ARG50  HG3 -   ARG50   HE    d: 2.76 +/- 0.41, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 395, id: 394, d: 2.58, u: 4.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG30  HG2 -   ARG30   HE    d: 2.56 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 396, id: 395, d: 3.44, u: 4.17, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31    H -  CYS120    H    d: 3.19 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 397, id: 396, d: 2.79, u: 3.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ASP124    H -  LEU125    H    d: 2.88 +/- 0.47, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 398, id: 397, d: 2.79, u: 3.71, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      SER52   HA -   SER52    H    d: 2.89 +/- 0.05, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 400, id: 399, d: 3.72, u: 3.98, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU42   HG -   LEU42    H    d: 3.84 +/- 0.10, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 401, id: 400, d: 3.54, u: 4.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL45   HA -   CYS46    H    d: 3.49 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 402, id: 401, d: 3.49, u: 5.22, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     SER118   HA -  GLY119    H    d: 3.49 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 403, id: 402, d: 3.25, u: 3.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG40  HD2 -   ARG40    H    d: 3.21 +/- 1.18, weight: 0.7

      ARG40  HD3 -   ARG40    H    d: 3.78 +/- 0.60, weight: 0.3

ref_spec: h2o-noesy, ref_peak: 404, id: 403, d: 3.54, u: 4.71, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31  HB2 -   GLU31    H    d: 3.40 +/- 0.38, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 405, id: 404, d: 3.98, u: 4.46, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU126   HA -  LEU128    H    d: 4.20 +/- 0.33, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 406, id: 405, d: 3.42, u: 3.51, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50   HA -   TRP51    H    d: 3.36 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 407, id: 406, d: 3.36, u: 4.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     THR127   HA -  LEU128    H    d: 3.43 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 408, id: 407, d: 4.85, u: 4.74, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG11 -   GLY47    H    d: 5.55 +/- 1.17, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 409, id: 408, d: 5.69, u: 5.55, u_viol: 0.14, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -   GLY47    H    d: 5.77 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 410, id: 409, d: 4.76, u: 4.91, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125  HB2 -   VAL45    H    d: 4.94 +/- 0.30, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 411, id: 410, d: 4.33, u: 4.27, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LYS32  HB2 -   LEU33    H    d: 4.33 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 412, id: 411, d: 3.61, u: 4.29, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   CYS34    H    d: 3.58 +/- 0.07, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 413, id: 412, d: 4.06, u: 4.12, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   CYS34    H    d: 3.95 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 414, id: 413, d: 3.57, u: 3.42, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA112  HB1 -  ARG113    H    d: 3.55 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 415, id: 414, d: 3.46, u: 3.89, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS116   HA -   LEU33    H    d: 3.30 +/- 0.32, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 416, id: 415, d: 3.65, u: 4.49, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS115  HB3 -  CYS115    H    d: 3.65 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 417, id: 416, d: 5.51, u: 5.40, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD21 -  TYR114  HE2    d: 5.78 +/- 0.59, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 419, id: 418, d: 2.79, u: 5.00, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA106   HA -  ALA107    H    d: 2.97 +/- 0.56, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 421, id: 420, d: 3.23, u: 4.87, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL43 HG21 -   ARG44    H    d: 3.70 +/- 0.26, weight: 0.9
      VAL43 HG22 -   ARG44    H
      VAL43 HG23 -   ARG44    H

ref_spec: h2o-noesy, ref_peak: 422, id: 421, d: 2.69, u: 3.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45 HG21 -   VAL45    H    d: 2.80 +/- 0.18, weight: 1.0
      VAL45 HG22 -   VAL45    H
      VAL45 HG23 -   VAL45    H

ref_spec: h2o-noesy, ref_peak: 423, id: 422, d: 5.06, u: 5.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42   HG -   VAL43    H    d: 5.04 +/- 0.13, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 424, id: 423, d: 3.11, u: 3.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR114  HB2 -  CYS115    H    d: 4.26 +/- 0.14, weight: 0.2

     TYR114  HB3 -  CYS115    H    d: 3.43 +/- 0.39, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 425, id: 424, d: 5.52, u: 5.62, u_viol: 0.09, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ALA41  HB1 -   ARG44   HE    d: 5.63 +/- 0.18, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 426, id: 425, d: 4.21, u: 6.12, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HD2 -   HIS37  HE1    d: 4.21 +/- 0.00, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 427, id: 426, d: 4.21, u: 4.34, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      LEU42   HG -   PHE38  HD1    d: 5.73 +/- 0.48, weight: 0.1

      LEU42   HG -   PHE38  HD2    d: 4.37 +/- 0.20, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 428, id: 427, d: 3.13, u: 3.18, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: A
      LEU33 HD11 -   PHE38  HE2    d: 4.41 +/- 0.26, weight: 0.1
      LEU33 HD12 -   PHE38  HE2
      LEU33 HD13 -   PHE38  HE2

      LEU42 HD11 -   PHE38  HE1    d: 3.85 +/- 0.43, weight: 0.3
      LEU42 HD12 -   PHE38  HE1
      LEU42 HD13 -   PHE38  HE1

      LEU42 HD11 -   PHE38  HE2    d: 4.55 +/- 0.36, weight: 0.1
      LEU42 HD12 -   PHE38  HE2
      LEU42 HD13 -   PHE38  HE2

      LEU42 HD11 -   PHE38   HZ    d: 3.58 +/- 0.53, weight: 0.4
      LEU42 HD12 -   PHE38   HZ
      LEU42 HD13 -   PHE38   HZ

ref_spec: h2o-noesy, ref_peak: 429, id: 428, d: 5.74, u: 5.52, u_viol: 0.23, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -   TRP51  HH2    d: 5.58 +/- 0.46, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 430, id: 429, d: 2.26, u: 3.83, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      LEU33 HD11 -   PHE38  HD2    d: 2.40 +/- 0.32, weight: 1.0
      LEU33 HD12 -   PHE38  HD2
      LEU33 HD13 -   PHE38  HD2

ref_spec: h2o-noesy, ref_peak: 431, id: 430, d: 4.00, u: 4.43, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD21 -   PHE38  HD2    d: 3.80 +/- 0.70, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 432, id: 431, d: 2.86, u: 4.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   TRP51  HH2    d: 3.18 +/- 0.48, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 433, id: 432, d: 4.61, u: 4.31, u_viol: 0.30, %_viol: 35.0, viol: no, reliable: no, a_type: M
      VAL43 HG11 -   TRP51  HH2    d: 5.11 +/- 0.89, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 434, id: 433, d: 2.81, u: 4.22, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU125 HD21 -   PHE38  HD2    d: 3.13 +/- 0.56, weight: 1.0
     LEU125 HD22 -   PHE38  HD2
     LEU125 HD23 -   PHE38  HD2

ref_spec: h2o-noesy, ref_peak: 435, id: 434, d: 2.90, u: 2.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   PHE38  HD2    d: 3.02 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 436, id: 435, d: 4.09, u: 4.22, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33  HB3 -   PHE38  HE2    d: 5.48 +/- 0.10, weight: 0.2

      LEU33  HB3 -   VAL39    H    d: 4.38 +/- 0.05, weight: 0.7

ref_spec: h2o-noesy, ref_peak: 437, id: 436, d: 3.31, u: 3.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU125 HD21 -   PHE38  HE2    d: 3.34 +/- 0.46, weight: 0.9
     LEU125 HD22 -   PHE38  HE2
     LEU125 HD23 -   PHE38  HE2

ref_spec: h2o-noesy, ref_peak: 438, id: 437, d: 4.39, u: 5.41, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125 HD21 -   PHE38  HE2    d: 4.25 +/- 0.72, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 439, id: 438, d: 5.49, u: 6.03, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128 HD11 -  TYR114  HE2    d: 5.20 +/- 0.36, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 440, id: 439, d: 5.10, u: 5.02, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: S
     THR109 HG21 -  TYR114  HE1    d: 6.31 +/- 0.92, weight: 0.3

     THR109 HG21 -  TYR114  HE2    d: 5.53 +/- 0.28, weight: 0.7

ref_spec: h2o-noesy, ref_peak: 441, id: 440, d: 3.84, u: 4.46, u_viol: 0.25, %_viol: 0.0, viol: no, reliable: no, a_type: A
     PRO130  HG2 -  TYR131  HE2    d: 3.69 +/- 0.71, weight: 1.0
     PRO130  HG3 -  TYR131  HE2

ref_spec: h2o-noesy, ref_peak: 442, id: 441, d: 5.42, u: 6.11, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HG2 -  TYR114  HE2    d: 6.04 +/- 0.54, weight: 0.3

     PRO111  HG3 -  TYR114  HE2    d: 5.41 +/- 0.52, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 443, id: 442, d: 4.42, u: 5.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR131  HB3 -  TYR131  HE1    d: 4.70 +/- 0.04, weight: 0.7

     TYR131  HB3 -  TYR131  HE2    d: 5.40 +/- 0.04, weight: 0.3

ref_spec: h2o-noesy, ref_peak: 444, id: 443, d: 4.41, u: 4.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR131  HB2 -  TYR131  HE1    d: 5.43 +/- 0.03, weight: 0.3

     TYR131  HB2 -  TYR131  HE2    d: 4.67 +/- 0.03, weight: 0.7

ref_spec: h2o-noesy, ref_peak: 445, id: 444, d: 3.79, u: 3.50, u_viol: 0.29, %_viol: 65.0, viol: yes, reliable: no, a_type: A
     TYR114  HB2 -  TYR114  HE1    d: 4.84 +/- 0.04, weight: 0.3

     TYR114  HB2 -  TYR114  HE2    d: 5.19 +/- 0.09, weight: 0.2

     TYR114  HB3 -  TYR114  HE1    d: 5.45 +/- 0.01, weight: 0.1

     TYR114  HB3 -  TYR114  HE2    d: 4.55 +/- 0.06, weight: 0.4

ref_spec: h2o-noesy, ref_peak: 446, id: 445, d: 4.33, u: 4.56, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: S
     SER118  HB2 -  TYR114  HE1    d: 4.50 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 447, id: 446, d: 3.36, u: 4.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111   HA -  TYR114  HE2    d: 2.95 +/- 0.45, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 448, id: 447, d: 4.52, u: 4.49, u_viol: 0.08, %_viol: 0.0, viol: no, reliable: no, a_type: A
     GLY119  HA3 -  TYR114  HE1    d: 5.76 +/- 0.37, weight: 0.3

     LEU126   HA -  GLN123 HE21    d: 6.97 +/- 1.58, weight: 0.1

     TYR114   HA -  TYR114  HE1    d: 5.56 +/- 0.25, weight: 0.3

     TYR114   HA -  TYR114  HE2    d: 6.58 +/- 0.05, weight: 0.1

ref_spec: h2o-noesy, ref_peak: 449, id: 448, d: 4.61, u: 5.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR131   HA -  TYR131  HE2    d: 5.64 +/- 0.16, weight: 0.3

     TYR131   HA -  TYR131  HE1    d: 4.90 +/- 0.13, weight: 0.7

ref_spec: h2o-noesy, ref_peak: 450, id: 449, d: 2.67, u: 4.48, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39 HG11 -   TRP51  HH2    d: 2.99 +/- 0.59, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 451, id: 450, d: 4.06, u: 4.05, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ALA41  HB1 -   PHE38  HD2    d: 4.16 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 452, id: 451, d: 4.23, u: 4.21, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33   HG -   PHE38  HD2    d: 4.25 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 453, id: 452, d: 2.51, u: 3.82, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG40  HG3 -   ARG40   HE    d: 2.64 +/- 0.36, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 454, id: 453, d: 3.35, u: 3.70, u_viol: 0.21, %_viol: 10.0, viol: no, reliable: no, a_type: A
     PRO130  HG2 -  TYR131  HD2    d: 3.14 +/- 0.84, weight: 1.0
     PRO130  HG3 -  TYR131  HD2

ref_spec: h2o-noesy, ref_peak: 455, id: 454, d: 2.76, u: 3.20, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33  HB2 -   PHE38  HD2    d: 2.91 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 456, id: 455, d: 2.45, u: 3.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     TYR131  HB3 -  TYR131  HD1    d: 2.47 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 457, id: 456, d: 2.28, u: 2.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      PHE38  HB3 -   PHE38  HD1    d: 2.31 +/- 0.01, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 458, id: 457, d: 2.39, u: 3.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR131  HB2 -  TYR131  HD2    d: 2.41 +/- 0.06, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 459, id: 458, d: 2.89, u: 3.62, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38  HB3 -   VAL39    H    d: 2.92 +/- 0.07, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 460, id: 459, d: 3.54, u: 3.48, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS115  HB3 -  GLY119    H    d: 3.69 +/- 0.12, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 461, id: 460, d: 4.91, u: 5.01, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      CYS34  HB3 -   HIS37  HD2    d: 4.68 +/- 0.31, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 462, id: 461, d: 2.05, u: 2.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      ARG40  HD2 -   ARG40   HE    d: 2.73 +/- 0.20, weight: 0.2

     TYR114  HB2 -  TYR114  HD1    d: 2.79 +/- 0.10, weight: 0.2

     TYR114  HB3 -  TYR114  HD2    d: 2.25 +/- 0.04, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 463, id: 462, d: 2.59, u: 2.74, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      PHE38  HB2 -   PHE38  HD2    d: 2.69 +/- 0.02, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 465, id: 464, d: 2.84, u: 3.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39   HA -   VAL39    H    d: 2.84 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 466, id: 465, d: 3.84, u: 3.85, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB3 -   TRP51  HD1    d: 3.72 +/- 0.39, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 467, id: 466, d: 2.84, u: 3.77, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD3 -   ARG44   HE    d: 2.77 +/- 0.07, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 468, id: 467, d: 3.29, u: 3.26, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS115  HB2 -   PHE38  HD2    d: 3.39 +/- 0.07, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 469, id: 468, d: 2.75, u: 3.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB2 -   TRP51  HD1    d: 2.94 +/- 0.42, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 470, id: 469, d: 2.65, u: 4.02, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HB2 -   HIS37  HD2    d: 2.65 +/- 0.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 471, id: 470, d: 4.13, u: 4.07, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: S
      GLY35  HA2 -   PHE38  HD1    d: 4.26 +/- 0.03, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 472, id: 471, d: 4.54, u: 4.60, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY47  HA2 -   TRP51  HD1    d: 4.55 +/- 0.26, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 473, id: 472, d: 3.68, u: 5.24, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125   HA -   PHE38  HE2    d: 4.15 +/- 0.44, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 474, id: 473, d: 2.48, u: 3.97, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      GLY35  HA3 -   PHE38  HD1    d: 2.56 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 475, id: 474, d: 3.45, u: 4.13, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38   HA -   VAL39    H    d: 3.45 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 476, id: 475, d: 2.85, u: 5.52, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50   HA -   TRP51  HD1    d: 3.50 +/- 0.75, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 477, id: 476, d: 2.30, u: 3.31, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      PHE38   HA -   PHE38  HD2    d: 2.34 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 478, id: 477, d: 1.80, u: 3.64, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111   HA -  TYR114  HD2    d: 1.87 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 479, id: 478, d: 4.20, u: 4.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37   HA -   HIS37  HD2    d: 4.13 +/- 0.31, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 480, id: 479, d: 4.87, u: 5.05, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128   HA -   PHE38  HE2    d: 6.22 +/- 0.22, weight: 0.3

     LEU128   HA -   PHE38   HZ    d: 5.48 +/- 0.18, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 481, id: 480, d: 2.89, u: 3.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     TYR131   HA -  TYR131  HD1    d: 2.94 +/- 0.22, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 482, id: 481, d: 4.97, u: 4.97, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: S
      LEU33   HA -   PHE38  HD2    d: 5.29 +/- 0.06, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 483, id: 482, d: 4.37, u: 5.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33   HA -   HIS37  HD2    d: 4.46 +/- 0.17, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 484, id: 483, d: 4.19, u: 4.07, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51   HA -   TRP51  HD1    d: 4.07 +/- 0.16, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 485, id: 484, d: 2.35, u: 3.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB3 -   TRP51  HE3    d: 2.54 +/- 0.55, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 486, id: 485, d: 4.89, u: 4.68, u_viol: 0.22, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39 HG11 -   TRP51  HZ2    d: 4.90 +/- 0.08, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 487, id: 486, d: 3.25, u: 4.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG11 -   TRP51  HZ2    d: 3.66 +/- 0.76, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 488, id: 487, d: 2.29, u: 5.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   TRP51  HZ2    d: 2.26 +/- 0.25, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 489, id: 488, d: 4.30, u: 10.69, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -   TRP51  HZ2    d: 4.34 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 490, id: 489, d: 5.03, u: 4.81, u_viol: 0.22, %_viol: 10.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   HIS37  HD2    d: 5.05 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 491, id: 490, d: 6.22, u: 6.07, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33  HB3 -   HIS37  HD2    d: 6.26 +/- 0.07, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 492, id: 491, d: 3.93, u: 3.74, u_viol: 0.19, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HB2 -   TRP51  HE3    d: 3.67 +/- 0.65, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 493, id: 492, d: 3.11, u: 3.87, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51   HA -   TRP51  HE3    d: 3.34 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 494, id: 493, d: 2.71, u: 2.71, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: S
     ALA112  HB1 -   PHE38  HE1    d: 2.74 +/- 0.06, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 495, id: 494, d: 6.78, u: 6.83, u_viol: 0.46, %_viol: 30.0, viol: no, reliable: no, a_type: S
      VAL45 HG11 -  GLN122 HE22    d: 6.74 +/- 1.10, weight: 0.9
      VAL45 HG12 -  GLN122 HE22
      VAL45 HG13 -  GLN122 HE22

ref_spec: h2o-noesy, ref_peak: 496, id: 495, d: 4.73, u: 5.39, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      ARG50  HG2 -   TRP51  HD1    d: 5.48 +/- 0.37, weight: 0.5

      ARG50  HG3 -   TRP51  HD1    d: 5.48 +/- 0.48, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 497, id: 496, d: 2.85, u: 4.13, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128  HB3 -   PHE38  HE2    d: 4.47 +/- 0.83, weight: 0.2

     LEU128  HB3 -   PHE38   HZ    d: 3.52 +/- 0.70, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 498, id: 497, d: 4.84, u: 5.49, u_viol: 0.16, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG50  HB3 -   TRP51  HD1    d: 4.82 +/- 0.30, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 499, id: 498, d: 4.83, u: 4.49, u_viol: 0.34, %_viol: 30.0, viol: no, reliable: no, a_type: M
      ARG50  HB2 -   TRP51  HD1    d: 4.34 +/- 0.68, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 500, id: 499, d: 3.42, u: 5.17, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128  HB2 -   PHE38  HE2    d: 4.18 +/- 0.50, weight: 0.5

     LEU128  HB2 -   PHE38   HZ    d: 4.14 +/- 0.47, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 501, id: 500, d: 4.54, u: 4.65, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS120   HA -  TYR114  HE1    d: 4.50 +/- 0.42, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 502, id: 501, d: 6.29, u: 6.30, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS120   HA -  TYR114  HD1    d: 6.25 +/- 0.32, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 503, id: 502, d: 2.08, u: 3.12, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42  HB2 -   LEU42    H    d: 2.11 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 504, id: 503, d: 5.34, u: 5.34, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU117  HB2 -  TYR114  HE1    d: 5.67 +/- 0.11, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 505, id: 504, d: 5.22, u: 5.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     PRO111  HD2 -  TYR114  HE2    d: 6.25 +/- 0.50, weight: 0.2

     PRO111  HD3 -  TYR114  HE2    d: 4.98 +/- 0.54, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 506, id: 505, d: 3.65, u: 3.54, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL39   HA -   LEU42    H    d: 3.65 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 507, id: 506, d: 4.62, u: 5.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO130  HB3 -  TYR131  HE2    d: 4.98 +/- 0.66, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 508, id: 507, d: 3.32, u: 3.69, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HB3 -   PHE38  HE2    d: 4.96 +/- 1.45, weight: 0.3

     PRO111  HB3 -   PHE38   HZ    d: 4.29 +/- 1.13, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 509, id: 508, d: 4.69, u: 4.73, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU125  HB3 -   PHE38  HE2    d: 4.99 +/- 0.14, weight: 0.8

     LEU125  HB3 -   PHE38   HZ    d: 6.57 +/- 0.31, weight: 0.1

ref_spec: h2o-noesy, ref_peak: 510, id: 509, d: 6.67, u: 6.55, u_viol: 0.12, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS37  HD2 -   HIS36  HE1    d: 6.72 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 511, id: 510, d: 5.03, u: 5.73, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HD1 -   TRP51  HE3    d: 5.03 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 512, id: 511, d: 4.27, u: 4.75, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HH2 -   TRP51  HE3    d: 4.27 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 513, id: 512, d: 2.46, u: 3.10, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51  HZ3 -   TRP51  HE3    d: 2.46 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 514, id: 513, d: 2.40, u: 2.99, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      TRP51  HH2 -   TRP51  HZ2    d: 2.41 +/- 0.02, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 515, id: 514, d: 4.17, u: 4.20, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: A
      TRP51  HZ3 -   TRP51  HZ2    d: 4.25 +/- 0.01, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 516, id: 515, d: 4.07, u: 5.47, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU128  HB3 -  CYS129    H    d: 4.12 +/- 0.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 517, id: 516, d: 5.95, u: 5.89, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG11 -   CYS46    H    d: 5.94 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 518, id: 517, d: 4.19, u: 4.04, u_viol: 0.15, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -   VAL43    H    d: 4.23 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 519, id: 518, d: 5.22, u: 5.01, u_viol: 0.21, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51   HA -   TRP51  HZ3    d: 5.45 +/- 0.55, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 520, id: 519, d: 4.29, u: 4.29, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: S
     PRO111  HB2 -  TYR114  HD2    d: 4.46 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 521, id: 520, d: 2.88, u: 3.27, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39   HB -   HIS36  HD2    d: 2.72 +/- 0.43, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 522, id: 521, d: 2.19, u: 2.63, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     TYR131  HE2 -  TYR131  HD2    d: 2.46 +/- 0.00, weight: 0.5

     TYR131  HE1 -  TYR131  HD1    d: 2.46 +/- 0.00, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 523, id: 522, d: 2.16, u: 2.51, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     TYR114  HE1 -  TYR114  HD1    d: 2.43 +/- 0.01, weight: 0.5

     TYR114  HE2 -  TYR114  HD2    d: 2.44 +/- 0.02, weight: 0.5

ref_spec: h2o-noesy, ref_peak: 524, id: 523, d: 2.95, u: 3.70, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     TYR114   HA -  TYR114  HD1    d: 3.21 +/- 0.26, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 525, id: 524, d: 4.50, u: 4.93, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA108  HB1 -  TYR114  HE2    d: 3.87 +/- 0.47, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 526, id: 525, d: 4.23, u: 4.36, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: S
     ALA108  HB1 -  TYR114  HD2    d: 4.10 +/- 0.31, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 527, id: 526, d: 4.86, u: 4.79, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39 HG21 -   TRP51  HZ2    d: 4.90 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 528, id: 527, d: 2.08, u: 5.57, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111  HB2 -   PHE38   HZ    d: 2.74 +/- 1.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 530, id: 529, d: 2.78, u: 4.37, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      TRP51    H -   ARG50    H    d: 3.22 +/- 0.44, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 531, id: 530, d: 4.73, u: 5.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      PRO49  HG2 -   TRP51  HZ2    d: 5.85 +/- 2.05, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 532, id: 531, d: 3.11, u: 3.04, u_viol: 0.07, %_viol: 0.0, viol: no, reliable: no, a_type: M
     ALA112  HB1 -   PHE38  HD1    d: 3.09 +/- 0.10, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 533, id: 532, d: 3.87, u: 4.25, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125  HB3 -  LEU126    H    d: 3.90 +/- 0.14, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 534, id: 533, d: 3.49, u: 3.63, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLN122   HA -  LEU125    H    d: 3.72 +/- 0.86, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 535, id: 534, d: 3.08, u: 3.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU126  HB2 -  THR127    H    d: 3.07 +/- 0.24, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 536, id: 535, d: 2.66, u: 3.92, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      HIS36   HA -   HIS36  HD2    d: 2.59 +/- 0.17, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 537, id: 536, d: 3.51, u: 5.18, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125   HA -  LEU126    H    d: 3.48 +/- 0.03, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 538, id: 537, d: 3.86, u: 4.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL43 HG11 -   GLY47    H    d: 4.64 +/- 0.21, weight: 0.4

      VAL43 HG11 -   GLY48    H    d: 4.22 +/- 1.07, weight: 0.6

ref_spec: h2o-noesy, ref_peak: 539, id: 538, d: 3.95, u: 5.13, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     LEU128 HD11 -  LEU125    H    d: 4.88 +/- 2.04, weight: 0.8
     LEU128 HD12 -  LEU125    H
     LEU128 HD13 -  LEU125    H

     LEU126 HD11 -  LEU125    H    d: 6.71 +/- 0.29, weight: 0.1
     LEU126 HD12 -  LEU125    H
     LEU126 HD13 -  LEU125    H

ref_spec: h2o-noesy, ref_peak: 540, id: 539, d: 4.81, u: 6.14, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     PRO111  HB2 -  TYR114  HE2    d: 4.49 +/- 0.62, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 541, id: 540, d: 2.60, u: 4.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39 HG21 -   TRP51  HH2    d: 2.83 +/- 0.27, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 542, id: 541, d: 4.08, u: 3.96, u_viol: 0.11, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39 HG21 -   HIS36  HD2    d: 4.10 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 543, id: 542, d: 5.05, u: 5.20, u_viol: 0.02, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLU31   HA -  CYS120    H    d: 4.83 +/- 0.20, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 544, id: 543, d: 4.14, u: 5.45, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     LEU125 HD21 -   ALA41    H    d: 4.57 +/- 0.51, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 545, id: 544, d: 4.98, u: 5.56, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   TRP51  HE3    d: 5.19 +/- 0.41, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 546, id: 545, d: 4.82, u: 5.18, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG11 -   TRP51  HE3    d: 5.36 +/- 1.19, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 547, id: 546, d: 2.20, u: 4.28, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     LEU128 HD11 -   PHE38  HE2    d: 3.54 +/- 2.20, weight: 0.6
     LEU128 HD12 -   PHE38  HE2
     LEU128 HD13 -   PHE38  HE2

     LEU128 HD11 -   PHE38   HZ    d: 4.00 +/- 1.72, weight: 0.3
     LEU128 HD12 -   PHE38   HZ
     LEU128 HD13 -   PHE38   HZ

ref_spec: h2o-noesy, ref_peak: 548, id: 547, d: 4.17, u: 5.06, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39 HG11 -   TRP51  HE3    d: 4.61 +/- 0.45, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 549, id: 548, d: 3.21, u: 3.83, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
     TYR131  HD2 -  TYR131    H    d: 3.15 +/- 0.51, weight: 0.9

ref_spec: h2o-noesy, ref_peak: 550, id: 549, d: 4.25, u: 4.49, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
      VAL45    H -   GLY47    H    d: 4.15 +/- 0.49, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 551, id: 550, d: 3.67, u: 4.36, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     THR109 HG21 -  TYR114  HD1    d: 5.04 +/- 1.14, weight: 0.2

     THR109 HG21 -  TYR114  HD2    d: 4.06 +/- 0.51, weight: 0.8

ref_spec: h2o-noesy, ref_peak: 552, id: 551, d: 2.72, u: 3.68, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD2 -   ARG44   HE    d: 2.81 +/- 0.06, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 553, id: 552, d: 4.21, u: 4.25, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD3 -   ARG44    H    d: 4.07 +/- 0.72, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 554, id: 553, d: 4.43, u: 5.15, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      ARG44  HD2 -   ARG44    H    d: 4.28 +/- 0.25, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 555, id: 554, d: 4.92, u: 5.95, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL39 HG21 -   TRP51  HE3    d: 5.17 +/- 0.56, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 556, id: 555, d: 2.69, u: 4.23, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     CYS115  HB2 -  CYS115    H    d: 2.55 +/- 0.11, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 557, id: 556, d: 5.74, u: 5.72, u_viol: 0.05, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD21 -   HIS37  HE1    d: 5.58 +/- 0.40, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 558, id: 557, d: 3.56, u: 4.94, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: A
      VAL39   HA -   ARG40    H    d: 3.57 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 559, id: 558, d: 3.86, u: 4.79, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
     GLY119    H -   LEU33    H    d: 4.00 +/- 0.22, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 560, id: 559, d: 2.66, u: 4.32, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      PHE38  HB2 -   PHE38    H    d: 2.70 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 561, id: 560, d: 3.98, u: 4.07, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: S
     CYS115  HB2 -   PHE38  HE2    d: 4.79 +/- 0.13, weight: 0.4

     CYS115  HB2 -  GLY119    H    d: 4.64 +/- 0.08, weight: 0.4

ref_spec: h2o-noesy, ref_peak: 562, id: 561, d: 4.55, u: 4.99, u_viol: 0.04, %_viol: 0.0, viol: no, reliable: no, a_type: M
      GLY47  HA3 -   TRP51  HD1    d: 4.72 +/- 0.36, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 563, id: 562, d: 4.54, u: 4.44, u_viol: 0.10, %_viol: 0.0, viol: no, reliable: no, a_type: S
     ASP124  HB2 -  TYR114  HE2    d: 6.50 +/- 2.11, weight: 0.3

     ASP124  HB2 -  GLN123 HE21    d: 6.11 +/- 1.56, weight: 0.5

     ASP124  HB2 -  TYR114  HE1    d: 6.87 +/- 0.58, weight: 0.2

ref_spec: h2o-noesy, ref_peak: 564, id: 563, d: 5.73, u: 5.87, u_viol: 0.01, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD11 -   TRP51  HH2    d: 5.18 +/- 1.12, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 565, id: 564, d: 5.15, u: 5.13, u_viol: 0.03, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD11 -   TRP51  HZ2    d: 4.92 +/- 0.55, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 566, id: 565, d: 3.64, u: 5.25, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU33 HD11 -  CYS120    H    d: 3.82 +/- 0.36, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 567, id: 566, d: 5.76, u: 5.71, u_viol: 0.06, %_viol: 0.0, viol: no, reliable: no, a_type: M
      VAL43 HG21 -   CYS46    H    d: 5.76 +/- 0.17, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 568, id: 567, d: 3.98, u: 5.54, u_viol: 0.00, %_viol: 0.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -   CYS46    H    d: 4.05 +/- 0.32, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 569, id: 568, d: 3.04, u: 2.81, u_viol: 0.23, %_viol: 30.0, viol: no, reliable: no, a_type: M
      VAL39 HG11 -   HIS36  HD2    d: 3.03 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 570, id: 569, d: 5.30, u: 5.03, u_viol: 0.27, %_viol: 10.0, viol: no, reliable: no, a_type: M
      LEU42 HD21 -  LEU128    H    d: 5.51 +/- 0.42, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 17, id: 586, d: 5.88, u: 5.00, u_viol: 0.88, %_viol: 100.0, viol: yes, reliable: no, a_type: M
     THR109   HB -  ASN110   HA    d: 5.41 +/- 0.18, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 24, id: 593, d: 4.84, u: 4.27, u_viol: 0.57, %_viol: 95.0, viol: yes, reliable: no, a_type: S
     ASN110  HB2 -  PRO111  HD2    d: 4.81 +/- 0.26, weight: 1.0
     ASN110  HB2 -  PRO111  HD3

ref_spec: d2o-noesy, ref_peak: 25, id: 594, d: 4.05, u: 3.79, u_viol: 0.38, %_viol: 50.0, viol: no, reliable: no, a_type: S
     ASN110  HB3 -  PRO111  HD2    d: 4.09 +/- 0.32, weight: 1.0
     ASN110  HB3 -  PRO111  HD3

ref_spec: d2o-noesy, ref_peak: 135, id: 704, d: 3.55, u: 2.98, u_viol: 0.57, %_viol: 90.0, viol: yes, reliable: no, a_type: S
      VAL39 HG11 -   VAL39   HA    d: 3.39 +/- 0.23, weight: 1.0
      VAL39 HG12 -   VAL39   HA
      VAL39 HG13 -   VAL39   HA

ref_spec: d2o-noesy, ref_peak: 199, id: 768, d: 3.56, u: 2.89, u_viol: 0.67, %_viol: 100.0, viol: yes, reliable: no, a_type: S
     LEU125 HD21 -  LEU125   HA    d: 3.49 +/- 0.21, weight: 1.0
     LEU125 HD22 -  LEU125   HA
     LEU125 HD23 -  LEU125   HA

ref_spec: d2o-noesy, ref_peak: 207, id: 776, d: 4.15, u: 3.46, u_viol: 0.69, %_viol: 100.0, viol: yes, reliable: no, a_type: A
     LEU125 HD11 -   ALA41   HA    d: 4.85 +/- 0.45, weight: 0.4
     LEU125 HD12 -   ALA41   HA
     LEU125 HD13 -   ALA41   HA

     LEU125 HD11 -  LEU125   HA    d: 4.54 +/- 0.14, weight: 0.6
     LEU125 HD12 -  LEU125   HA
     LEU125 HD13 -  LEU125   HA

ref_spec: d2o-noesy, ref_peak: 248, id: 817, d: 3.66, u: 3.09, u_viol: 0.57, %_viol: 100.0, viol: yes, reliable: no, a_type: A
      VAL45 HG21 -   ALA41   HA    d: 3.95 +/- 0.21, weight: 0.8
      VAL45 HG22 -   ALA41   HA
      VAL45 HG23 -   ALA41   HA

      VAL45 HG21 -  LEU125   HA    d: 5.23 +/- 0.09, weight: 0.1
      VAL45 HG22 -  LEU125   HA
      VAL45 HG23 -  LEU125   HA

ref_spec: d2o-noesy, ref_peak: 253, id: 822, d: 4.27, u: 3.68, u_viol: 0.59, %_viol: 100.0, viol: yes, reliable: no, a_type: A
      LEU33 HD21 -   ALA41   HA    d: 5.33 +/- 0.39, weight: 0.3
      LEU33 HD22 -   ALA41   HA
      LEU33 HD23 -   ALA41   HA

      VAL45 HG11 -  LEU125   HA    d: 4.95 +/- 0.37, weight: 0.5
      VAL45 HG12 -  LEU125   HA
      VAL45 HG13 -  LEU125   HA

ref_spec: d2o-noesy, ref_peak: 267, id: 836, d: 4.60, u: 3.23, u_viol: 1.37, %_viol: 100.0, viol: yes, reliable: no, a_type: M
     LEU128 HD11 -  LEU128   HA    d: 4.57 +/- 0.08, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 320, id: 889, d: 4.59, u: 4.42, u_viol: 0.23, %_viol: 25.0, viol: no, reliable: no, a_type: A
     ALA108  HB1 -  THR109   HB    d: 5.96 +/- 0.53, weight: 0.3
     ALA108  HB2 -  THR109   HB
     ALA108  HB3 -  THR109   HB

     ALA108  HB1 -  PRO111   HA    d: 5.39 +/- 0.67, weight: 0.6
     ALA108  HB2 -  PRO111   HA
     ALA108  HB3 -  PRO111   HA

ref_spec: d2o-noesy, ref_peak: 328, id: 897, d: 6.08, u: 5.13, u_viol: 0.95, %_viol: 100.0, viol: yes, reliable: no, a_type: S
     THR121 HG21 -  GLN122   HA    d: 6.42 +/- 0.06, weight: 0.7

     THR121 HG21 -  GLN123   HA    d: 7.62 +/- 0.19, weight: 0.3

ref_spec: d2o-noesy, ref_peak: 345, id: 914, d: 3.26, u: 3.37, u_viol: 0.44, %_viol: 20.0, viol: no, reliable: no, a_type: S
     TYR114  HB2 -  PRO111   HA    d: 3.75 +/- 0.22, weight: 1.0
     TYR114  HB3 -  PRO111   HA

ref_spec: d2o-noesy, ref_peak: 347, id: 916, d: 4.35, u: 3.83, u_viol: 0.72, %_viol: 75.0, viol: yes, reliable: no, a_type: S
      ARG50  HD2 -   ARG50   HA    d: 3.93 +/- 1.10, weight: 1.0
      ARG50  HD3 -   ARG50   HA

ref_spec: d2o-noesy, ref_peak: 360, id: 929, d: 5.39, u: 4.93, u_viol: 0.46, %_viol: 75.0, viol: yes, reliable: no, a_type: S
      VAL45 HG21 -  LEU126   HA    d: 5.58 +/- 0.13, weight: 0.9
      VAL45 HG22 -  LEU126   HA
      VAL45 HG23 -  LEU126   HA

ref_spec: d2o-noesy, ref_peak: 392, id: 961, d: 4.79, u: 4.40, u_viol: 0.47, %_viol: 65.0, viol: yes, reliable: no, a_type: A
      ALA41  HB1 -   ARG44  HB3    d: 5.72 +/- 0.23, weight: 0.5
      ALA41  HB2 -   ARG44  HB3
      ALA41  HB3 -   ARG44  HB3

      ARG30  HG3 -   GLU28  HB2    d: 5.71 +/- 0.53, weight: 0.5

ref_spec: d2o-noesy, ref_peak: 403, id: 972, d: 4.80, u: 4.12, u_viol: 0.69, %_viol: 100.0, viol: yes, reliable: no, a_type: M
     GLN123   HA -  ASP124   HA    d: 4.79 +/- 0.03, weight: 1.0

ref_spec: d2o-noesy, ref_peak: 457, id: 1026, d: 4.79, u: 4.28, u_viol: 0.51, %_viol: 100.0, viol: yes, reliable: no, a_type: S
      LEU42 HD21 -  LEU128   HA    d: 4.93 +/- 0.46, weight: 0.8
      LEU42 HD22 -  LEU128   HA
      LEU42 HD23 -  LEU128   HA

      LEU42 HD11 -  LEU128   HA    d: 5.99 +/- 0.64, weight: 0.2
      LEU42 HD12 -  LEU128   HA
      LEU42 HD13 -  LEU128   HA

ref_spec: h2o-noesy, ref_peak: 16, id: 15, d: 3.56, u: 3.13, u_viol: 0.43, %_viol: 100.0, viol: yes, reliable: no, a_type: M
      ARG44  HB3 -   ARG44    H    d: 3.47 +/- 0.01, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 164, id: 163, d: 4.33, u: 3.45, u_viol: 0.88, %_viol: 100.0, viol: yes, reliable: no, a_type: S
      VAL43 HG11 -   VAL43    H    d: 4.40 +/- 0.11, weight: 0.9
      VAL43 HG12 -   VAL43    H
      VAL43 HG13 -   VAL43    H

ref_spec: h2o-noesy, ref_peak: 178, id: 177, d: 4.41, u: 3.74, u_viol: 0.68, %_viol: 100.0, viol: yes, reliable: no, a_type: S
      VAL45 HG11 -   VAL45    H    d: 4.52 +/- 0.15, weight: 1.0
      VAL45 HG12 -   VAL45    H
      VAL45 HG13 -   VAL45    H

ref_spec: h2o-noesy, ref_peak: 253, id: 252, d: 4.12, u: 3.32, u_viol: 0.80, %_viol: 100.0, viol: yes, reliable: no, a_type: S
     LEU117 HD21 -  LEU117    H    d: 4.56 +/- 0.28, weight: 0.5
     LEU117 HD22 -  LEU117    H
     LEU117 HD23 -  LEU117    H

     LEU117 HD11 -  LEU117    H    d: 4.49 +/- 0.06, weight: 0.5
     LEU117 HD12 -  LEU117    H
     LEU117 HD13 -  LEU117    H

ref_spec: h2o-noesy, ref_peak: 295, id: 294, d: 4.70, u: 4.02, u_viol: 0.67, %_viol: 100.0, viol: yes, reliable: no, a_type: S
     LEU125 HD21 -  LEU125    H    d: 4.74 +/- 0.30, weight: 1.0
     LEU125 HD22 -  LEU125    H
     LEU125 HD23 -  LEU125    H

ref_spec: h2o-noesy, ref_peak: 305, id: 304, d: 4.65, u: 4.00, u_viol: 0.65, %_viol: 100.0, viol: yes, reliable: no, a_type: S
     LEU128 HD11 -  THR127    H    d: 5.42 +/- 0.33, weight: 0.4
     LEU128 HD12 -  THR127    H
     LEU128 HD13 -  THR127    H

     LEU126 HD11 -  THR127    H    d: 5.82 +/- 0.30, weight: 0.3
     LEU126 HD12 -  THR127    H
     LEU126 HD13 -  THR127    H

     LEU126 HD21 -  THR127    H    d: 5.59 +/- 0.05, weight: 0.3
     LEU126 HD22 -  THR127    H
     LEU126 HD23 -  THR127    H

ref_spec: h2o-noesy, ref_peak: 306, id: 305, d: 4.07, u: 3.40, u_viol: 0.68, %_viol: 100.0, viol: yes, reliable: no, a_type: S
     LEU126 HD11 -  LEU126    H    d: 4.57 +/- 0.24, weight: 0.5
     LEU126 HD12 -  LEU126    H
     LEU126 HD13 -  LEU126    H

     LEU126 HD21 -  LEU126    H    d: 4.60 +/- 0.31, weight: 0.5
     LEU126 HD22 -  LEU126    H
     LEU126 HD23 -  LEU126    H

ref_spec: h2o-noesy, ref_peak: 330, id: 329, d: 5.50, u: 4.62, u_viol: 1.18, %_viol: 75.0, viol: yes, reliable: no, a_type: S
      VAL45 HG11 -  GLN122 HE21    d: 5.60 +/- 1.30, weight: 0.9
      VAL45 HG12 -  GLN122 HE21
      VAL45 HG13 -  GLN122 HE21

ref_spec: h2o-noesy, ref_peak: 399, id: 398, d: 5.12, u: 4.38, u_viol: 0.74, %_viol: 100.0, viol: yes, reliable: no, a_type: M
      HIS36  HD2 -   HIS36    H    d: 5.07 +/- 0.09, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 418, id: 417, d: 4.33, u: 3.71, u_viol: 0.66, %_viol: 90.0, viol: yes, reliable: no, a_type: S
     LEU128 HD21 -  LEU128    H    d: 4.64 +/- 0.56, weight: 0.9
     LEU128 HD22 -  LEU128    H
     LEU128 HD23 -  LEU128    H

ref_spec: h2o-noesy, ref_peak: 420, id: 419, d: 5.13, u: 4.58, u_viol: 0.55, %_viol: 95.0, viol: yes, reliable: no, a_type: S
      VAL45 HG21 -   ARG44    H    d: 4.97 +/- 0.37, weight: 1.0
      VAL45 HG22 -   ARG44    H
      VAL45 HG23 -   ARG44    H

ref_spec: h2o-noesy, ref_peak: 464, id: 463, d: 4.08, u: 3.30, u_viol: 0.78, %_viol: 100.0, viol: yes, reliable: no, a_type: M
      PHE38  HB2 -   VAL39    H    d: 4.11 +/- 0.04, weight: 1.0

ref_spec: h2o-noesy, ref_peak: 529, id: 528, d: 4.98, u: 4.16, u_viol: 0.81, %_viol: 100.0, viol: yes, reliable: no, a_type: S
     LEU117 HD11 -  SER118    H    d: 5.64 +/- 0.12, weight: 0.5
     LEU117 HD12 -  SER118    H
     LEU117 HD13 -  SER118    H

     LEU117 HD21 -  SER118    H    d: 5.61 +/- 0.05, weight: 0.5
     LEU117 HD22 -  SER118    H
     LEU117 HD23 -  SER118    H


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA 106           HT1      ALA 106  -1.664  -1.608  16.929
    2    H2   ALA 106           HT2      ALA 106  -3.310  -1.966  16.786
    3    H3   ALA 106           HT3      ALA 106  -2.803  -0.723  17.814
    4    HA   ALA 106           HA       ALA 106  -3.735   0.175  15.789
    5    HB1  ALA 106           HB1      ALA 106  -1.932   1.373  16.960
    6    HB2  ALA 106           HB2      ALA 106  -1.913   1.663  15.220
    7    HB3  ALA 106           HB3      ALA 106  -0.748   0.554  15.941
    8    H    ALA 107           HN       ALA 107  -1.296  -2.260  15.327
    9    HA   ALA 107           HA       ALA 107  -1.015  -2.006  12.516
   10    HB1  ALA 107           HB1      ALA 107   0.024  -4.221  12.623
   11    HB2  ALA 107           HB2      ALA 107  -0.530  -4.399  14.287
   12    HB3  ALA 107           HB3      ALA 107   0.648  -3.152  13.879
   13    H    ALA 108           HN       ALA 108  -1.599  -3.901  11.040
   14    HA   ALA 108           HA       ALA 108  -4.324  -4.862  11.620
   15    HB1  ALA 108           HB1      ALA 108  -5.183  -3.890   9.802
   16    HB2  ALA 108           HB2      ALA 108  -3.828  -4.410   8.795
   17    HB3  ALA 108           HB3      ALA 108  -3.706  -2.924   9.746
   18    H    THR 109           HN       THR 109  -4.561  -6.114   9.060
   19    HA   THR 109           HA       THR 109  -3.239  -8.590   9.597
   20    HB   THR 109           HB       THR 109  -5.536  -8.369   8.586
   21    HG1  THR 109           HG1      THR 109  -3.573 -10.075   7.946
   22   HG21  THR 109          HG21      THR 109  -4.788  -6.516   6.985
   23   HG22  THR 109          HG22      THR 109  -5.844  -7.767   6.323
   24   HG23  THR 109          HG23      THR 109  -4.113  -7.811   5.991
   25    H    ASN 110           HN       ASN 110  -2.734  -9.371   6.873
   26    HA   ASN 110           HA       ASN 110  -0.088  -8.271   6.553
   27    HB2  ASN 110           HB2      ASN 110  -1.640 -10.412   5.097
   28    HB3  ASN 110           HB1      ASN 110  -0.053  -9.880   4.562
   29   HD21  ASN 110          HD21      ASN 110   1.729 -10.514   5.656
   30   HD22  ASN 110          HD22      ASN 110   1.698 -11.656   6.949
   31    HA   PRO 111           HA       PRO 111  -1.959  -5.025   4.015
   32    HB2  PRO 111           HB2      PRO 111   0.423  -3.795   3.424
   33    HB3  PRO 111           HB1      PRO 111  -0.527  -3.490   4.879
   34    HG2  PRO 111           HG2      PRO 111   1.845  -5.280   4.511
   35    HG3  PRO 111           HG1      PRO 111   1.476  -4.169   5.844
   36    HD2  PRO 111           HD2      PRO 111   1.065  -6.801   6.084
   37    HD3  PRO 111           HD1      PRO 111  -0.063  -5.627   6.796
   38    H    ALA 112           HN       ALA 112   0.900  -6.903   3.048
   39    HA   ALA 112           HA       ALA 112   0.852  -6.295   0.323
   40    HB1  ALA 112           HB1      ALA 112   1.604  -9.023   1.270
   41    HB2  ALA 112           HB2      ALA 112   2.557  -7.620   1.747
   42    HB3  ALA 112           HB3      ALA 112   2.365  -8.012   0.039
   43    H    ARG 113           HN       ARG 113  -0.800  -8.807   2.132
   44    HA   ARG 113           HA       ARG 113  -2.097  -9.939  -0.172
   45    HB2  ARG 113           HB2      ARG 113  -1.530 -11.024   2.144
   46    HB3  ARG 113           HB1      ARG 113  -3.055 -10.317   2.645
   47    HG2  ARG 113           HG2      ARG 113  -3.431 -12.590   2.002
   48    HG3  ARG 113           HG1      ARG 113  -4.188 -11.529   0.815
   49    HD2  ARG 113           HD2      ARG 113  -2.230 -11.828  -0.657
   50    HD3  ARG 113           HD1      ARG 113  -1.537 -12.941   0.523
   51    HE   ARG 113           HE       ARG 113  -4.136 -13.781  -0.211
   52   HH11  ARG 113          HH11      ARG 113  -0.873 -13.617  -1.425
   53   HH12  ARG 113          HH12      ARG 113  -1.058 -14.984  -2.473
   54   HH21  ARG 113          HH21      ARG 113  -4.387 -15.580  -1.586
   55   HH22  ARG 113          HH22      ARG 113  -3.055 -16.100  -2.564
   56    H    TYR 114           HN       TYR 114  -3.124  -7.975   2.563
   57    HA   TYR 114           HA       TYR 114  -5.810  -7.695   1.993
   58    HB2  TYR 114           HB2      TYR 114  -5.505  -6.862   4.037
   59    HB3  TYR 114           HB1      TYR 114  -3.831  -6.460   3.715
   60    HD1  TYR 114           HD1      TYR 114  -6.960  -5.057   2.205
   61    HD2  TYR 114           HD2      TYR 114  -3.521  -4.383   4.605
   62    HE1  TYR 114           HE1      TYR 114  -7.514  -2.681   2.317
   63    HE2  TYR 114           HE2      TYR 114  -4.051  -1.999   4.731
   64    HH   TYR 114           HH       TYR 114  -7.065  -0.743   3.799
   65    H    CYS 115           HN       CYS 115  -3.146  -5.587   0.830
   66    HA   CYS 115           HA       CYS 115  -4.987  -3.924  -0.606
   67    HB2  CYS 115           HB2      CYS 115  -2.068  -4.069  -1.301
   68    HB3  CYS 115           HB1      CYS 115  -3.165  -2.698  -1.380
   69    H    CYS 116           HN       CYS 116  -3.328  -6.880  -1.276
   70    HA   CYS 116           HA       CYS 116  -3.302  -6.776  -4.093
   71    HB2  CYS 116           HB2      CYS 116  -2.029  -8.441  -2.818
   72    HB3  CYS 116           HB1      CYS 116  -3.526  -9.179  -2.266
   73    H    LEU 117           HN       LEU 117  -5.757  -7.867  -1.796
   74    HA   LEU 117           HA       LEU 117  -7.551  -8.729  -3.862
   75    HB2  LEU 117           HB2      LEU 117  -7.561  -8.629  -0.908
   76    HB3  LEU 117           HB1      LEU 117  -9.110  -8.687  -1.714
   77    HG   LEU 117           HG       LEU 117  -6.905 -10.715  -2.078
   78   HD11  LEU 117          HD11      LEU 117  -7.807 -10.828   0.170
   79   HD12  LEU 117          HD12      LEU 117  -8.354 -12.210  -0.779
   80   HD13  LEU 117          HD13      LEU 117  -9.450 -10.862  -0.470
   81   HD21  LEU 117          HD21      LEU 117  -8.641 -12.037  -3.196
   82   HD22  LEU 117          HD22      LEU 117  -8.334 -10.517  -4.036
   83   HD23  LEU 117          HD23      LEU 117  -9.769 -10.692  -3.024
   84    H    SER 118           HN       SER 118  -7.393  -5.984  -1.607
   85    HA   SER 118           HA       SER 118  -9.603  -4.738  -3.096
   86    HB2  SER 118           HB2      SER 118 -10.002  -5.052  -0.683
   87    HB3  SER 118           HB1      SER 118  -8.581  -4.069  -0.330
   88    HG   SER 118           HG       SER 118 -10.514  -2.972  -2.008
   89    H    GLY 119           HN       GLY 119  -6.534  -3.829  -1.486
   90    HA2  GLY 119           HA2      GLY 119  -4.960  -2.602  -2.990
   91    HA3  GLY 119           HA1      GLY 119  -6.339  -1.593  -3.413
   92    H    CYS 120           HN       CYS 120  -4.087  -0.345  -2.462
   93    HA   CYS 120           HA       CYS 120  -5.045   0.578   0.121
   94    HB2  CYS 120           HB2      CYS 120  -2.263  -0.411  -0.359
   95    HB3  CYS 120           HB1      CYS 120  -2.653   0.682   0.956
   96    H    THR 121           HN       THR 121  -4.848   2.666   0.555
   97    HA   THR 121           HA       THR 121  -4.108   4.416  -1.615
   98    HB   THR 121           HB       THR 121  -4.808   6.241  -0.150
   99    HG1  THR 121           HG1      THR 121  -5.389   4.272   1.819
  100   HG21  THR 121          HG21      THR 121  -6.389   4.347  -1.223
  101   HG22  THR 121          HG22      THR 121  -6.962   5.871  -0.561
  102   HG23  THR 121          HG23      THR 121  -6.991   4.405   0.425
  103    H    GLN 122           HN       GLN 122  -2.668   6.227  -1.310
  104    HA   GLN 122           HA       GLN 122  -0.122   5.521  -0.413
  105    HB2  GLN 122           HB2      GLN 122  -1.471   8.153  -0.989
  106    HB3  GLN 122           HB1      GLN 122   0.162   8.109  -0.354
  107    HG2  GLN 122           HG2      GLN 122   1.023   7.120  -2.257
  108    HG3  GLN 122           HG1      GLN 122  -0.545   6.509  -2.765
  109   HE21  GLN 122          HE21      GLN 122  -1.842   9.089  -2.220
  110   HE22  GLN 122          HE22      GLN 122  -1.390  10.128  -3.525
  111    H    GLN 123           HN       GLN 123  -2.935   6.462   1.332
  112    HA   GLN 123           HA       GLN 123  -1.573   7.459   3.625
  113    HB2  GLN 123           HB2      GLN 123  -4.309   6.206   3.418
  114    HB3  GLN 123           HB1      GLN 123  -3.704   7.152   4.759
  115    HG2  GLN 123           HG2      GLN 123  -3.571   9.119   3.343
  116    HG3  GLN 123           HG1      GLN 123  -4.134   8.172   1.967
  117   HE21  GLN 123          HE21      GLN 123  -6.283   7.492   1.898
  118   HE22  GLN 123          HE22      GLN 123  -7.504   8.226   2.876
  119    H    ASP 124           HN       ASP 124  -3.184   4.350   2.891
  120    HA   ASP 124           HA       ASP 124  -2.345   2.965   5.152
  121    HB2  ASP 124           HB2      ASP 124  -3.495   2.284   2.606
  122    HB3  ASP 124           HB1      ASP 124  -2.189   1.156   2.948
  123    H    LEU 125           HN       LEU 125  -0.810   3.074   1.960
  124    HA   LEU 125           HA       LEU 125   1.506   1.693   2.628
  125    HB2  LEU 125           HB2      LEU 125   1.110   3.813   0.509
  126    HB3  LEU 125           HB1      LEU 125   2.449   2.712   0.582
  127    HG   LEU 125           HG       LEU 125   0.085   1.153   0.668
  128   HD11  LEU 125          HD11      LEU 125  -1.381   2.104  -0.698
  129   HD12  LEU 125          HD12      LEU 125  -0.132   2.379  -1.911
  130   HD13  LEU 125          HD13      LEU 125  -0.409   3.576  -0.644
  131   HD21  LEU 125          HD21      LEU 125   2.365   0.641  -0.257
  132   HD22  LEU 125          HD22      LEU 125   1.906   1.610  -1.663
  133   HD23  LEU 125          HD23      LEU 125   1.000   0.149  -1.260
  134    H    LEU 126           HN       LEU 126   0.665   5.088   3.090
  135    HA   LEU 126           HA       LEU 126   3.260   6.044   3.649
  136    HB2  LEU 126           HB2      LEU 126   0.500   6.979   4.076
  137    HB3  LEU 126           HB1      LEU 126   1.661   7.601   5.225
  138    HG   LEU 126           HG       LEU 126   1.787   7.895   2.226
  139   HD11  LEU 126          HD11      LEU 126   0.092   9.294   3.276
  140   HD12  LEU 126          HD12      LEU 126   1.437  10.267   2.683
  141   HD13  LEU 126          HD13      LEU 126   1.293   9.918   4.406
  142   HD21  LEU 126          HD21      LEU 126   3.661   8.920   4.358
  143   HD22  LEU 126          HD22      LEU 126   3.718   9.354   2.649
  144   HD23  LEU 126          HD23      LEU 126   4.026   7.691   3.148
  145    H    THR 127           HN       THR 127   0.951   4.239   5.509
  146    HA   THR 127           HA       THR 127   2.564   4.583   7.930
  147    HB   THR 127           HB       THR 127   0.728   4.260   9.187
  148    HG1  THR 127           HG1      THR 127  -0.911   2.652   8.529
  149   HG21  THR 127          HG21      THR 127   0.015   5.797   7.228
  150   HG22  THR 127          HG22      THR 127  -1.227   5.153   8.298
  151   HG23  THR 127          HG23      THR 127  -0.960   4.419   6.718
  152    H    LEU 128           HN       LEU 128   2.463   2.490   5.336
  153    HA   LEU 128           HA       LEU 128   2.924   0.121   6.982
  154    HB2  LEU 128           HB2      LEU 128   2.603   0.425   4.004
  155    HB3  LEU 128           HB1      LEU 128   2.878  -1.088   4.827
  156    HG   LEU 128           HG       LEU 128   0.509   0.664   5.428
  157   HD11  LEU 128          HD11      LEU 128   0.522  -1.724   3.609
  158   HD12  LEU 128          HD12      LEU 128   0.580  -0.060   3.026
  159   HD13  LEU 128          HD13      LEU 128  -0.815  -0.625   3.946
  160   HD21  LEU 128          HD21      LEU 128   0.892  -0.851   7.172
  161   HD22  LEU 128          HD22      LEU 128   1.299  -2.139   6.045
  162   HD23  LEU 128          HD23      LEU 128  -0.369  -1.591   6.181
  163    H    CYS 129           HN       CYS 129   4.595   2.578   5.308
  164    HA   CYS 129           HA       CYS 129   6.982   1.134   4.719
  165    HB2  CYS 129           HB2      CYS 129   8.014   3.325   4.391
  166    HB3  CYS 129           HB1      CYS 129   6.441   3.263   3.612
  167    HA   PRO 130           HA       PRO 130   8.857   1.119   8.731
  168    HB2  PRO 130           HB2      PRO 130  11.520   1.031   7.708
  169    HB3  PRO 130           HB1      PRO 130  10.504  -0.326   8.190
  170    HG2  PRO 130           HG2      PRO 130  11.324   0.200   5.599
  171    HG3  PRO 130           HG1      PRO 130   9.936  -0.807   6.042
  172    HD2  PRO 130           HD2      PRO 130  10.005   2.045   5.145
  173    HD3  PRO 130           HD1      PRO 130   8.833   0.768   4.753
  174    H    TYR 131           HN       TYR 131   8.544   3.828   7.345
  175    HA   TYR 131           HA       TYR 131  10.423   5.239   9.088
  176    HB2  TYR 131           HB2      TYR 131  10.120   5.660   6.123
  177    HB3  TYR 131           HB1      TYR 131  10.686   6.952   7.176
  178    HD1  TYR 131           HD1      TYR 131  12.864   6.819   8.251
  179    HD2  TYR 131           HD2      TYR 131  11.508   3.718   5.673
  180    HE1  TYR 131           HE1      TYR 131  15.154   5.936   8.120
  181    HE2  TYR 131           HE2      TYR 131  13.795   2.825   5.536
  182    HH   TYR 131           HH       TYR 131  16.114   3.647   5.828
  183    H2   PRO  25           HT1      PRO  25  -0.132  12.756 -10.137
  184    H3   PRO  25           HT2      PRO  25  -0.012  13.641 -11.503
  185    HA   PRO  25           HA       PRO  25  -0.507  11.905 -12.573
  186    HB2  PRO  25           HB2      PRO  25   1.792  10.239 -12.063
  187    HB3  PRO  25           HB1      PRO  25   1.398  11.177 -13.512
  188    HG2  PRO  25           HG2      PRO  25   3.441  11.815 -11.812
  189    HG3  PRO  25           HG1      PRO  25   2.584  13.000 -12.814
  190    HD2  PRO  25           HD2      PRO  25   2.200  12.344  -9.906
  191    HD3  PRO  25           HD1      PRO  25   2.258  13.929 -10.697
  192    H    THR  26           HN       THR  26  -2.158  10.755 -11.814
  193    HA   THR  26           HA       THR  26  -3.406   9.251 -10.674
  194    HB   THR  26           HB       THR  26  -2.437   7.050 -10.235
  195    HG1  THR  26           HG1      THR  26   0.023   7.419 -11.243
  196   HG21  THR  26          HG21      THR  26  -1.508   8.256 -12.843
  197   HG22  THR  26          HG22      THR  26  -3.109   7.593 -12.516
  198   HG23  THR  26          HG23      THR  26  -1.700   6.533 -12.519
  199    HA   PRO  27           HA       PRO  27  -2.493  10.228  -6.385
  200    HB2  PRO  27           HB2      PRO  27  -5.029  10.478  -5.580
  201    HB3  PRO  27           HB1      PRO  27  -4.284  11.682  -6.638
  202    HG2  PRO  27           HG2      PRO  27  -6.306   9.620  -7.264
  203    HG3  PRO  27           HG1      PRO  27  -5.991  11.168  -8.062
  204    HD2  PRO  27           HD2      PRO  27  -5.110   8.551  -8.852
  205    HD3  PRO  27           HD1      PRO  27  -4.783  10.104  -9.651
  206    H    GLU  28           HN       GLU  28  -4.264   9.394  -4.391
  207    HA   GLU  28           HA       GLU  28  -3.540   6.611  -4.197
  208    HB2  GLU  28           HB2      GLU  28  -4.818   6.833  -1.963
  209    HB3  GLU  28           HB1      GLU  28  -3.280   7.646  -2.166
  210    HG2  GLU  28           HG2      GLU  28  -4.355   9.753  -2.489
  211    HG3  GLU  28           HG1      GLU  28  -5.941   8.986  -2.554
  212    H    MET  29           HN       MET  29  -4.771   5.951  -5.972
  213    HA   MET  29           HA       MET  29  -7.651   6.013  -5.830
  214    HB2  MET  29           HB2      MET  29  -6.270   6.136  -7.970
  215    HB3  MET  29           HB1      MET  29  -5.969   4.416  -7.750
  216    HG2  MET  29           HG2      MET  29  -8.341   3.950  -7.903
  217    HG3  MET  29           HG1      MET  29  -8.691   5.672  -8.036
  218    HE1  MET  29           HE1      MET  29  -9.792   3.521 -10.129
  219    HE2  MET  29           HE2      MET  29  -9.519   4.398 -11.635
  220    HE3  MET  29           HE3      MET  29 -10.113   5.253 -10.212
  221    H    ARG  30           HN       ARG  30  -5.776   4.543  -3.931
  222    HA   ARG  30           HA       ARG  30  -5.575   2.536  -2.845
  223    HB2  ARG  30           HB2      ARG  30  -7.998   3.667  -2.514
  224    HB3  ARG  30           HB1      ARG  30  -8.450   2.082  -3.133
  225    HG2  ARG  30           HG2      ARG  30  -6.440   1.721  -1.180
  226    HG3  ARG  30           HG1      ARG  30  -7.663   2.807  -0.517
  227    HD2  ARG  30           HD2      ARG  30  -9.370   1.193  -1.339
  228    HD3  ARG  30           HD1      ARG  30  -8.049   0.070  -1.655
  229    HE   ARG  30           HE       ARG  30  -7.671   0.786   0.926
  230   HH11  ARG  30          HH11      ARG  30 -10.417  -0.457  -0.821
  231   HH12  ARG  30          HH12      ARG  30 -11.082  -1.277   0.552
  232   HH21  ARG  30          HH21      ARG  30  -8.540  -0.292   2.740
  233   HH22  ARG  30          HH22      ARG  30 -10.017  -1.183   2.575
  234    H    GLU  31           HN       GLU  31  -5.167   2.189  -5.640
  235    HA   GLU  31           HA       GLU  31  -6.749   0.072  -6.644
  236    HB2  GLU  31           HB2      GLU  31  -4.999  -0.182  -8.350
  237    HB3  GLU  31           HB1      GLU  31  -5.454   1.505  -8.141
  238    HG2  GLU  31           HG2      GLU  31  -3.481   1.957  -6.889
  239    HG3  GLU  31           HG1      GLU  31  -3.075   0.244  -6.824
  240    H    LYS  32           HN       LYS  32  -6.078  -2.047  -7.100
  241    HA   LYS  32           HA       LYS  32  -5.370  -3.415  -4.781
  242    HB2  LYS  32           HB2      LYS  32  -5.408  -4.478  -7.590
  243    HB3  LYS  32           HB1      LYS  32  -5.618  -5.380  -6.101
  244    HG2  LYS  32           HG2      LYS  32  -7.639  -3.980  -5.648
  245    HG3  LYS  32           HG1      LYS  32  -7.483  -3.360  -7.284
  246    HD2  LYS  32           HD2      LYS  32  -7.678  -5.627  -8.176
  247    HD3  LYS  32           HD1      LYS  32  -7.820  -6.266  -6.540
  248    HE2  LYS  32           HE2      LYS  32  -9.856  -4.941  -6.234
  249    HE3  LYS  32           HE1      LYS  32  -9.725  -4.360  -7.890
  250    HZ1  LYS  32           HZ1      LYS  32 -10.060  -7.200  -7.081
  251    HZ2  LYS  32           HZ2      LYS  32  -9.959  -6.630  -8.671
  252    HZ3  LYS  32           HZ3      LYS  32 -11.281  -6.206  -7.704
  253    H    LEU  33           HN       LEU  33  -3.484  -3.292  -3.924
  254    HA   LEU  33           HA       LEU  33  -1.037  -3.426  -5.489
  255    HB2  LEU  33           HB2      LEU  33  -1.291  -3.030  -2.547
  256    HB3  LEU  33           HB1      LEU  33   0.036  -2.653  -3.609
  257    HG   LEU  33           HG       LEU  33  -2.611  -1.258  -3.645
  258   HD11  LEU  33          HD11      LEU  33  -1.835   0.282  -2.231
  259   HD12  LEU  33          HD12      LEU  33  -0.216   0.247  -2.921
  260   HD13  LEU  33          HD13      LEU  33  -0.700  -0.975  -1.745
  261   HD21  LEU  33          HD21      LEU  33  -1.877  -0.010  -5.408
  262   HD22  LEU  33          HD22      LEU  33  -1.007  -1.512  -5.757
  263   HD23  LEU  33          HD23      LEU  33  -0.182  -0.171  -4.952
  264    H    CYS  34           HN       CYS  34  -0.842  -5.550  -6.058
  265    HA   CYS  34           HA       CYS  34  -1.048  -7.620  -4.025
  266    HB2  CYS  34           HB2      CYS  34  -0.776  -7.594  -6.995
  267    HB3  CYS  34           HB1      CYS  34  -0.479  -9.072  -6.100
  268    H    GLY  35           HN       GLY  35   0.751  -7.088  -2.781
  269    HA2  GLY  35           HA2      GLY  35   2.915  -7.326  -2.066
  270    HA3  GLY  35           HA1      GLY  35   3.106  -8.493  -3.356
  271    H    HIS  36           HN       HIS  36   3.663  -7.630  -5.529
  272    HA   HIS  36           HA       HIS  36   5.754  -5.795  -5.382
  273    HB2  HIS  36           HB2      HIS  36   5.282  -7.623  -7.156
  274    HB3  HIS  36           HB1      HIS  36   4.347  -6.362  -7.962
  275    HD1  HIS  36           HD1      HIS  36   6.118  -6.330  -9.911
  276    HD2  HIS  36           HD2      HIS  36   7.558  -5.250  -6.155
  277    HE1  HIS  36           HE1      HIS  36   8.342  -5.219 -10.308
  278    H    HIS  37           HN       HIS  37   2.502  -5.361  -6.892
  279    HA   HIS  37           HA       HIS  37   2.755  -2.654  -7.506
  280    HB2  HIS  37           HB2      HIS  37   0.374  -4.194  -6.464
  281    HB3  HIS  37           HB1      HIS  37   0.274  -2.497  -6.921
  282    HD1  HIS  37           HD1      HIS  37  -0.924  -2.438  -9.076
  283    HD2  HIS  37           HD2      HIS  37   1.844  -5.518  -8.877
  284    HE1  HIS  37           HE1      HIS  37  -0.972  -3.550 -11.322
  285    H    PHE  38           HN       PHE  38   1.879  -4.334  -4.630
  286    HA   PHE  38           HA       PHE  38   1.418  -2.158  -2.946
  287    HB2  PHE  38           HB2      PHE  38   0.598  -4.322  -2.363
  288    HB3  PHE  38           HB1      PHE  38   2.208  -5.022  -2.445
  289    HD1  PHE  38           HD2      PHE  38   0.540  -2.170  -0.807
  290    HD2  PHE  38           HD1      PHE  38   3.148  -5.516  -0.417
  291    HE1  PHE  38           HE2      PHE  38   0.855  -1.649   1.582
  292    HE2  PHE  38           HE1      PHE  38   3.468  -5.007   1.974
  293    HZ   PHE  38           HZ       PHE  38   2.322  -3.064   2.978
  294    H    VAL  39           HN       VAL  39   4.272  -3.762  -4.017
  295    HA   VAL  39           HA       VAL  39   6.014  -2.629  -2.078
  296    HB   VAL  39           HB       VAL  39   6.316  -4.220  -4.565
  297   HG11  VAL  39          HG11      VAL  39   8.025  -3.066  -5.401
  298   HG12  VAL  39          HG12      VAL  39   8.937  -3.608  -3.994
  299   HG13  VAL  39          HG13      VAL  39   8.140  -2.044  -3.970
  300   HG21  VAL  39          HG21      VAL  39   6.439  -4.804  -1.955
  301   HG22  VAL  39          HG22      VAL  39   8.149  -4.500  -2.277
  302   HG23  VAL  39          HG23      VAL  39   7.282  -5.728  -3.198
  303    H    ARG  40           HN       ARG  40   5.817  -1.988  -5.608
  304    HA   ARG  40           HA       ARG  40   7.189   0.358  -5.684
  305    HB2  ARG  40           HB2      ARG  40   4.700  -0.353  -7.243
  306    HB3  ARG  40           HB1      ARG  40   5.785   0.972  -7.641
  307    HG2  ARG  40           HG2      ARG  40   6.861  -0.480  -8.920
  308    HG3  ARG  40           HG1      ARG  40   7.470  -1.197  -7.437
  309    HD2  ARG  40           HD2      ARG  40   6.009  -2.930  -7.522
  310    HD3  ARG  40           HD1      ARG  40   4.794  -2.023  -8.418
  311    HE   ARG  40           HE       ARG  40   7.291  -2.918  -9.697
  312   HH11  ARG  40          HH11      ARG  40   3.811  -2.780  -9.568
  313   HH12  ARG  40          HH12      ARG  40   3.596  -3.510 -11.123
  314   HH21  ARG  40          HH21      ARG  40   7.017  -3.882 -11.745
  315   HH22  ARG  40          HH22      ARG  40   5.417  -4.140 -12.359
  316    H    ALA  41           HN       ALA  41   3.575   0.187  -5.284
  317    HA   ALA  41           HA       ALA  41   3.255   2.910  -4.873
  318    HB1  ALA  41           HB1      ALA  41   1.146   2.408  -3.873
  319    HB2  ALA  41           HB2      ALA  41   1.653   0.783  -3.400
  320    HB3  ALA  41           HB3      ALA  41   1.420   1.179  -5.106
  321    H    LEU  42           HN       LEU  42   3.954   0.354  -2.422
  322    HA   LEU  42           HA       LEU  42   3.921   1.839  -0.125
  323    HB2  LEU  42           HB2      LEU  42   4.909  -0.636  -0.853
  324    HB3  LEU  42           HB1      LEU  42   6.345   0.206  -0.334
  325    HG   LEU  42           HG       LEU  42   3.858  -0.219   1.322
  326   HD11  LEU  42          HD11      LEU  42   4.957  -2.284   1.206
  327   HD12  LEU  42          HD12      LEU  42   5.537  -1.556   2.703
  328   HD13  LEU  42          HD13      LEU  42   6.553  -1.539   1.263
  329   HD21  LEU  42          HD21      LEU  42   4.583   1.559   2.451
  330   HD22  LEU  42          HD22      LEU  42   6.102   1.590   1.558
  331   HD23  LEU  42          HD23      LEU  42   5.933   0.545   2.969
  332    H    VAL  43           HN       VAL  43   6.384   1.754  -2.596
  333    HA   VAL  43           HA       VAL  43   8.185   3.541  -1.267
  334    HB   VAL  43           HB       VAL  43   8.412   3.192  -4.216
  335   HG11  VAL  43          HG11      VAL  43  10.684   3.175  -3.785
  336   HG12  VAL  43          HG12      VAL  43  10.460   2.462  -2.183
  337   HG13  VAL  43          HG13      VAL  43  10.095   4.174  -2.451
  338   HG21  VAL  43          HG21      VAL  43   7.601   1.024  -3.691
  339   HG22  VAL  43          HG22      VAL  43   8.654   0.929  -2.276
  340   HG23  VAL  43          HG23      VAL  43   9.348   0.914  -3.900
  341    H    ARG  44           HN       ARG  44   6.534   3.824  -4.375
  342    HA   ARG  44           HA       ARG  44   6.646   6.376  -5.086
  343    HB2  ARG  44           HB2      ARG  44   3.990   4.960  -4.795
  344    HB3  ARG  44           HB1      ARG  44   4.399   6.169  -5.986
  345    HG2  ARG  44           HG2      ARG  44   6.280   4.230  -6.435
  346    HG3  ARG  44           HG1      ARG  44   4.840   3.307  -6.002
  347    HD2  ARG  44           HD2      ARG  44   3.644   4.897  -7.661
  348    HD3  ARG  44           HD1      ARG  44   5.270   5.188  -8.268
  349    HE   ARG  44           HE       ARG  44   4.336   2.427  -8.058
  350   HH11  ARG  44          HH11      ARG  44   5.194   5.159 -10.046
  351   HH12  ARG  44          HH12      ARG  44   5.304   4.227 -11.501
  352   HH21  ARG  44          HH21      ARG  44   4.483   1.194  -9.967
  353   HH22  ARG  44          HH22      ARG  44   4.902   1.973 -11.456
  354    H    VAL  45           HN       VAL  45   4.686   5.102  -2.549
  355    HA   VAL  45           HA       VAL  45   3.405   7.485  -1.707
  356    HB   VAL  45           HB       VAL  45   3.773   4.841  -0.311
  357   HG11  VAL  45          HG11      VAL  45   2.206   7.263   0.322
  358   HG12  VAL  45          HG12      VAL  45   3.025   6.111   1.380
  359   HG13  VAL  45          HG13      VAL  45   1.482   5.689   0.650
  360   HG21  VAL  45          HG21      VAL  45   1.152   5.220  -1.349
  361   HG22  VAL  45          HG22      VAL  45   2.322   3.952  -1.694
  362   HG23  VAL  45          HG23      VAL  45   2.329   5.438  -2.645
  363    H    CYS  46           HN       CYS  46   5.706   5.348  -0.041
  364    HA   CYS  46           HA       CYS  46   6.583   7.638   1.612
  365    HB2  CYS  46           HB2      CYS  46   5.198   5.766   2.674
  366    HB3  CYS  46           HB1      CYS  46   6.590   4.735   2.417
  367    H    GLY  47           HN       GLY  47   7.515   4.409   0.563
  368    HA2  GLY  47           HA2      GLY  47   9.758   4.633  -0.787
  369    HA3  GLY  47           HA1      GLY  47  10.360   5.122   0.790
  370    H    GLY  48           HN       GLY  48  10.510   3.604   2.455
  371    HA2  GLY  48           HA2      GLY  48   9.717   1.244   3.041
  372    HA3  GLY  48           HA1      GLY  48  10.429   0.831   1.493
  373    HA   PRO  49           HA       PRO  49  13.825   0.039   4.386
  374    HB2  PRO  49           HB2      PRO  49  15.146  -1.696   2.788
  375    HB3  PRO  49           HB1      PRO  49  13.751  -2.153   3.766
  376    HG2  PRO  49           HG2      PRO  49  13.870  -1.506   0.860
  377    HG3  PRO  49           HG1      PRO  49  12.992  -2.806   1.688
  378    HD2  PRO  49           HD2      PRO  49  11.827  -0.504   0.896
  379    HD3  PRO  49           HD1      PRO  49  11.256  -1.412   2.282
  380    H    ARG  50           HN       ARG  50  14.788  -0.016   0.965
  381    HA   ARG  50           HA       ARG  50  16.295   2.441   1.224
  382    HB2  ARG  50           HB2      ARG  50  17.573  -0.245   0.940
  383    HB3  ARG  50           HB1      ARG  50  18.392   1.224   0.457
  384    HG2  ARG  50           HG2      ARG  50  18.343   2.053   2.721
  385    HG3  ARG  50           HG1      ARG  50  17.386   0.663   3.238
  386    HD2  ARG  50           HD2      ARG  50  20.179   0.529   2.107
  387    HD3  ARG  50           HD1      ARG  50  19.773   0.449   3.821
  388    HE   ARG  50           HE       ARG  50  18.366  -1.528   2.350
  389   HH11  ARG  50          HH11      ARG  50  21.512  -0.767   3.645
  390   HH12  ARG  50          HH12      ARG  50  21.989  -2.424   3.804
  391   HH21  ARG  50          HH21      ARG  50  18.988  -3.713   2.557
  392   HH22  ARG  50          HH22      ARG  50  20.556  -4.098   3.185
  393    H    TRP  51           HN       TRP  51  15.692  -0.472  -0.687
  394    HA   TRP  51           HA       TRP  51  15.316  -0.852  -2.864
  395    HB2  TRP  51           HB2      TRP  51  14.781   2.087  -3.109
  396    HB3  TRP  51           HB1      TRP  51  14.141   0.768  -4.067
  397    HD1  TRP  51           HD1      TRP  51  13.800   2.275  -0.554
  398    HE1  TRP  51           HE1      TRP  51  11.561   1.476   0.417
  399    HE3  TRP  51           HE3      TRP  51  12.533  -0.949  -4.201
  400    HZ2  TRP  51           HZ2      TRP  51   9.514  -0.361  -0.310
  401    HZ3  TRP  51           HZ3      TRP  51  10.436  -2.209  -4.007
  402    HH2  TRP  51           HH2      TRP  51   8.944  -1.875  -2.078
  403    H    SER  52           HN       SER  52  17.891   0.901  -1.821
  404    HA   SER  52           HA       SER  52  18.983   1.835  -4.279
  405    HB2  SER  52           HB2      SER  52  20.294   1.257  -1.617
  406    HB3  SER  52           HB1      SER  52  21.099   2.047  -2.973
  407    HG   SER  52           HG       SER  52  20.175   3.837  -2.404
  408    H    THR  53           HN       THR  53  20.395  -0.587  -2.175
  409    HA   THR  53           HA       THR  53  21.585  -2.474  -2.547
  410    HB   THR  53           HB       THR  53  20.644  -4.111  -4.119
  411    HG1  THR  53           HG1      THR  53  19.313  -3.525  -5.675
  412   HG21  THR  53          HG21      THR  53  18.516  -2.629  -2.572
  413   HG22  THR  53          HG22      THR  53  19.635  -3.811  -1.892
  414   HG23  THR  53          HG23      THR  53  18.446  -4.312  -3.095
  415    H    GLU  54           HN       GLU  54  20.779  -1.833  -5.954
  416    HA   GLU  54           HA       GLU  54  23.528  -2.240  -6.694
  417    HB2  GLU  54           HB2      GLU  54  21.809  -3.177  -8.104
  418    HB3  GLU  54           HB1      GLU  54  21.050  -1.604  -8.296
  419    HG2  GLU  54           HG2      GLU  54  22.973  -0.807  -9.530
  420    HG3  GLU  54           HG1      GLU  54  23.780  -2.358  -9.310
  421    H    ALA  55           HN       ALA  55  21.680   0.369  -5.719
  422    HA   ALA  55           HA       ALA  55  22.902   2.397  -7.340
  423    HB1  ALA  55           HB1      ALA  55  21.758   3.978  -5.870
  424    HB2  ALA  55           HB2      ALA  55  21.313   2.657  -4.790
  425    HB3  ALA  55           HB3      ALA  55  20.663   2.714  -6.427
  Start of MODEL    2
    1    H1   ALA 106           HT1      ALA 106   2.041  -2.281  13.066
    2    H2   ALA 106           HT2      ALA 106   3.548  -3.009  12.815
    3    H3   ALA 106           HT3      ALA 106   2.973  -2.776  14.390
    4    HA   ALA 106           HA       ALA 106   1.774  -4.559  12.351
    5    HB1  ALA 106           HB1      ALA 106   2.548  -6.386  13.772
    6    HB2  ALA 106           HB2      ALA 106   3.306  -5.226  14.862
    7    HB3  ALA 106           HB3      ALA 106   3.899  -5.402  13.212
    8    H    ALA 107           HN       ALA 107  -0.366  -4.208  12.609
    9    HA   ALA 107           HA       ALA 107  -1.551  -4.957  15.137
   10    HB1  ALA 107           HB1      ALA 107  -2.868  -2.936  15.410
   11    HB2  ALA 107           HB2      ALA 107  -2.097  -2.220  13.996
   12    HB3  ALA 107           HB3      ALA 107  -1.148  -2.555  15.444
   13    H    ALA 108           HN       ALA 108  -1.679  -4.414  11.766
   14    HA   ALA 108           HA       ALA 108  -4.476  -5.316  11.637
   15    HB1  ALA 108           HB1      ALA 108  -4.750  -3.848   9.994
   16    HB2  ALA 108           HB2      ALA 108  -3.444  -4.604   9.072
   17    HB3  ALA 108           HB3      ALA 108  -3.084  -3.310  10.224
   18    H    THR 109           HN       THR 109  -4.517  -6.268   9.080
   19    HA   THR 109           HA       THR 109  -3.378  -8.882   9.400
   20    HB   THR 109           HB       THR 109  -5.629  -8.424   8.357
   21    HG1  THR 109           HG1      THR 109  -4.918  -9.855   6.382
   22   HG21  THR 109          HG21      THR 109  -4.820  -6.477   6.976
   23   HG22  THR 109          HG22      THR 109  -5.787  -7.663   6.097
   24   HG23  THR 109          HG23      THR 109  -4.034  -7.648   5.916
   25    H    ASN 110           HN       ASN 110  -2.798  -9.442   6.673
   26    HA   ASN 110           HA       ASN 110  -0.107  -8.402   6.520
   27    HB2  ASN 110           HB2      ASN 110  -1.589 -10.343   4.721
   28    HB3  ASN 110           HB1      ASN 110   0.125  -9.949   4.593
   29   HD21  ASN 110          HD21      ASN 110   0.785 -12.041   4.957
   30   HD22  ASN 110          HD22      ASN 110   0.670 -12.802   6.504
   31    HA   PRO 111           HA       PRO 111  -1.793  -5.016   4.013
   32    HB2  PRO 111           HB2      PRO 111   0.609  -3.753   3.677
   33    HB3  PRO 111           HB1      PRO 111  -0.430  -3.546   5.086
   34    HG2  PRO 111           HG2      PRO 111   1.951  -5.335   4.748
   35    HG3  PRO 111           HG1      PRO 111   1.530  -4.281   6.113
   36    HD2  PRO 111           HD2      PRO 111   1.064  -6.905   6.224
   37    HD3  PRO 111           HD1      PRO 111  -0.102  -5.745   6.897
   38    H    ALA 112           HN       ALA 112   0.249  -7.548   3.160
   39    HA   ALA 112           HA       ALA 112   0.787  -6.600   0.468
   40    HB1  ALA 112           HB1      ALA 112   1.238  -9.356   1.601
   41    HB2  ALA 112           HB2      ALA 112   2.388  -8.028   1.724
   42    HB3  ALA 112           HB3      ALA 112   1.952  -8.667   0.141
   43    H    ARG 113           HN       ARG 113  -0.966  -9.292   1.941
   44    HA   ARG 113           HA       ARG 113  -2.417  -9.914  -0.456
   45    HB2  ARG 113           HB2      ARG 113  -2.194 -10.971   2.268
   46    HB3  ARG 113           HB1      ARG 113  -3.825 -11.074   1.625
   47    HG2  ARG 113           HG2      ARG 113  -2.689 -13.116   1.144
   48    HG3  ARG 113           HG1      ARG 113  -2.901 -12.235  -0.370
   49    HD2  ARG 113           HD2      ARG 113  -0.581 -11.394  -0.151
   50    HD3  ARG 113           HD1      ARG 113  -0.389 -12.386   1.293
   51    HE   ARG 113           HE       ARG 113  -1.242 -13.979  -0.879
   52   HH11  ARG 113          HH11      ARG 113   1.555 -12.291   0.337
   53   HH12  ARG 113          HH12      ARG 113   2.688 -13.338  -0.449
   54   HH21  ARG 113          HH21      ARG 113   0.243 -15.362  -1.915
   55   HH22  ARG 113          HH22      ARG 113   1.943 -15.085  -1.729
   56    H    TYR 114           HN       TYR 114  -2.795  -7.829   2.221
   57    HA   TYR 114           HA       TYR 114  -5.571  -7.385   2.220
   58    HB2  TYR 114           HB2      TYR 114  -4.492  -6.658   4.125
   59    HB3  TYR 114           HB1      TYR 114  -3.138  -5.995   3.239
   60    HD1  TYR 114           HD1      TYR 114  -6.505  -4.961   2.220
   61    HD2  TYR 114           HD2      TYR 114  -3.189  -4.096   4.737
   62    HE1  TYR 114           HE1      TYR 114  -7.364  -2.696   2.566
   63    HE2  TYR 114           HE2      TYR 114  -4.033  -1.833   5.099
   64    HH   TYR 114           HH       TYR 114  -7.183  -0.879   4.215
   65    H    CYS 115           HN       CYS 115  -2.969  -5.377   0.771
   66    HA   CYS 115           HA       CYS 115  -4.858  -3.804  -0.678
   67    HB2  CYS 115           HB2      CYS 115  -1.972  -4.029  -1.470
   68    HB3  CYS 115           HB1      CYS 115  -3.046  -2.641  -1.574
   69    H    CYS 116           HN       CYS 116  -3.078  -6.733  -1.331
   70    HA   CYS 116           HA       CYS 116  -3.221  -6.785  -4.115
   71    HB2  CYS 116           HB2      CYS 116  -1.908  -8.434  -2.899
   72    HB3  CYS 116           HB1      CYS 116  -3.351  -9.072  -2.135
   73    H    LEU 117           HN       LEU 117  -5.610  -7.557  -1.672
   74    HA   LEU 117           HA       LEU 117  -7.501  -8.645  -3.522
   75    HB2  LEU 117           HB2      LEU 117  -7.484  -7.968  -0.628
   76    HB3  LEU 117           HB1      LEU 117  -9.002  -8.296  -1.425
   77    HG   LEU 117           HG       LEU 117  -6.674 -10.212  -1.365
   78   HD11  LEU 117          HD11      LEU 117  -9.186 -10.184   0.301
   79   HD12  LEU 117          HD12      LEU 117  -7.552  -9.861   0.881
   80   HD13  LEU 117          HD13      LEU 117  -7.975 -11.466   0.281
   81   HD21  LEU 117          HD21      LEU 117  -9.552 -10.576  -2.194
   82   HD22  LEU 117          HD22      LEU 117  -8.327 -11.843  -2.132
   83   HD23  LEU 117          HD23      LEU 117  -8.161 -10.511  -3.276
   84    H    SER 118           HN       SER 118  -7.561  -5.720  -1.459
   85    HA   SER 118           HA       SER 118  -9.522  -4.577  -3.315
   86    HB2  SER 118           HB2      SER 118  -8.911  -4.034  -0.418
   87    HB3  SER 118           HB1      SER 118  -9.901  -2.948  -1.387
   88    HG   SER 118           HG       SER 118 -10.645  -5.171  -0.169
   89    H    GLY 119           HN       GLY 119  -6.440  -3.835  -1.698
   90    HA2  GLY 119           HA2      GLY 119  -4.820  -2.548  -2.975
   91    HA3  GLY 119           HA1      GLY 119  -6.157  -1.573  -3.576
   92    H    CYS 120           HN       CYS 120  -3.823  -0.514  -2.296
   93    HA   CYS 120           HA       CYS 120  -5.094   0.580   0.103
   94    HB2  CYS 120           HB2      CYS 120  -2.195  -0.168  -0.161
   95    HB3  CYS 120           HB1      CYS 120  -2.871   0.736   1.183
   96    H    THR 121           HN       THR 121  -4.709   2.689   0.654
   97    HA   THR 121           HA       THR 121  -4.112   4.408  -1.595
   98    HB   THR 121           HB       THR 121  -4.955   6.197  -0.333
   99    HG1  THR 121           HG1      THR 121  -5.420   5.658   2.046
  100   HG21  THR 121          HG21      THR 121  -6.609   4.526  -0.957
  101   HG22  THR 121          HG22      THR 121  -7.090   5.454   0.454
  102   HG23  THR 121          HG23      THR 121  -6.488   3.803   0.638
  103    H    GLN 122           HN       GLN 122  -2.811   6.344  -1.245
  104    HA   GLN 122           HA       GLN 122  -0.168   5.658  -0.443
  105    HB2  GLN 122           HB2      GLN 122  -1.557   8.097  -1.456
  106    HB3  GLN 122           HB1      GLN 122  -0.042   8.339  -0.601
  107    HG2  GLN 122           HG2      GLN 122   1.156   7.024  -2.153
  108    HG3  GLN 122           HG1      GLN 122  -0.323   6.417  -2.883
  109   HE21  GLN 122          HE21      GLN 122   0.110   9.757  -1.972
  110   HE22  GLN 122          HE22      GLN 122   0.176  10.394  -3.576
  111    H    GLN 123           HN       GLN 123  -2.826   6.231   1.394
  112    HA   GLN 123           HA       GLN 123  -1.381   7.574   3.526
  113    HB2  GLN 123           HB2      GLN 123  -4.216   6.622   3.212
  114    HB3  GLN 123           HB1      GLN 123  -3.582   7.170   4.746
  115    HG2  GLN 123           HG2      GLN 123  -3.135   9.357   3.822
  116    HG3  GLN 123           HG1      GLN 123  -3.665   8.814   2.232
  117   HE21  GLN 123          HE21      GLN 123  -5.860   7.232   3.352
  118   HE22  GLN 123          HE22      GLN 123  -7.076   8.369   3.813
  119    H    ASP 124           HN       ASP 124  -3.130   4.523   2.941
  120    HA   ASP 124           HA       ASP 124  -2.334   3.192   5.266
  121    HB2  ASP 124           HB2      ASP 124  -3.561   2.491   2.746
  122    HB3  ASP 124           HB1      ASP 124  -2.365   1.273   3.177
  123    H    LEU 125           HN       LEU 125  -0.903   3.132   2.030
  124    HA   LEU 125           HA       LEU 125   1.351   1.630   2.646
  125    HB2  LEU 125           HB2      LEU 125   0.929   3.721   0.509
  126    HB3  LEU 125           HB1      LEU 125   2.312   2.684   0.581
  127    HG   LEU 125           HG       LEU 125  -0.032   1.065   0.707
  128   HD11  LEU 125          HD11      LEU 125  -1.470   2.284  -0.504
  129   HD12  LEU 125          HD12      LEU 125  -0.439   1.855  -1.869
  130   HD13  LEU 125          HD13      LEU 125  -0.215   3.398  -1.045
  131   HD21  LEU 125          HD21      LEU 125   2.285   0.536  -0.116
  132   HD22  LEU 125          HD22      LEU 125   1.872   1.450  -1.573
  133   HD23  LEU 125          HD23      LEU 125   0.963  -0.006  -1.151
  134    H    LEU 126           HN       LEU 126   0.710   5.082   3.056
  135    HA   LEU 126           HA       LEU 126   3.344   5.908   3.585
  136    HB2  LEU 126           HB2      LEU 126   0.643   6.970   3.981
  137    HB3  LEU 126           HB1      LEU 126   1.783   7.508   5.196
  138    HG   LEU 126           HG       LEU 126   2.068   7.853   2.215
  139   HD11  LEU 126          HD11      LEU 126   0.374   9.308   3.155
  140   HD12  LEU 126          HD12      LEU 126   1.805  10.245   2.728
  141   HD13  LEU 126          HD13      LEU 126   1.490   9.836   4.413
  142   HD21  LEU 126          HD21      LEU 126   4.243   7.550   3.263
  143   HD22  LEU 126          HD22      LEU 126   3.853   8.778   4.468
  144   HD23  LEU 126          HD23      LEU 126   4.026   9.231   2.772
  145    H    THR 127           HN       THR 127   0.980   4.226   5.493
  146    HA   THR 127           HA       THR 127   2.601   4.523   7.909
  147    HB   THR 127           HB       THR 127   0.763   4.131   9.155
  148    HG1  THR 127           HG1      THR 127   0.432   2.002   8.791
  149   HG21  THR 127          HG21      THR 127   0.047   5.756   7.295
  150   HG22  THR 127          HG22      THR 127  -1.220   5.005   8.262
  151   HG23  THR 127          HG23      THR 127  -0.866   4.395   6.646
  152    H    LEU 128           HN       LEU 128   2.472   2.450   5.289
  153    HA   LEU 128           HA       LEU 128   2.979   0.064   6.887
  154    HB2  LEU 128           HB2      LEU 128   2.714   0.419   3.908
  155    HB3  LEU 128           HB1      LEU 128   2.951  -1.106   4.721
  156    HG   LEU 128           HG       LEU 128   0.587   0.664   5.279
  157   HD11  LEU 128          HD11      LEU 128   0.540  -1.729   3.479
  158   HD12  LEU 128          HD12      LEU 128   0.786  -0.099   2.854
  159   HD13  LEU 128          HD13      LEU 128  -0.703  -0.500   3.711
  160   HD21  LEU 128          HD21      LEU 128   0.875  -0.864   7.016
  161   HD22  LEU 128          HD22      LEU 128   1.363  -2.139   5.906
  162   HD23  LEU 128          HD23      LEU 128  -0.320  -1.621   5.959
  163    H    CYS 129           HN       CYS 129   4.650   2.553   5.242
  164    HA   CYS 129           HA       CYS 129   7.042   1.142   4.641
  165    HB2  CYS 129           HB2      CYS 129   8.073   3.351   4.410
  166    HB3  CYS 129           HB1      CYS 129   6.513   3.305   3.603
  167    HA   PRO 130           HA       PRO 130   8.880   1.017   8.668
  168    HB2  PRO 130           HB2      PRO 130  11.540   0.832   7.697
  169    HB3  PRO 130           HB1      PRO 130  10.447  -0.499   8.077
  170    HG2  PRO 130           HG2      PRO 130  11.378   0.167   5.534
  171    HG3  PRO 130           HG1      PRO 130   9.989  -0.874   5.888
  172    HD2  PRO 130           HD2      PRO 130  10.055   2.006   5.104
  173    HD3  PRO 130           HD1      PRO 130   8.876   0.746   4.677
  174    H    TYR 131           HN       TYR 131   9.305   3.635   6.669
  175    HA   TYR 131           HA       TYR 131  10.769   5.092   8.762
  176    HB2  TYR 131           HB2      TYR 131  11.234   5.163   5.786
  177    HB3  TYR 131           HB1      TYR 131  11.722   6.495   6.828
  178    HD1  TYR 131           HD2      TYR 131  12.216   2.869   6.214
  179    HD2  TYR 131           HD1      TYR 131  13.725   6.392   8.060
  180    HE1  TYR 131           HE2      TYR 131  14.317   1.697   6.719
  181    HE2  TYR 131           HE1      TYR 131  15.833   5.229   8.569
  182    HH   TYR 131           HH       TYR 131  16.659   2.234   7.191
  183    H2   PRO  25           HT1      PRO  25  -1.033  14.770  -8.026
  184    H3   PRO  25           HT2      PRO  25   0.170  14.803  -6.925
  185    HA   PRO  25           HA       PRO  25  -1.072  15.404  -5.296
  186    HB2  PRO  25           HB2      PRO  25  -3.239  16.899  -6.371
  187    HB3  PRO  25           HB1      PRO  25  -1.885  17.495  -5.402
  188    HG2  PRO  25           HG2      PRO  25  -2.220  17.447  -8.348
  189    HG3  PRO  25           HG1      PRO  25  -1.317  18.587  -7.334
  190    HD2  PRO  25           HD2      PRO  25  -0.030  16.789  -8.820
  191    HD3  PRO  25           HD1      PRO  25   0.539  17.175  -7.186
  192    H    THR  26           HN       THR  26  -1.411  13.033  -5.925
  193    HA   THR  26           HA       THR  26  -3.903  12.308  -7.117
  194    HB   THR  26           HB       THR  26  -3.370  10.013  -6.230
  195    HG1  THR  26           HG1      THR  26  -0.774  10.770  -5.640
  196   HG21  THR  26          HG21      THR  26  -2.686  10.643  -8.465
  197   HG22  THR  26          HG22      THR  26  -1.411   9.685  -7.712
  198   HG23  THR  26          HG23      THR  26  -1.244  11.437  -7.833
  199    HA   PRO  27           HA       PRO  27  -6.281  12.523  -3.344
  200    HB2  PRO  27           HB2      PRO  27  -8.658  11.914  -4.370
  201    HB3  PRO  27           HB1      PRO  27  -7.823  13.394  -4.858
  202    HG2  PRO  27           HG2      PRO  27  -8.175  10.843  -6.341
  203    HG3  PRO  27           HG1      PRO  27  -8.050  12.498  -6.960
  204    HD2  PRO  27           HD2      PRO  27  -5.978  10.550  -6.804
  205    HD3  PRO  27           HD1      PRO  27  -5.821  12.254  -7.278
  206    H    GLU  28           HN       GLU  28  -4.924  10.490  -2.729
  207    HA   GLU  28           HA       GLU  28  -4.688   8.280  -2.257
  208    HB2  GLU  28           HB2      GLU  28  -6.451   7.593  -0.643
  209    HB3  GLU  28           HB1      GLU  28  -5.607   9.066  -0.290
  210    HG2  GLU  28           HG2      GLU  28  -7.492  10.373  -1.066
  211    HG3  GLU  28           HG1      GLU  28  -8.342   8.897  -1.523
  212    H    MET  29           HN       MET  29  -5.023   7.882  -4.579
  213    HA   MET  29           HA       MET  29  -7.497   6.639  -5.372
  214    HB2  MET  29           HB2      MET  29  -5.485   7.789  -6.790
  215    HB3  MET  29           HB1      MET  29  -5.080   6.082  -6.944
  216    HG2  MET  29           HG2      MET  29  -7.171   5.583  -7.949
  217    HG3  MET  29           HG1      MET  29  -7.786   7.197  -7.599
  218    HE1  MET  29           HE1      MET  29  -4.189   6.292  -8.866
  219    HE2  MET  29           HE2      MET  29  -4.379   6.409 -10.616
  220    HE3  MET  29           HE3      MET  29  -5.185   5.116  -9.725
  221    H    ARG  30           HN       ARG  30  -8.045   4.777  -4.639
  222    HA   ARG  30           HA       ARG  30  -6.157   2.930  -3.522
  223    HB2  ARG  30           HB2      ARG  30  -9.075   3.240  -3.574
  224    HB3  ARG  30           HB1      ARG  30  -8.512   1.576  -3.547
  225    HG2  ARG  30           HG2      ARG  30  -6.938   2.779  -1.660
  226    HG3  ARG  30           HG1      ARG  30  -8.487   3.599  -1.463
  227    HD2  ARG  30           HD2      ARG  30  -9.604   1.472  -1.227
  228    HD3  ARG  30           HD1      ARG  30  -8.086   0.621  -1.496
  229    HE   ARG  30           HE       ARG  30  -7.905   2.430   0.678
  230   HH11  ARG  30          HH11      ARG  30  -9.100  -0.714  -0.228
  231   HH12  ARG  30          HH12      ARG  30  -9.018  -1.353   1.380
  232   HH21  ARG  30          HH21      ARG  30  -7.795   1.599   2.802
  233   HH22  ARG  30          HH22      ARG  30  -8.278  -0.036   3.103
  234    H    GLU  31           HN       GLU  31  -5.167   1.354  -4.547
  235    HA   GLU  31           HA       GLU  31  -6.454   0.014  -6.791
  236    HB2  GLU  31           HB2      GLU  31  -4.336   0.099  -8.106
  237    HB3  GLU  31           HB1      GLU  31  -5.125   1.662  -7.925
  238    HG2  GLU  31           HG2      GLU  31  -3.572   2.287  -6.196
  239    HG3  GLU  31           HG1      GLU  31  -2.837   0.691  -6.257
  240    H    LYS  32           HN       LYS  32  -5.930  -2.063  -7.050
  241    HA   LYS  32           HA       LYS  32  -5.196  -3.482  -4.780
  242    HB2  LYS  32           HB2      LYS  32  -5.212  -4.488  -7.612
  243    HB3  LYS  32           HB1      LYS  32  -5.440  -5.419  -6.143
  244    HG2  LYS  32           HG2      LYS  32  -7.456  -3.934  -5.706
  245    HG3  LYS  32           HG1      LYS  32  -7.293  -3.431  -7.383
  246    HD2  LYS  32           HD2      LYS  32  -7.551  -5.717  -8.136
  247    HD3  LYS  32           HD1      LYS  32  -7.597  -6.291  -6.470
  248    HE2  LYS  32           HE2      LYS  32  -9.618  -4.893  -6.130
  249    HE3  LYS  32           HE1      LYS  32  -9.606  -4.523  -7.851
  250    HZ1  LYS  32           HZ1      LYS  32  -9.869  -7.232  -6.658
  251    HZ2  LYS  32           HZ2      LYS  32  -9.838  -6.888  -8.314
  252    HZ3  LYS  32           HZ3      LYS  32 -11.120  -6.332  -7.360
  253    H    LEU  33           HN       LEU  33  -3.312  -3.559  -3.890
  254    HA   LEU  33           HA       LEU  33  -0.867  -3.654  -5.497
  255    HB2  LEU  33           HB2      LEU  33  -0.871  -3.252  -2.572
  256    HB3  LEU  33           HB1      LEU  33   0.217  -2.686  -3.808
  257    HG   LEU  33           HG       LEU  33  -2.556  -1.651  -3.485
  258   HD11  LEU  33          HD11      LEU  33  -1.851  -0.006  -2.106
  259   HD12  LEU  33          HD12      LEU  33  -0.228   0.027  -2.793
  260   HD13  LEU  33          HD13      LEU  33  -0.674  -1.233  -1.640
  261   HD21  LEU  33          HD21      LEU  33  -2.125  -0.303  -5.248
  262   HD22  LEU  33          HD22      LEU  33  -0.996  -1.599  -5.668
  263   HD23  LEU  33          HD23      LEU  33  -0.416  -0.143  -4.845
  264    H    CYS  34           HN       CYS  34  -0.587  -5.767  -5.983
  265    HA   CYS  34           HA       CYS  34  -0.673  -7.695  -3.786
  266    HB2  CYS  34           HB2      CYS  34  -1.777  -7.971  -6.145
  267    HB3  CYS  34           HB1      CYS  34  -0.174  -8.526  -6.602
  268    H    GLY  35           HN       GLY  35   1.158  -7.445  -2.721
  269    HA2  GLY  35           HA2      GLY  35   3.380  -7.652  -2.196
  270    HA3  GLY  35           HA1      GLY  35   3.498  -8.701  -3.591
  271    H    HIS  36           HN       HIS  36   4.012  -7.718  -5.684
  272    HA   HIS  36           HA       HIS  36   5.986  -5.755  -5.465
  273    HB2  HIS  36           HB2      HIS  36   5.601  -7.561  -7.312
  274    HB3  HIS  36           HB1      HIS  36   4.671  -6.280  -8.093
  275    HD1  HIS  36           HD1      HIS  36   6.569  -6.233  -9.970
  276    HD2  HIS  36           HD2      HIS  36   7.751  -5.098  -6.140
  277    HE1  HIS  36           HE1      HIS  36   8.778  -5.046 -10.239
  278    H    HIS  37           HN       HIS  37   2.705  -5.465  -6.967
  279    HA   HIS  37           HA       HIS  37   2.838  -2.719  -7.472
  280    HB2  HIS  37           HB2      HIS  37   0.565  -4.534  -6.725
  281    HB3  HIS  37           HB1      HIS  37   0.302  -2.792  -6.784
  282    HD1  HIS  37           HD1      HIS  37  -0.954  -2.419  -8.904
  283    HD2  HIS  37           HD2      HIS  37   2.219  -5.042  -9.336
  284    HE1  HIS  37           HE1      HIS  37  -0.831  -2.949 -11.360
  285    H    PHE  38           HN       PHE  38   2.129  -4.575  -4.665
  286    HA   PHE  38           HA       PHE  38   1.490  -2.476  -2.916
  287    HB2  PHE  38           HB2      PHE  38   0.783  -4.689  -2.398
  288    HB3  PHE  38           HB1      PHE  38   2.423  -5.308  -2.500
  289    HD1  PHE  38           HD2      PHE  38   0.809  -2.453  -0.836
  290    HD2  PHE  38           HD1      PHE  38   3.193  -5.962  -0.429
  291    HE1  PHE  38           HE2      PHE  38   1.121  -1.963   1.569
  292    HE2  PHE  38           HE1      PHE  38   3.501  -5.494   1.972
  293    HZ   PHE  38           HZ       PHE  38   2.473  -3.485   2.973
  294    H    VAL  39           HN       VAL  39   4.430  -3.845  -4.048
  295    HA   VAL  39           HA       VAL  39   6.090  -2.616  -2.085
  296    HB   VAL  39           HB       VAL  39   6.515  -4.168  -4.582
  297   HG11  VAL  39          HG11      VAL  39   8.136  -2.856  -5.377
  298   HG12  VAL  39          HG12      VAL  39   9.084  -3.419  -4.002
  299   HG13  VAL  39          HG13      VAL  39   8.208  -1.898  -3.899
  300   HG21  VAL  39          HG21      VAL  39   6.637  -4.786  -1.984
  301   HG22  VAL  39          HG22      VAL  39   8.325  -4.346  -2.260
  302   HG23  VAL  39          HG23      VAL  39   7.578  -5.622  -3.220
  303    H    ARG  40           HN       ARG  40   5.888  -1.998  -5.612
  304    HA   ARG  40           HA       ARG  40   7.116   0.408  -5.725
  305    HB2  ARG  40           HB2      ARG  40   4.644  -0.447  -7.235
  306    HB3  ARG  40           HB1      ARG  40   5.638   0.942  -7.658
  307    HG2  ARG  40           HG2      ARG  40   6.790  -0.441  -8.944
  308    HG3  ARG  40           HG1      ARG  40   7.452  -1.127  -7.468
  309    HD2  ARG  40           HD2      ARG  40   6.109  -2.947  -7.556
  310    HD3  ARG  40           HD1      ARG  40   4.813  -2.104  -8.402
  311    HE   ARG  40           HE       ARG  40   7.255  -2.567  -9.907
  312   HH11  ARG  40          HH11      ARG  40   4.023  -3.628  -9.151
  313   HH12  ARG  40          HH12      ARG  40   3.859  -4.571 -10.594
  314   HH21  ARG  40          HH21      ARG  40   7.045  -3.804 -11.808
  315   HH22  ARG  40          HH22      ARG  40   5.575  -4.671 -12.104
  316    H    ALA  41           HN       ALA  41   3.535   0.068  -5.221
  317    HA   ALA  41           HA       ALA  41   3.105   2.789  -4.859
  318    HB1  ALA  41           HB1      ALA  41   1.030   2.220  -3.828
  319    HB2  ALA  41           HB2      ALA  41   1.607   0.626  -3.336
  320    HB3  ALA  41           HB3      ALA  41   1.337   0.983  -5.044
  321    H    LEU  42           HN       LEU  42   3.860   0.295  -2.361
  322    HA   LEU  42           HA       LEU  42   3.829   1.811  -0.090
  323    HB2  LEU  42           HB2      LEU  42   4.820  -0.655  -0.782
  324    HB3  LEU  42           HB1      LEU  42   6.278   0.199  -0.345
  325    HG   LEU  42           HG       LEU  42   3.873  -0.248   1.419
  326   HD11  LEU  42          HD11      LEU  42   5.101  -2.255   1.282
  327   HD12  LEU  42          HD12      LEU  42   5.634  -1.478   2.773
  328   HD13  LEU  42          HD13      LEU  42   6.645  -1.406   1.332
  329   HD21  LEU  42          HD21      LEU  42   4.571   1.709   2.307
  330   HD22  LEU  42          HD22      LEU  42   6.177   1.570   1.600
  331   HD23  LEU  42          HD23      LEU  42   5.782   0.672   3.066
  332    H    VAL  43           HN       VAL  43   6.315   1.737  -2.553
  333    HA   VAL  43           HA       VAL  43   8.090   3.568  -1.249
  334    HB   VAL  43           HB       VAL  43   8.269   3.217  -4.206
  335   HG11  VAL  43          HG11      VAL  43  10.570   3.154  -3.801
  336   HG12  VAL  43          HG12      VAL  43  10.340   2.591  -2.142
  337   HG13  VAL  43          HG13      VAL  43   9.981   4.273  -2.567
  338   HG21  VAL  43          HG21      VAL  43   7.529   1.041  -3.709
  339   HG22  VAL  43          HG22      VAL  43   8.519   0.978  -2.243
  340   HG23  VAL  43          HG23      VAL  43   9.287   0.951  -3.836
  341    H    ARG  44           HN       ARG  44   6.362   3.819  -4.322
  342    HA   ARG  44           HA       ARG  44   6.413   6.373  -5.042
  343    HB2  ARG  44           HB2      ARG  44   3.858   4.788  -4.728
  344    HB3  ARG  44           HB1      ARG  44   4.098   6.117  -5.833
  345    HG2  ARG  44           HG2      ARG  44   6.135   4.308  -6.388
  346    HG3  ARG  44           HG1      ARG  44   4.673   3.345  -6.152
  347    HD2  ARG  44           HD2      ARG  44   4.360   5.787  -7.756
  348    HD3  ARG  44           HD1      ARG  44   5.347   4.514  -8.451
  349    HE   ARG  44           HE       ARG  44   3.081   3.251  -7.577
  350   HH11  ARG  44          HH11      ARG  44   3.788   5.854  -9.788
  351   HH12  ARG  44          HH12      ARG  44   2.409   5.546 -10.790
  352   HH21  ARG  44          HH21      ARG  44   1.267   2.841  -8.889
  353   HH22  ARG  44          HH22      ARG  44   0.978   3.831 -10.280
  354    H    VAL  45           HN       VAL  45   4.539   5.037  -2.481
  355    HA   VAL  45           HA       VAL  45   3.143   7.347  -1.634
  356    HB   VAL  45           HB       VAL  45   3.667   4.722  -0.252
  357   HG11  VAL  45          HG11      VAL  45   1.906   7.028   0.386
  358   HG12  VAL  45          HG12      VAL  45   2.937   6.060   1.436
  359   HG13  VAL  45          HG13      VAL  45   1.420   5.395   0.837
  360   HG21  VAL  45          HG21      VAL  45   1.009   5.038  -1.277
  361   HG22  VAL  45          HG22      VAL  45   2.190   3.769  -1.577
  362   HG23  VAL  45          HG23      VAL  45   2.195   5.226  -2.568
  363    H    CYS  46           HN       CYS  46   5.532   5.344   0.079
  364    HA   CYS  46           HA       CYS  46   6.227   7.685   1.742
  365    HB2  CYS  46           HB2      CYS  46   5.133   5.619   2.771
  366    HB3  CYS  46           HB1      CYS  46   6.628   4.777   2.421
  367    H    GLY  47           HN       GLY  47   7.455   4.840   0.118
  368    HA2  GLY  47           HA2      GLY  47   9.525   4.949  -1.138
  369    HA3  GLY  47           HA1      GLY  47  10.143   6.085   0.049
  370    H    GLY  48           HN       GLY  48   8.353   3.645   1.474
  371    HA2  GLY  48           HA2      GLY  48   9.091   2.194   3.138
  372    HA3  GLY  48           HA1      GLY  48   9.600   1.352   1.687
  373    HA   PRO  49           HA       PRO  49  13.481   1.569   4.000
  374    HB2  PRO  49           HB2      PRO  49  14.741  -0.355   2.563
  375    HB3  PRO  49           HB1      PRO  49  13.562  -0.717   3.823
  376    HG2  PRO  49           HG2      PRO  49  13.156  -0.596   0.865
  377    HG3  PRO  49           HG1      PRO  49  12.631  -1.842   2.016
  378    HD2  PRO  49           HD2      PRO  49  10.971   0.073   1.160
  379    HD3  PRO  49           HD1      PRO  49  10.871  -0.546   2.797
  380    H    ARG  50           HN       ARG  50  15.597   0.663   1.933
  381    HA   ARG  50           HA       ARG  50  16.349   3.322   1.132
  382    HB2  ARG  50           HB2      ARG  50  17.638   0.674   0.622
  383    HB3  ARG  50           HB1      ARG  50  18.391   2.233   0.331
  384    HG2  ARG  50           HG2      ARG  50  18.279   2.729   2.727
  385    HG3  ARG  50           HG1      ARG  50  17.549   1.149   3.014
  386    HD2  ARG  50           HD2      ARG  50  19.524   0.027   2.268
  387    HD3  ARG  50           HD1      ARG  50  20.238   1.541   1.715
  388    HE   ARG  50           HE       ARG  50  19.630   1.515   4.522
  389   HH11  ARG  50          HH11      ARG  50  21.984   0.663   2.099
  390   HH12  ARG  50          HH12      ARG  50  23.323   0.710   3.197
  391   HH21  ARG  50          HH21      ARG  50  21.386   1.578   5.977
  392   HH22  ARG  50          HH22      ARG  50  22.983   1.229   5.402
  393    H    TRP  51           HN       TRP  51  15.845   0.276  -0.657
  394    HA   TRP  51           HA       TRP  51  15.309  -0.186  -2.784
  395    HB2  TRP  51           HB2      TRP  51  14.486   2.687  -3.014
  396    HB3  TRP  51           HB1      TRP  51  13.972   1.329  -3.985
  397    HD1  TRP  51           HD1      TRP  51  13.487   2.788  -0.488
  398    HE1  TRP  51           HE1      TRP  51  11.324   1.779   0.479
  399    HE3  TRP  51           HE3      TRP  51  12.583  -0.583  -4.099
  400    HZ2  TRP  51           HZ2      TRP  51   9.473  -0.252  -0.251
  401    HZ3  TRP  51           HZ3      TRP  51  10.612  -2.042  -3.917
  402    HH2  TRP  51           HH2      TRP  51   9.076  -1.837  -2.005
  403    H    SER  52           HN       SER  52  17.856   1.442  -1.898
  404    HA   SER  52           HA       SER  52  19.800   2.125  -2.836
  405    HB2  SER  52           HB2      SER  52  18.651   0.648  -5.204
  406    HB3  SER  52           HB1      SER  52  20.304   1.252  -5.125
  407    HG   SER  52           HG       SER  52  20.415  -0.050  -3.111
  408    H    THR  53           HN       THR  53  20.705   3.356  -4.871
  409    HA   THR  53           HA       THR  53  18.787   5.130  -6.125
  410    HB   THR  53           HB       THR  53  20.040   7.182  -5.327
  411    HG1  THR  53           HG1      THR  53  20.927   6.603  -3.058
  412   HG21  THR  53          HG21      THR  53  18.495   5.590  -3.277
  413   HG22  THR  53          HG22      THR  53  17.816   6.684  -4.484
  414   HG23  THR  53          HG23      THR  53  18.824   7.320  -3.184
  415    H    GLU  54           HN       GLU  54  22.229   4.581  -5.417
  416    HA   GLU  54           HA       GLU  54  22.840   4.537  -8.227
  417    HB2  GLU  54           HB2      GLU  54  24.689   6.302  -7.849
  418    HB3  GLU  54           HB1      GLU  54  23.038   6.845  -8.113
  419    HG2  GLU  54           HG2      GLU  54  22.782   6.973  -5.639
  420    HG3  GLU  54           HG1      GLU  54  24.512   6.670  -5.504
  421    H    ALA  55           HN       ALA  55  23.269   2.364  -7.309
  422    HA   ALA  55           HA       ALA  55  25.528   2.021  -5.573
  423    HB1  ALA  55           HB1      ALA  55  24.044  -0.009  -7.239
  424    HB2  ALA  55           HB2      ALA  55  23.677   0.425  -5.570
  425    HB3  ALA  55           HB3      ALA  55  25.203  -0.366  -5.959
  Start of MODEL    3
    1    H1   ALA 106           HT1      ALA 106  -0.616  -0.391  11.129
    2    H2   ALA 106           HT2      ALA 106   0.705   0.561  10.670
    3    H3   ALA 106           HT3      ALA 106   0.229   0.502  12.292
    4    HA   ALA 106           HA       ALA 106   1.333  -1.748  10.715
    5    HB1  ALA 106           HB1      ALA 106   2.543  -0.162  12.977
    6    HB2  ALA 106           HB2      ALA 106   3.009  -0.066  11.277
    7    HB3  ALA 106           HB3      ALA 106   3.276  -1.555  12.181
    8    H    ALA 107           HN       ALA 107  -1.114  -2.138  11.811
    9    HA   ALA 107           HA       ALA 107  -0.536  -4.127  13.829
   10    HB1  ALA 107           HB1      ALA 107  -2.085  -3.304  15.486
   11    HB2  ALA 107           HB2      ALA 107  -2.489  -1.920  14.469
   12    HB3  ALA 107           HB3      ALA 107  -0.872  -2.068  15.155
   13    H    ALA 108           HN       ALA 108  -1.687  -3.775  11.049
   14    HA   ALA 108           HA       ALA 108  -4.344  -4.965  11.478
   15    HB1  ALA 108           HB1      ALA 108  -5.032  -3.770   9.734
   16    HB2  ALA 108           HB2      ALA 108  -3.762  -4.450   8.710
   17    HB3  ALA 108           HB3      ALA 108  -3.442  -3.006   9.680
   18    H    THR 109           HN       THR 109  -4.580  -6.198   8.981
   19    HA   THR 109           HA       THR 109  -3.224  -8.672   9.481
   20    HB   THR 109           HB       THR 109  -5.556  -8.511   8.576
   21    HG1  THR 109           HG1      THR 109  -4.820 -10.487   8.176
   22   HG21  THR 109          HG21      THR 109  -4.930  -6.634   6.951
   23   HG22  THR 109          HG22      THR 109  -6.003  -7.899   6.345
   24   HG23  THR 109          HG23      THR 109  -4.294  -7.910   5.912
   25    H    ASN 110           HN       ASN 110  -2.945  -9.289   6.564
   26    HA   ASN 110           HA       ASN 110  -0.235  -8.349   6.271
   27    HB2  ASN 110           HB2      ASN 110  -1.944 -10.102   4.492
   28    HB3  ASN 110           HB1      ASN 110  -0.240  -9.766   4.222
   29   HD21  ASN 110          HD21      ASN 110   1.285 -10.697   5.549
   30   HD22  ASN 110          HD22      ASN 110   0.910 -12.011   6.601
   31    HA   PRO 111           HA       PRO 111  -1.854  -4.765   4.040
   32    HB2  PRO 111           HB2      PRO 111   0.505  -3.493   3.772
   33    HB3  PRO 111           HB1      PRO 111  -0.422  -3.472   5.271
   34    HG2  PRO 111           HG2      PRO 111   1.900  -5.217   4.522
   35    HG3  PRO 111           HG1      PRO 111   1.621  -4.323   6.029
   36    HD2  PRO 111           HD2      PRO 111   1.103  -6.947   5.842
   37    HD3  PRO 111           HD1      PRO 111   0.072  -5.865   6.802
   38    H    ALA 112           HN       ALA 112   0.190  -7.242   3.061
   39    HA   ALA 112           HA       ALA 112   0.618  -6.181   0.379
   40    HB1  ALA 112           HB1      ALA 112   1.398  -8.942   1.175
   41    HB2  ALA 112           HB2      ALA 112   2.274  -7.573   1.854
   42    HB3  ALA 112           HB3      ALA 112   2.217  -7.802   0.105
   43    H    ARG 113           HN       ARG 113  -1.042  -8.816   2.017
   44    HA   ARG 113           HA       ARG 113  -2.193  -9.872  -0.394
   45    HB2  ARG 113           HB2      ARG 113  -1.696 -11.042   1.904
   46    HB3  ARG 113           HB1      ARG 113  -3.303 -10.465   2.314
   47    HG2  ARG 113           HG2      ARG 113  -4.337 -11.791   0.727
   48    HG3  ARG 113           HG1      ARG 113  -2.859 -11.983  -0.219
   49    HD2  ARG 113           HD2      ARG 113  -1.909 -13.319   1.635
   50    HD3  ARG 113           HD1      ARG 113  -3.461 -13.210   2.467
   51    HE   ARG 113           HE       ARG 113  -3.634 -14.270  -0.203
   52   HH11  ARG 113          HH11      ARG 113  -3.120 -15.028   3.160
   53   HH12  ARG 113          HH12      ARG 113  -3.606 -16.682   2.993
   54   HH21  ARG 113          HH21      ARG 113  -4.272 -16.445  -0.431
   55   HH22  ARG 113          HH22      ARG 113  -4.260 -17.488   0.952
   56    H    TYR 114           HN       TYR 114  -3.496  -8.131   2.423
   57    HA   TYR 114           HA       TYR 114  -6.127  -7.955   1.620
   58    HB2  TYR 114           HB2      TYR 114  -6.368  -6.796   3.519
   59    HB3  TYR 114           HB1      TYR 114  -4.636  -6.961   3.738
   60    HD1  TYR 114           HD1      TYR 114  -6.959  -4.700   1.827
   61    HD2  TYR 114           HD2      TYR 114  -3.549  -5.027   4.356
   62    HE1  TYR 114           HE1      TYR 114  -6.743  -2.258   1.835
   63    HE2  TYR 114           HE2      TYR 114  -3.314  -2.576   4.371
   64    HH   TYR 114           HH       TYR 114  -3.975  -0.659   2.950
   65    H    CYS 115           HN       CYS 115  -3.396  -5.981   0.568
   66    HA   CYS 115           HA       CYS 115  -5.116  -4.150  -0.820
   67    HB2  CYS 115           HB2      CYS 115  -2.101  -4.445  -0.990
   68    HB3  CYS 115           HB1      CYS 115  -3.061  -3.176  -1.743
   69    H    CYS 116           HN       CYS 116  -3.377  -7.061  -1.654
   70    HA   CYS 116           HA       CYS 116  -3.347  -6.779  -4.428
   71    HB2  CYS 116           HB2      CYS 116  -2.189  -8.624  -3.309
   72    HB3  CYS 116           HB1      CYS 116  -3.718  -9.296  -2.779
   73    H    LEU 117           HN       LEU 117  -5.855  -8.074  -2.280
   74    HA   LEU 117           HA       LEU 117  -7.701  -8.499  -4.439
   75    HB2  LEU 117           HB2      LEU 117  -7.755  -8.810  -1.484
   76    HB3  LEU 117           HB1      LEU 117  -9.260  -8.807  -2.365
   77    HG   LEU 117           HG       LEU 117  -6.979 -10.725  -2.838
   78   HD11  LEU 117          HD11      LEU 117  -9.640 -11.169  -1.493
   79   HD12  LEU 117          HD12      LEU 117  -8.077 -11.084  -0.680
   80   HD13  LEU 117          HD13      LEU 117  -8.413 -12.396  -1.810
   81   HD21  LEU 117          HD21      LEU 117  -8.638 -11.938  -4.210
   82   HD22  LEU 117          HD22      LEU 117  -8.241 -10.348  -4.863
   83   HD23  LEU 117          HD23      LEU 117  -9.760 -10.595  -3.999
   84    H    SER 118           HN       SER 118  -7.230  -6.113  -1.883
   85    HA   SER 118           HA       SER 118  -9.474  -4.546  -2.963
   86    HB2  SER 118           HB2      SER 118  -9.476  -5.140  -0.506
   87    HB3  SER 118           HB1      SER 118  -8.054  -4.120  -0.328
   88    HG   SER 118           HG       SER 118 -10.447  -3.299  -0.114
   89    H    GLY 119           HN       GLY 119  -6.488  -3.675  -1.249
   90    HA2  GLY 119           HA2      GLY 119  -4.722  -2.579  -2.673
   91    HA3  GLY 119           HA1      GLY 119  -6.036  -1.569  -3.276
   92    H    CYS 120           HN       CYS 120  -3.653  -0.583  -1.956
   93    HA   CYS 120           HA       CYS 120  -4.818   0.372   0.575
   94    HB2  CYS 120           HB2      CYS 120  -2.035   1.005   0.419
   95    HB3  CYS 120           HB1      CYS 120  -2.877   0.039   1.620
   96    H    THR 121           HN       THR 121  -4.324   2.488   1.263
   97    HA   THR 121           HA       THR 121  -4.357   4.395  -0.949
   98    HB   THR 121           HB       THR 121  -5.080   6.040   0.674
   99    HG1  THR 121           HG1      THR 121  -5.334   4.294   2.796
  100   HG21  THR 121          HG21      THR 121  -6.643   4.269  -0.260
  101   HG22  THR 121          HG22      THR 121  -7.216   5.233   1.097
  102   HG23  THR 121          HG23      THR 121  -6.641   3.583   1.358
  103    H    GLN 122           HN       GLN 122  -3.002   6.262  -0.868
  104    HA   GLN 122           HA       GLN 122  -0.312   5.687  -0.221
  105    HB2  GLN 122           HB2      GLN 122  -1.834   8.084  -1.128
  106    HB3  GLN 122           HB1      GLN 122  -0.277   8.375  -0.370
  107    HG2  GLN 122           HG2      GLN 122   0.860   7.082  -1.993
  108    HG3  GLN 122           HG1      GLN 122  -0.647   6.443  -2.631
  109   HE21  GLN 122          HE21      GLN 122   1.478   9.184  -2.498
  110   HE22  GLN 122          HE22      GLN 122   0.765  10.062  -3.803
  111    H    GLN 123           HN       GLN 123  -2.873   6.289   1.795
  112    HA   GLN 123           HA       GLN 123  -1.324   7.628   3.834
  113    HB2  GLN 123           HB2      GLN 123  -4.090   6.429   3.864
  114    HB3  GLN 123           HB1      GLN 123  -3.360   7.285   5.201
  115    HG2  GLN 123           HG2      GLN 123  -3.269   9.320   3.886
  116    HG3  GLN 123           HG1      GLN 123  -3.933   8.463   2.496
  117   HE21  GLN 123          HE21      GLN 123  -6.100   7.804   2.536
  118   HE22  GLN 123          HE22      GLN 123  -7.245   8.529   3.611
  119    H    ASP 124           HN       ASP 124  -3.037   4.521   3.443
  120    HA   ASP 124           HA       ASP 124  -1.988   3.210   5.657
  121    HB2  ASP 124           HB2      ASP 124  -3.765   2.364   3.964
  122    HB3  ASP 124           HB1      ASP 124  -2.396   1.813   3.010
  123    H    LEU 125           HN       LEU 125  -0.800   3.200   2.310
  124    HA   LEU 125           HA       LEU 125   1.545   1.783   2.757
  125    HB2  LEU 125           HB2      LEU 125   0.974   3.884   0.654
  126    HB3  LEU 125           HB1      LEU 125   2.330   2.812   0.636
  127    HG   LEU 125           HG       LEU 125  -0.083   1.287   0.891
  128   HD11  LEU 125          HD11      LEU 125  -1.394   2.009  -0.818
  129   HD12  LEU 125          HD12      LEU 125  -0.026   2.660  -1.714
  130   HD13  LEU 125          HD13      LEU 125  -0.704   3.570  -0.369
  131   HD21  LEU 125          HD21      LEU 125   2.269   0.755  -0.028
  132   HD22  LEU 125          HD22      LEU 125   1.657   1.486  -1.521
  133   HD23  LEU 125          HD23      LEU 125   0.859   0.066  -0.832
  134    H    LEU 126           HN       LEU 126   0.837   5.224   3.179
  135    HA   LEU 126           HA       LEU 126   3.484   6.096   3.591
  136    HB2  LEU 126           HB2      LEU 126   0.781   7.136   4.077
  137    HB3  LEU 126           HB1      LEU 126   1.976   7.726   5.209
  138    HG   LEU 126           HG       LEU 126   2.111   7.972   2.209
  139   HD11  LEU 126          HD11      LEU 126   0.431   9.428   3.139
  140   HD12  LEU 126          HD12      LEU 126   1.836  10.383   2.661
  141   HD13  LEU 126          HD13      LEU 126   1.561  10.008   4.363
  142   HD21  LEU 126          HD21      LEU 126   4.336   7.754   3.186
  143   HD22  LEU 126          HD22      LEU 126   3.968   9.037   4.338
  144   HD23  LEU 126          HD23      LEU 126   4.062   9.399   2.615
  145    H    THR 127           HN       THR 127   1.251   4.354   5.575
  146    HA   THR 127           HA       THR 127   2.870   4.776   7.971
  147    HB   THR 127           HB       THR 127   1.104   4.071   9.258
  148    HG1  THR 127           HG1      THR 127  -0.438   2.554   8.541
  149   HG21  THR 127          HG21      THR 127   0.428   5.962   7.594
  150   HG22  THR 127          HG22      THR 127  -0.803   5.196   8.594
  151   HG23  THR 127          HG23      THR 127  -0.621   4.723   6.907
  152    H    LEU 128           HN       LEU 128   2.791   2.638   5.379
  153    HA   LEU 128           HA       LEU 128   3.498   0.306   6.973
  154    HB2  LEU 128           HB2      LEU 128   3.230   0.628   3.991
  155    HB3  LEU 128           HB1      LEU 128   3.495  -0.875   4.836
  156    HG   LEU 128           HG       LEU 128   1.087   0.830   5.371
  157   HD11  LEU 128          HD11      LEU 128   0.886  -1.553   3.632
  158   HD12  LEU 128          HD12      LEU 128   1.498  -0.062   2.914
  159   HD13  LEU 128          HD13      LEU 128  -0.097  -0.090   3.667
  160   HD21  LEU 128          HD21      LEU 128   1.387  -0.728   7.076
  161   HD22  LEU 128          HD22      LEU 128   1.922  -1.966   5.946
  162   HD23  LEU 128          HD23      LEU 128   0.227  -1.493   5.986
  163    H    CYS 129           HN       CYS 129   4.967   2.860   5.182
  164    HA   CYS 129           HA       CYS 129   7.453   1.588   4.649
  165    HB2  CYS 129           HB2      CYS 129   8.314   3.829   4.219
  166    HB3  CYS 129           HB1      CYS 129   6.734   3.633   3.476
  167    HA   PRO 130           HA       PRO 130   9.347   1.850   8.636
  168    HB2  PRO 130           HB2      PRO 130  11.998   1.936   7.549
  169    HB3  PRO 130           HB1      PRO 130  11.119   0.533   8.157
  170    HG2  PRO 130           HG2      PRO 130  11.817   0.913   5.517
  171    HG3  PRO 130           HG1      PRO 130  10.491  -0.126   6.067
  172    HD2  PRO 130           HD2      PRO 130  10.392   2.667   4.992
  173    HD3  PRO 130           HD1      PRO 130   9.289   1.305   4.689
  174    H    TYR 131           HN       TYR 131   9.244   4.423   6.641
  175    HA   TYR 131           HA       TYR 131  10.666   6.127   8.563
  176    HB2  TYR 131           HB2      TYR 131  10.915   6.228   5.554
  177    HB3  TYR 131           HB1      TYR 131  11.392   7.560   6.604
  178    HD1  TYR 131           HD1      TYR 131  13.280   7.268   8.185
  179    HD2  TYR 131           HD2      TYR 131  12.287   4.289   5.314
  180    HE1  TYR 131           HE1      TYR 131  15.490   6.240   8.499
  181    HE2  TYR 131           HE2      TYR 131  14.496   3.251   5.620
  182    HH   TYR 131           HH       TYR 131  16.544   4.014   8.192
  183    H2   PRO  25           HT1      PRO  25  -5.960  17.468  -2.786
  184    H3   PRO  25           HT2      PRO  25  -6.288  18.983  -3.301
  185    HA   PRO  25           HA       PRO  25  -6.654  18.174  -5.201
  186    HB2  PRO  25           HB2      PRO  25  -4.031  17.226  -5.941
  187    HB3  PRO  25           HB1      PRO  25  -4.875  18.689  -6.471
  188    HG2  PRO  25           HG2      PRO  25  -2.689  18.720  -4.833
  189    HG3  PRO  25           HG1      PRO  25  -3.935  19.979  -4.838
  190    HD2  PRO  25           HD2      PRO  25  -3.595  17.654  -2.963
  191    HD3  PRO  25           HD1      PRO  25  -3.997  19.342  -2.592
  192    H    THR  26           HN       THR  26  -4.002  15.934  -4.404
  193    HA   THR  26           HA       THR  26  -5.450  13.694  -5.423
  194    HB   THR  26           HB       THR  26  -3.541  12.346  -4.585
  195    HG1  THR  26           HG1      THR  26  -2.070  14.596  -3.914
  196   HG21  THR  26          HG21      THR  26  -1.831  13.344  -6.035
  197   HG22  THR  26          HG22      THR  26  -2.755  14.845  -6.087
  198   HG23  THR  26          HG23      THR  26  -3.421  13.375  -6.799
  199    HA   PRO  27           HA       PRO  27  -7.261  12.682  -1.437
  200    HB2  PRO  27           HB2      PRO  27  -9.231  11.148  -2.370
  201    HB3  PRO  27           HB1      PRO  27  -9.217  12.886  -2.685
  202    HG2  PRO  27           HG2      PRO  27  -8.673  10.637  -4.524
  203    HG3  PRO  27           HG1      PRO  27  -9.244  12.274  -4.886
  204    HD2  PRO  27           HD2      PRO  27  -6.553  11.240  -5.036
  205    HD3  PRO  27           HD1      PRO  27  -7.134  12.868  -5.451
  206    H    GLU  28           HN       GLU  28  -8.454  10.215  -0.994
  207    HA   GLU  28           HA       GLU  28  -6.122   8.538  -0.700
  208    HB2  GLU  28           HB2      GLU  28  -7.756   7.007   0.479
  209    HB3  GLU  28           HB1      GLU  28  -7.466   8.575   1.197
  210    HG2  GLU  28           HG2      GLU  28  -9.559   9.405   0.384
  211    HG3  GLU  28           HG1      GLU  28  -9.828   7.929  -0.540
  212    H    MET  29           HN       MET  29  -5.926   8.381  -2.998
  213    HA   MET  29           HA       MET  29  -7.810   6.761  -4.462
  214    HB2  MET  29           HB2      MET  29  -5.711   8.537  -5.136
  215    HB3  MET  29           HB1      MET  29  -5.281   6.954  -5.780
  216    HG2  MET  29           HG2      MET  29  -7.921   8.301  -6.268
  217    HG3  MET  29           HG1      MET  29  -6.537   8.416  -7.352
  218    HE1  MET  29           HE1      MET  29  -5.497   6.409  -8.641
  219    HE2  MET  29           HE2      MET  29  -6.102   4.753  -8.587
  220    HE3  MET  29           HE3      MET  29  -5.305   5.448  -7.175
  221    H    ARG  30           HN       ARG  30  -7.982   4.793  -3.923
  222    HA   ARG  30           HA       ARG  30  -5.828   3.181  -2.922
  223    HB2  ARG  30           HB2      ARG  30  -8.744   2.970  -3.222
  224    HB3  ARG  30           HB1      ARG  30  -7.859   1.459  -3.307
  225    HG2  ARG  30           HG2      ARG  30  -6.693   2.586  -1.162
  226    HG3  ARG  30           HG1      ARG  30  -8.319   3.259  -1.043
  227    HD2  ARG  30           HD2      ARG  30  -9.261   1.037  -1.137
  228    HD3  ARG  30           HD1      ARG  30  -7.648   0.352  -1.327
  229    HE   ARG  30           HE       ARG  30  -7.687   1.877   1.005
  230   HH11  ARG  30          HH11      ARG  30  -9.109  -1.043  -0.252
  231   HH12  ARG  30          HH12      ARG  30  -9.253  -1.795   1.302
  232   HH21  ARG  30          HH21      ARG  30  -7.873   0.894   3.057
  233   HH22  ARG  30          HH22      ARG  30  -8.551  -0.694   3.181
  234    H    GLU  31           HN       GLU  31  -5.360   1.035  -3.830
  235    HA   GLU  31           HA       GLU  31  -5.976   0.404  -6.527
  236    HB2  GLU  31           HB2      GLU  31  -3.791   0.700  -7.534
  237    HB3  GLU  31           HB1      GLU  31  -4.369   2.245  -6.925
  238    HG2  GLU  31           HG2      GLU  31  -2.948   2.058  -4.991
  239    HG3  GLU  31           HG1      GLU  31  -2.441   0.450  -5.493
  240    H    LYS  32           HN       LYS  32  -5.600  -1.613  -6.991
  241    HA   LYS  32           HA       LYS  32  -5.135  -3.414  -4.909
  242    HB2  LYS  32           HB2      LYS  32  -5.093  -3.980  -7.865
  243    HB3  LYS  32           HB1      LYS  32  -5.469  -5.098  -6.564
  244    HG2  LYS  32           HG2      LYS  32  -7.396  -3.622  -5.975
  245    HG3  LYS  32           HG1      LYS  32  -7.075  -2.730  -7.450
  246    HD2  LYS  32           HD2      LYS  32  -7.449  -4.704  -8.790
  247    HD3  LYS  32           HD1      LYS  32  -7.640  -5.691  -7.341
  248    HE2  LYS  32           HE2      LYS  32  -9.618  -4.442  -6.740
  249    HE3  LYS  32           HE1      LYS  32  -9.419  -3.392  -8.137
  250    HZ1  LYS  32           HZ1      LYS  32  -9.702  -5.351  -9.563
  251    HZ2  LYS  32           HZ2      LYS  32 -11.061  -5.072  -8.596
  252    HZ3  LYS  32           HZ3      LYS  32  -9.979  -6.309  -8.194
  253    H    LEU  33           HN       LEU  33  -3.331  -3.797  -3.989
  254    HA   LEU  33           HA       LEU  33  -0.805  -3.830  -5.482
  255    HB2  LEU  33           HB2      LEU  33  -1.311  -3.413  -2.581
  256    HB3  LEU  33           HB1      LEU  33   0.204  -3.371  -3.411
  257    HG   LEU  33           HG       LEU  33  -2.041  -1.421  -3.696
  258   HD11  LEU  33          HD11      LEU  33  -0.413  -1.251  -1.780
  259   HD12  LEU  33          HD12      LEU  33  -0.505   0.172  -2.810
  260   HD13  LEU  33          HD13      LEU  33   0.837  -0.954  -2.975
  261   HD21  LEU  33          HD21      LEU  33  -0.917  -0.365  -5.475
  262   HD22  LEU  33          HD22      LEU  33  -0.892  -2.082  -5.885
  263   HD23  LEU  33          HD23      LEU  33   0.548  -1.311  -5.220
  264    H    CYS  34           HN       CYS  34  -0.343  -5.914  -6.015
  265    HA   CYS  34           HA       CYS  34  -0.778  -7.979  -3.983
  266    HB2  CYS  34           HB2      CYS  34  -1.452  -8.034  -6.559
  267    HB3  CYS  34           HB1      CYS  34   0.148  -8.747  -6.682
  268    H    GLY  35           HN       GLY  35   0.963  -7.291  -2.736
  269    HA2  GLY  35           HA2      GLY  35   3.085  -7.547  -1.896
  270    HA3  GLY  35           HA1      GLY  35   3.345  -8.751  -3.141
  271    H    HIS  36           HN       HIS  36   4.103  -7.997  -5.269
  272    HA   HIS  36           HA       HIS  36   6.159  -6.161  -5.091
  273    HB2  HIS  36           HB2      HIS  36   5.812  -7.964  -6.859
  274    HB3  HIS  36           HB1      HIS  36   4.777  -6.797  -7.682
  275    HD1  HIS  36           HD1      HIS  36   6.560  -6.720  -9.657
  276    HD2  HIS  36           HD2      HIS  36   7.874  -5.378  -5.949
  277    HE1  HIS  36           HE1      HIS  36   8.705  -5.461 -10.090
  278    H    HIS  37           HN       HIS  37   2.995  -5.696  -6.763
  279    HA   HIS  37           HA       HIS  37   3.300  -2.989  -7.345
  280    HB2  HIS  37           HB2      HIS  37   0.833  -4.504  -6.459
  281    HB3  HIS  37           HB1      HIS  37   0.788  -2.804  -6.922
  282    HD1  HIS  37           HD1      HIS  37  -0.139  -2.630  -9.207
  283    HD2  HIS  37           HD2      HIS  37   2.277  -5.963  -8.728
  284    HE1  HIS  37           HE1      HIS  37  -0.115  -3.794 -11.436
  285    H    PHE  38           HN       PHE  38   2.110  -4.640  -4.531
  286    HA   PHE  38           HA       PHE  38   1.502  -2.493  -2.935
  287    HB2  PHE  38           HB2      PHE  38   0.775  -4.625  -2.248
  288    HB3  PHE  38           HB1      PHE  38   2.393  -5.286  -2.306
  289    HD1  PHE  38           HD2      PHE  38   0.662  -2.438  -0.750
  290    HD2  PHE  38           HD1      PHE  38   3.324  -5.717  -0.247
  291    HE1  PHE  38           HE2      PHE  38   0.939  -1.837   1.624
  292    HE2  PHE  38           HE1      PHE  38   3.602  -5.143   2.138
  293    HZ   PHE  38           HZ       PHE  38   2.412  -3.191   3.076
  294    H    VAL  39           HN       VAL  39   4.541  -3.918  -3.721
  295    HA   VAL  39           HA       VAL  39   6.009  -2.492  -1.744
  296    HB   VAL  39           HB       VAL  39   6.593  -4.422  -3.837
  297   HG11  VAL  39          HG11      VAL  39   7.810  -3.039  -5.160
  298   HG12  VAL  39          HG12      VAL  39   9.051  -3.456  -3.982
  299   HG13  VAL  39          HG13      VAL  39   8.196  -1.925  -3.852
  300   HG21  VAL  39          HG21      VAL  39   7.611  -3.603  -1.187
  301   HG22  VAL  39          HG22      VAL  39   8.748  -4.449  -2.236
  302   HG23  VAL  39          HG23      VAL  39   7.212  -5.204  -1.809
  303    H    ARG  40           HN       ARG  40   5.527  -2.108  -5.247
  304    HA   ARG  40           HA       ARG  40   6.903   0.240  -5.682
  305    HB2  ARG  40           HB2      ARG  40   4.523  -1.062  -6.931
  306    HB3  ARG  40           HB1      ARG  40   4.928   0.580  -7.410
  307    HG2  ARG  40           HG2      ARG  40   5.849  -1.226  -8.852
  308    HG3  ARG  40           HG1      ARG  40   7.031  -0.082  -8.241
  309    HD2  ARG  40           HD2      ARG  40   6.568  -2.532  -6.654
  310    HD3  ARG  40           HD1      ARG  40   7.397  -2.724  -8.187
  311    HE   ARG  40           HE       ARG  40   8.327  -0.988  -5.995
  312   HH11  ARG  40          HH11      ARG  40   8.946  -3.009  -8.766
  313   HH12  ARG  40          HH12      ARG  40  10.668  -2.891  -8.625
  314   HH21  ARG  40          HH21      ARG  40  10.590  -0.824  -5.809
  315   HH22  ARG  40          HH22      ARG  40  11.603  -1.648  -6.947
  316    H    ALA  41           HN       ALA  41   3.322   0.084  -5.179
  317    HA   ALA  41           HA       ALA  41   2.982   2.810  -4.901
  318    HB1  ALA  41           HB1      ALA  41   0.900   2.332  -3.809
  319    HB2  ALA  41           HB2      ALA  41   1.436   0.718  -3.324
  320    HB3  ALA  41           HB3      ALA  41   1.150   1.085  -5.030
  321    H    LEU  42           HN       LEU  42   3.826   0.369  -2.408
  322    HA   LEU  42           HA       LEU  42   3.740   1.949  -0.165
  323    HB2  LEU  42           HB2      LEU  42   4.753  -0.541  -0.786
  324    HB3  LEU  42           HB1      LEU  42   6.191   0.337  -0.330
  325    HG   LEU  42           HG       LEU  42   3.732   0.069   1.397
  326   HD11  LEU  42          HD11      LEU  42   4.481  -1.977   1.855
  327   HD12  LEU  42          HD12      LEU  42   5.877  -1.207   2.610
  328   HD13  LEU  42          HD13      LEU  42   5.957  -1.720   0.925
  329   HD21  LEU  42          HD21      LEU  42   4.685   1.923   2.272
  330   HD22  LEU  42          HD22      LEU  42   6.260   1.564   1.564
  331   HD23  LEU  42          HD23      LEU  42   5.748   0.740   3.040
  332    H    VAL  43           HN       VAL  43   6.253   1.755  -2.611
  333    HA   VAL  43           HA       VAL  43   8.004   3.660  -1.419
  334    HB   VAL  43           HB       VAL  43   8.088   3.236  -4.380
  335   HG11  VAL  43          HG11      VAL  43  10.359   3.472  -4.113
  336   HG12  VAL  43          HG12      VAL  43  10.336   2.734  -2.505
  337   HG13  VAL  43          HG13      VAL  43   9.797   4.408  -2.723
  338   HG21  VAL  43          HG21      VAL  43   7.498   1.047  -3.742
  339   HG22  VAL  43          HG22      VAL  43   8.611   1.094  -2.373
  340   HG23  VAL  43          HG23      VAL  43   9.238   1.062  -4.020
  341    H    ARG  44           HN       ARG  44   6.212   3.811  -4.448
  342    HA   ARG  44           HA       ARG  44   6.239   6.355  -5.225
  343    HB2  ARG  44           HB2      ARG  44   3.627   4.881  -4.850
  344    HB3  ARG  44           HB1      ARG  44   3.995   6.059  -6.086
  345    HG2  ARG  44           HG2      ARG  44   5.909   4.125  -6.478
  346    HG3  ARG  44           HG1      ARG  44   4.468   3.208  -6.032
  347    HD2  ARG  44           HD2      ARG  44   3.276   4.750  -7.742
  348    HD3  ARG  44           HD1      ARG  44   4.905   5.042  -8.345
  349    HE   ARG  44           HE       ARG  44   4.032   2.270  -8.072
  350   HH11  ARG  44          HH11      ARG  44   4.729   4.992 -10.137
  351   HH12  ARG  44          HH12      ARG  44   4.804   4.040 -11.581
  352   HH21  ARG  44          HH21      ARG  44   4.128   1.012  -9.973
  353   HH22  ARG  44          HH22      ARG  44   4.462   1.779 -11.489
  354    H    VAL  45           HN       VAL  45   4.415   5.089  -2.580
  355    HA   VAL  45           HA       VAL  45   3.065   7.452  -1.775
  356    HB   VAL  45           HB       VAL  45   3.609   4.881  -0.296
  357   HG11  VAL  45          HG11      VAL  45   1.999   7.269   0.348
  358   HG12  VAL  45          HG12      VAL  45   2.911   6.180   1.394
  359   HG13  VAL  45          HG13      VAL  45   1.340   5.689   0.769
  360   HG21  VAL  45          HG21      VAL  45   0.916   5.138  -1.192
  361   HG22  VAL  45          HG22      VAL  45   2.104   3.885  -1.535
  362   HG23  VAL  45          HG23      VAL  45   2.016   5.317  -2.561
  363    H    CYS  46           HN       CYS  46   5.574   5.485  -0.217
  364    HA   CYS  46           HA       CYS  46   6.466   7.864   1.287
  365    HB2  CYS  46           HB2      CYS  46   5.151   6.061   2.534
  366    HB3  CYS  46           HB1      CYS  46   6.538   5.023   2.275
  367    H    GLY  47           HN       GLY  47   7.396   4.558   0.473
  368    HA2  GLY  47           HA2      GLY  47   9.584   4.767  -1.012
  369    HA3  GLY  47           HA1      GLY  47  10.227   5.315   0.529
  370    H    GLY  48           HN       GLY  48  10.613   3.847   2.157
  371    HA2  GLY  48           HA2      GLY  48   9.832   1.480   2.860
  372    HA3  GLY  48           HA1      GLY  48  10.518   1.045   1.305
  373    HA   PRO  49           HA       PRO  49  14.036   0.404   4.091
  374    HB2  PRO  49           HB2      PRO  49  15.413  -1.209   2.413
  375    HB3  PRO  49           HB1      PRO  49  14.059  -1.776   3.391
  376    HG2  PRO  49           HG2      PRO  49  14.090  -0.994   0.514
  377    HG3  PRO  49           HG1      PRO  49  13.320  -2.392   1.287
  378    HD2  PRO  49           HD2      PRO  49  11.965  -0.157   0.636
  379    HD3  PRO  49           HD1      PRO  49  11.516  -1.146   2.015
  380    H    ARG  50           HN       ARG  50  14.958   0.439   0.668
  381    HA   ARG  50           HA       ARG  50  16.188   3.028   0.876
  382    HB2  ARG  50           HB2      ARG  50  18.261   1.542  -0.134
  383    HB3  ARG  50           HB1      ARG  50  18.206   2.299   1.448
  384    HG2  ARG  50           HG2      ARG  50  17.351   0.247   2.418
  385    HG3  ARG  50           HG1      ARG  50  17.333  -0.516   0.827
  386    HD2  ARG  50           HD2      ARG  50  19.749  -0.303   0.673
  387    HD3  ARG  50           HD1      ARG  50  19.792   0.531   2.225
  388    HE   ARG  50           HE       ARG  50  18.676  -1.738   2.966
  389   HH11  ARG  50          HH11      ARG  50  21.340  -1.220   0.778
  390   HH12  ARG  50          HH12      ARG  50  22.100  -2.735   1.141
  391   HH21  ARG  50          HH21      ARG  50  19.674  -3.730   3.452
  392   HH22  ARG  50          HH22      ARG  50  21.154  -4.159   2.664
  393    H    TRP  51           HN       TRP  51  15.840   0.050  -0.991
  394    HA   TRP  51           HA       TRP  51  15.460  -0.379  -3.156
  395    HB2  TRP  51           HB2      TRP  51  14.773   2.516  -3.498
  396    HB3  TRP  51           HB1      TRP  51  14.187   1.128  -4.388
  397    HD1  TRP  51           HD1      TRP  51  13.787   2.814  -0.983
  398    HE1  TRP  51           HE1      TRP  51  11.604   1.952   0.076
  399    HE3  TRP  51           HE3      TRP  51  12.670  -0.697  -4.404
  400    HZ2  TRP  51           HZ2      TRP  51   9.657  -0.040  -0.516
  401    HZ3  TRP  51           HZ3      TRP  51  10.646  -2.059  -4.104
  402    HH2  TRP  51           HH2      TRP  51   9.159  -1.690  -2.181
  403    H    SER  52           HN       SER  52  17.922   1.543  -2.136
  404    HA   SER  52           HA       SER  52  19.072   1.776  -4.840
  405    HB2  SER  52           HB2      SER  52  19.974   3.355  -2.436
  406    HB3  SER  52           HB1      SER  52  20.327   3.665  -4.135
  407    HG   SER  52           HG       SER  52  18.685   4.978  -3.947
  408    H    THR  53           HN       THR  53  20.473   0.210  -5.209
  409    HA   THR  53           HA       THR  53  22.631  -0.307  -3.361
  410    HB   THR  53           HB       THR  53  22.212  -2.834  -3.507
  411    HG1  THR  53           HG1      THR  53  20.513  -3.253  -4.713
  412   HG21  THR  53          HG21      THR  53  20.292  -1.206  -1.837
  413   HG22  THR  53          HG22      THR  53  21.982  -1.513  -1.429
  414   HG23  THR  53          HG23      THR  53  20.836  -2.851  -1.510
  415    H    GLU  54           HN       GLU  54  20.959  -1.414  -6.293
  416    HA   GLU  54           HA       GLU  54  23.428  -1.244  -7.789
  417    HB2  GLU  54           HB2      GLU  54  21.850  -3.771  -7.358
  418    HB3  GLU  54           HB1      GLU  54  22.889  -3.550  -8.750
  419    HG2  GLU  54           HG2      GLU  54  24.781  -3.139  -7.195
  420    HG3  GLU  54           HG1      GLU  54  23.707  -3.551  -5.862
  421    H    ALA  55           HN       ALA  55  22.757  -2.177 -10.155
  422    HA   ALA  55           HA       ALA  55  20.076  -1.573 -10.954
  423    HB1  ALA  55           HB1      ALA  55  22.242   0.365 -11.758
  424    HB2  ALA  55           HB2      ALA  55  20.915   0.701 -10.647
  425    HB3  ALA  55           HB3      ALA  55  20.579   0.368 -12.345
  Start of MODEL    4
    1    H1   ALA 106           HT1      ALA 106   0.181   0.474  15.742
    2    H2   ALA 106           HT2      ALA 106  -1.096   1.264  16.521
    3    H3   ALA 106           HT3      ALA 106  -1.037   1.216  14.831
    4    HA   ALA 106           HA       ALA 106  -1.393  -1.116  16.623
    5    HB1  ALA 106           HB1      ALA 106  -3.661  -1.211  15.771
    6    HB2  ALA 106           HB2      ALA 106  -3.362   0.206  14.762
    7    HB3  ALA 106           HB3      ALA 106  -3.357   0.357  16.519
    8    H    ALA 107           HN       ALA 107  -0.807  -2.984  15.755
    9    HA   ALA 107           HA       ALA 107   0.042  -3.099  12.993
   10    HB1  ALA 107           HB1      ALA 107   1.370  -4.165  14.766
   11    HB2  ALA 107           HB2      ALA 107   0.860  -5.318  13.535
   12    HB3  ALA 107           HB3      ALA 107   0.031  -5.267  15.091
   13    H    ALA 108           HN       ALA 108  -1.030  -3.986  11.336
   14    HA   ALA 108           HA       ALA 108  -3.663  -5.173  11.896
   15    HB1  ALA 108           HB1      ALA 108  -4.445  -3.928  10.230
   16    HB2  ALA 108           HB2      ALA 108  -3.244  -4.593   9.117
   17    HB3  ALA 108           HB3      ALA 108  -2.855  -3.174  10.097
   18    H    THR 109           HN       THR 109  -4.024  -6.274   9.335
   19    HA   THR 109           HA       THR 109  -2.744  -8.808   9.665
   20    HB   THR 109           HB       THR 109  -5.090  -8.482   8.813
   21    HG1  THR 109           HG1      THR 109  -4.170  -9.900   6.735
   22   HG21  THR 109          HG21      THR 109  -4.370  -6.574   7.249
   23   HG22  THR 109          HG22      THR 109  -5.529  -7.748   6.621
   24   HG23  THR 109          HG23      THR 109  -3.833  -7.849   6.153
   25    H    ASN 110           HN       ASN 110  -2.422  -9.467   6.889
   26    HA   ASN 110           HA       ASN 110   0.234  -8.408   6.462
   27    HB2  ASN 110           HB2      ASN 110  -1.400 -10.422   4.896
   28    HB3  ASN 110           HB1      ASN 110   0.269  -9.992   4.532
   29   HD21  ASN 110          HD21      ASN 110   0.976 -12.092   4.861
   30   HD22  ASN 110          HD22      ASN 110   1.103 -12.786   6.439
   31    HA   PRO 111           HA       PRO 111  -1.718  -5.151   3.999
   32    HB2  PRO 111           HB2      PRO 111   0.517  -3.673   3.643
   33    HB3  PRO 111           HB1      PRO 111  -0.424  -3.643   5.134
   34    HG2  PRO 111           HG2      PRO 111   2.055  -5.219   4.510
   35    HG3  PRO 111           HG1      PRO 111   1.692  -4.239   5.946
   36    HD2  PRO 111           HD2      PRO 111   1.405  -6.899   5.977
   37    HD3  PRO 111           HD1      PRO 111   0.261  -5.838   6.827
   38    H    ALA 112           HN       ALA 112   0.279  -7.611   3.085
   39    HA   ALA 112           HA       ALA 112   0.812  -6.609   0.403
   40    HB1  ALA 112           HB1      ALA 112   1.343  -9.370   1.479
   41    HB2  ALA 112           HB2      ALA 112   2.446  -8.011   1.671
   42    HB3  ALA 112           HB3      ALA 112   2.060  -8.609   0.057
   43    H    ARG 113           HN       ARG 113  -0.896  -9.306   1.909
   44    HA   ARG 113           HA       ARG 113  -2.361  -9.949  -0.480
   45    HB2  ARG 113           HB2      ARG 113  -1.910 -11.137   2.079
   46    HB3  ARG 113           HB1      ARG 113  -3.647 -11.024   1.820
   47    HG2  ARG 113           HG2      ARG 113  -3.630 -12.517   0.109
   48    HG3  ARG 113           HG1      ARG 113  -2.006 -12.065  -0.416
   49    HD2  ARG 113           HD2      ARG 113  -1.101 -13.186   1.591
   50    HD3  ARG 113           HD1      ARG 113  -2.729 -13.728   1.992
   51    HE   ARG 113           HE       ARG 113  -1.936 -14.486  -0.649
   52   HH11  ARG 113          HH11      ARG 113  -1.707 -15.339   2.723
   53   HH12  ARG 113          HH12      ARG 113  -1.408 -17.016   2.411
   54   HH21  ARG 113          HH21      ARG 113  -1.541 -16.693  -1.069
   55   HH22  ARG 113          HH22      ARG 113  -1.313 -17.785   0.256
   56    H    TYR 114           HN       TYR 114  -2.717  -7.899   2.233
   57    HA   TYR 114           HA       TYR 114  -5.502  -7.474   2.262
   58    HB2  TYR 114           HB2      TYR 114  -4.480  -6.779   4.190
   59    HB3  TYR 114           HB1      TYR 114  -3.072  -6.163   3.355
   60    HD1  TYR 114           HD1      TYR 114  -6.426  -4.999   2.365
   61    HD2  TYR 114           HD2      TYR 114  -3.016  -4.248   4.786
   62    HE1  TYR 114           HE1      TYR 114  -7.193  -2.705   2.727
   63    HE2  TYR 114           HE2      TYR 114  -3.760  -1.958   5.165
   64    HH   TYR 114           HH       TYR 114  -6.905  -0.894   4.355
   65    H    CYS 115           HN       CYS 115  -2.904  -5.480   0.775
   66    HA   CYS 115           HA       CYS 115  -4.845  -3.857  -0.570
   67    HB2  CYS 115           HB2      CYS 115  -1.960  -4.000  -1.400
   68    HB3  CYS 115           HB1      CYS 115  -3.070  -2.637  -1.464
   69    H    CYS 116           HN       CYS 116  -3.522  -6.913  -1.174
   70    HA   CYS 116           HA       CYS 116  -3.656  -6.814  -4.043
   71    HB2  CYS 116           HB2      CYS 116  -2.158  -8.404  -2.930
   72    HB3  CYS 116           HB1      CYS 116  -3.525  -9.174  -2.151
   73    H    LEU 117           HN       LEU 117  -5.819  -7.532  -1.430
   74    HA   LEU 117           HA       LEU 117  -7.803  -8.796  -3.075
   75    HB2  LEU 117           HB2      LEU 117  -7.490  -8.088  -0.231
   76    HB3  LEU 117           HB1      LEU 117  -9.131  -8.201  -0.826
   77    HG   LEU 117           HG       LEU 117  -7.085 -10.408  -1.069
   78   HD11  LEU 117          HD11      LEU 117  -7.600  -9.990   1.271
   79   HD12  LEU 117          HD12      LEU 117  -8.320 -11.508   0.733
   80   HD13  LEU 117          HD13      LEU 117  -9.326 -10.072   0.920
   81   HD21  LEU 117          HD21      LEU 117  -8.850 -10.459  -2.764
   82   HD22  LEU 117          HD22      LEU 117 -10.071 -10.396  -1.494
   83   HD23  LEU 117          HD23      LEU 117  -9.008 -11.796  -1.625
   84    H    SER 118           HN       SER 118  -7.225  -5.558  -1.792
   85    HA   SER 118           HA       SER 118  -9.413  -4.596  -3.479
   86    HB2  SER 118           HB2      SER 118  -9.097  -4.240  -0.540
   87    HB3  SER 118           HB1      SER 118  -9.753  -2.905  -1.477
   88    HG   SER 118           HG       SER 118 -10.973  -5.094  -2.295
   89    H    GLY 119           HN       GLY 119  -6.423  -3.839  -1.728
   90    HA2  GLY 119           HA2      GLY 119  -4.792  -2.525  -3.026
   91    HA3  GLY 119           HA1      GLY 119  -6.132  -1.485  -3.496
   92    H    CYS 120           HN       CYS 120  -4.003  -0.222  -2.433
   93    HA   CYS 120           HA       CYS 120  -5.042   0.581   0.165
   94    HB2  CYS 120           HB2      CYS 120  -2.210  -0.275  -0.319
   95    HB3  CYS 120           HB1      CYS 120  -2.667   0.740   1.037
   96    H    THR 121           HN       THR 121  -4.936   2.664   0.647
   97    HA   THR 121           HA       THR 121  -4.284   4.508  -1.451
   98    HB   THR 121           HB       THR 121  -4.940   6.257   0.156
   99    HG1  THR 121           HG1      THR 121  -4.575   4.201   1.932
  100   HG21  THR 121          HG21      THR 121  -6.530   4.486  -1.069
  101   HG22  THR 121          HG22      THR 121  -7.119   5.898  -0.199
  102   HG23  THR 121          HG23      THR 121  -7.088   4.316   0.589
  103    H    GLN 122           HN       GLN 122  -2.836   6.301  -1.205
  104    HA   GLN 122           HA       GLN 122  -0.250   5.626  -0.407
  105    HB2  GLN 122           HB2      GLN 122  -1.681   8.115  -1.156
  106    HB3  GLN 122           HB1      GLN 122  -0.242   8.347  -0.180
  107    HG2  GLN 122           HG2      GLN 122   1.123   7.257  -1.790
  108    HG3  GLN 122           HG1      GLN 122  -0.282   6.729  -2.709
  109   HE21  GLN 122          HE21      GLN 122   0.566   7.720  -4.558
  110   HE22  GLN 122          HE22      GLN 122   0.498   9.432  -4.784
  111    H    GLN 123           HN       GLN 123  -3.002   6.596   1.428
  112    HA   GLN 123           HA       GLN 123  -1.589   7.560   3.705
  113    HB2  GLN 123           HB2      GLN 123  -4.364   6.449   3.345
  114    HB3  GLN 123           HB1      GLN 123  -3.762   7.069   4.867
  115    HG2  GLN 123           HG2      GLN 123  -3.533   9.265   3.967
  116    HG3  GLN 123           HG1      GLN 123  -3.885   8.685   2.340
  117   HE21  GLN 123          HE21      GLN 123  -5.997   6.897   3.269
  118   HE22  GLN 123          HE22      GLN 123  -7.350   7.908   3.637
  119    H    ASP 124           HN       ASP 124  -3.223   4.496   2.929
  120    HA   ASP 124           HA       ASP 124  -2.424   3.044   5.159
  121    HB2  ASP 124           HB2      ASP 124  -3.503   2.463   2.529
  122    HB3  ASP 124           HB1      ASP 124  -2.331   1.236   3.002
  123    H    LEU 125           HN       LEU 125  -0.858   3.286   1.986
  124    HA   LEU 125           HA       LEU 125   1.426   1.808   2.633
  125    HB2  LEU 125           HB2      LEU 125   1.098   3.981   0.554
  126    HB3  LEU 125           HB1      LEU 125   2.402   2.842   0.614
  127    HG   LEU 125           HG       LEU 125  -0.051   1.389   0.645
  128   HD11  LEU 125          HD11      LEU 125  -1.389   2.680  -0.586
  129   HD12  LEU 125          HD12      LEU 125  -0.300   2.317  -1.928
  130   HD13  LEU 125          HD13      LEU 125  -0.081   3.794  -0.989
  131   HD21  LEU 125          HD21      LEU 125   2.286   0.794  -0.163
  132   HD22  LEU 125          HD22      LEU 125   1.853   1.677  -1.632
  133   HD23  LEU 125          HD23      LEU 125   0.923   0.258  -1.145
  134    H    LEU 126           HN       LEU 126   0.596   5.172   3.179
  135    HA   LEU 126           HA       LEU 126   3.180   6.130   3.772
  136    HB2  LEU 126           HB2      LEU 126   0.407   7.019   4.244
  137    HB3  LEU 126           HB1      LEU 126   1.573   7.618   5.401
  138    HG   LEU 126           HG       LEU 126   1.719   7.988   2.412
  139   HD11  LEU 126          HD11      LEU 126  -0.063   9.302   3.412
  140   HD12  LEU 126          HD12      LEU 126   1.270  10.344   2.913
  141   HD13  LEU 126          HD13      LEU 126   1.060   9.935   4.617
  142   HD21  LEU 126          HD21      LEU 126   3.488   9.034   4.620
  143   HD22  LEU 126          HD22      LEU 126   3.567   9.532   2.932
  144   HD23  LEU 126          HD23      LEU 126   3.938   7.867   3.377
  145    H    THR 127           HN       THR 127   0.898   4.210   5.522
  146    HA   THR 127           HA       THR 127   2.349   4.499   8.032
  147    HB   THR 127           HB       THR 127   0.540   3.647   9.115
  148    HG1  THR 127           HG1      THR 127   0.535   1.569   8.387
  149   HG21  THR 127          HG21      THR 127  -0.270   5.449   7.477
  150   HG22  THR 127          HG22      THR 127  -1.489   4.410   8.211
  151   HG23  THR 127          HG23      THR 127  -0.962   4.115   6.556
  152    H    LEU 128           HN       LEU 128   2.354   2.472   5.271
  153    HA   LEU 128           HA       LEU 128   3.474   0.215   6.749
  154    HB2  LEU 128           HB2      LEU 128   2.848   0.417   3.811
  155    HB3  LEU 128           HB1      LEU 128   3.164  -1.031   4.732
  156    HG   LEU 128           HG       LEU 128   0.815   0.733   5.342
  157   HD11  LEU 128          HD11      LEU 128   0.735  -1.689   3.571
  158   HD12  LEU 128          HD12      LEU 128   0.790  -0.039   2.950
  159   HD13  LEU 128          HD13      LEU 128  -0.574  -0.566   3.936
  160   HD21  LEU 128          HD21      LEU 128   1.193  -0.725   7.103
  161   HD22  LEU 128          HD22      LEU 128   1.685  -2.023   6.024
  162   HD23  LEU 128          HD23      LEU 128  -0.011  -1.569   6.126
  163    H    CYS 129           HN       CYS 129   4.424   3.040   5.467
  164    HA   CYS 129           HA       CYS 129   6.663   2.553   3.957
  165    HB2  CYS 129           HB2      CYS 129   5.767   4.763   4.104
  166    HB3  CYS 129           HB1      CYS 129   6.060   4.809   5.835
  167    HA   PRO 130           HA       PRO 130   9.285   2.264   7.912
  168    HB2  PRO 130           HB2      PRO 130   8.024   2.210  10.299
  169    HB3  PRO 130           HB1      PRO 130   8.403   3.716   9.459
  170    HG2  PRO 130           HG2      PRO 130   5.803   2.357   9.809
  171    HG3  PRO 130           HG1      PRO 130   6.151   4.072   9.532
  172    HD2  PRO 130           HD2      PRO 130   5.306   2.142   7.604
  173    HD3  PRO 130           HD1      PRO 130   5.767   3.817   7.302
  174    H    TYR 131           HN       TYR 131   6.897   0.279   6.938
  175    HA   TYR 131           HA       TYR 131   7.869  -1.967   8.579
  176    HB2  TYR 131           HB2      TYR 131   5.105  -1.511   7.444
  177    HB3  TYR 131           HB1      TYR 131   5.637  -3.038   8.141
  178    HD1  TYR 131           HD2      TYR 131   4.690   0.427   8.849
  179    HD2  TYR 131           HD1      TYR 131   5.962  -3.265  10.538
  180    HE1  TYR 131           HE2      TYR 131   4.044   1.232  11.080
  181    HE2  TYR 131           HE1      TYR 131   5.319  -2.471  12.774
  182    HH   TYR 131           HH       TYR 131   4.998  -0.291  13.931
  183    H2   PRO  25           HT1      PRO  25   0.807  11.607 -11.508
  184    H3   PRO  25           HT2      PRO  25   1.961  12.513 -10.793
  185    HA   PRO  25           HA       PRO  25   0.594  13.696  -9.674
  186    HB2  PRO  25           HB2      PRO  25  -1.789  13.987 -11.160
  187    HB3  PRO  25           HB1      PRO  25  -0.527  15.201 -10.908
  188    HG2  PRO  25           HG2      PRO  25  -0.928  13.334 -13.185
  189    HG3  PRO  25           HG1      PRO  25  -0.254  14.973 -13.178
  190    HD2  PRO  25           HD2      PRO  25   1.341  12.860 -13.464
  191    HD3  PRO  25           HD1      PRO  25   1.847  14.239 -12.470
  192    H    THR  26           HN       THR  26   0.608  10.748 -10.056
  193    HA   THR  26           HA       THR  26  -2.063   9.808  -9.693
  194    HB   THR  26           HB       THR  26  -1.020   7.657  -9.083
  195    HG1  THR  26           HG1      THR  26   0.856   8.051  -8.081
  196   HG21  THR  26          HG21      THR  26   0.123   7.251 -11.222
  197   HG22  THR  26          HG22      THR  26   0.218   8.991 -11.495
  198   HG23  THR  26          HG23      THR  26  -1.353   8.191 -11.443
  199    HA   PRO  27           HA       PRO  27  -2.009  10.646  -5.270
  200    HB2  PRO  27           HB2      PRO  27  -4.652  10.851  -4.965
  201    HB3  PRO  27           HB1      PRO  27  -3.743  12.086  -5.841
  202    HG2  PRO  27           HG2      PRO  27  -5.576  10.013  -6.874
  203    HG3  PRO  27           HG1      PRO  27  -5.135  11.576  -7.577
  204    HD2  PRO  27           HD2      PRO  27  -4.067   8.972  -8.196
  205    HD3  PRO  27           HD1      PRO  27  -3.647  10.534  -8.930
  206    H    GLU  28           HN       GLU  28  -4.110   9.725  -3.684
  207    HA   GLU  28           HA       GLU  28  -3.397   6.942  -3.434
  208    HB2  GLU  28           HB2      GLU  28  -5.072   7.087  -1.478
  209    HB3  GLU  28           HB1      GLU  28  -3.548   7.943  -1.370
  210    HG2  GLU  28           HG2      GLU  28  -4.592  10.029  -1.830
  211    HG3  GLU  28           HG1      GLU  28  -6.113   9.237  -2.241
  212    H    MET  29           HN       MET  29  -4.251   6.278  -5.407
  213    HA   MET  29           HA       MET  29  -7.105   6.335  -5.822
  214    HB2  MET  29           HB2      MET  29  -5.409   6.562  -7.678
  215    HB3  MET  29           HB1      MET  29  -5.036   4.858  -7.446
  216    HG2  MET  29           HG2      MET  29  -7.266   4.229  -8.077
  217    HG3  MET  29           HG1      MET  29  -7.762   5.919  -8.155
  218    HE1  MET  29           HE1      MET  29  -5.315   7.330  -9.548
  219    HE2  MET  29           HE2      MET  29  -6.994   7.612 -10.016
  220    HE3  MET  29           HE3      MET  29  -5.785   7.239 -11.245
  221    H    ARG  30           HN       ARG  30  -5.517   4.757  -3.705
  222    HA   ARG  30           HA       ARG  30  -5.493   2.676  -2.724
  223    HB2  ARG  30           HB2      ARG  30  -7.850   3.934  -2.527
  224    HB3  ARG  30           HB1      ARG  30  -8.363   2.443  -3.311
  225    HG2  ARG  30           HG2      ARG  30  -6.572   1.832  -1.180
  226    HG3  ARG  30           HG1      ARG  30  -7.862   2.882  -0.588
  227    HD2  ARG  30           HD2      ARG  30  -9.445   1.358  -1.818
  228    HD3  ARG  30           HD1      ARG  30  -8.096   0.231  -1.950
  229    HE   ARG  30           HE       ARG  30  -8.266   0.913   0.715
  230   HH11  ARG  30          HH11      ARG  30 -10.336  -0.590  -1.652
  231   HH12  ARG  30          HH12      ARG  30 -11.184  -1.553  -0.488
  232   HH21  ARG  30          HH21      ARG  30  -9.382  -0.348   2.256
  233   HH22  ARG  30          HH22      ARG  30 -10.641  -1.416   1.731
  234    H    GLU  31           HN       GLU  31  -4.922   2.438  -5.555
  235    HA   GLU  31           HA       GLU  31  -6.517   0.400  -6.699
  236    HB2  GLU  31           HB2      GLU  31  -4.799   0.200  -8.384
  237    HB3  GLU  31           HB1      GLU  31  -5.044   1.904  -8.022
  238    HG2  GLU  31           HG2      GLU  31  -3.063   1.934  -6.648
  239    HG3  GLU  31           HG1      GLU  31  -2.846   0.202  -6.894
  240    H    LYS  32           HN       LYS  32  -5.922  -1.738  -7.163
  241    HA   LYS  32           HA       LYS  32  -5.312  -3.177  -4.854
  242    HB2  LYS  32           HB2      LYS  32  -5.337  -4.201  -7.677
  243    HB3  LYS  32           HB1      LYS  32  -5.633  -5.105  -6.204
  244    HG2  LYS  32           HG2      LYS  32  -7.594  -3.589  -5.795
  245    HG3  LYS  32           HG1      LYS  32  -7.368  -3.007  -7.429
  246    HD2  LYS  32           HD2      LYS  32  -9.005  -4.681  -7.608
  247    HD3  LYS  32           HD1      LYS  32  -7.510  -5.439  -8.165
  248    HE2  LYS  32           HE2      LYS  32  -7.322  -6.031  -5.602
  249    HE3  LYS  32           HE1      LYS  32  -9.075  -5.894  -5.689
  250    HZ1  LYS  32           HZ1      LYS  32  -7.374  -7.678  -7.349
  251    HZ2  LYS  32           HZ2      LYS  32  -9.049  -7.510  -7.513
  252    HZ3  LYS  32           HZ3      LYS  32  -8.401  -8.161  -6.092
  253    H    LEU  33           HN       LEU  33  -3.436  -3.198  -3.956
  254    HA   LEU  33           HA       LEU  33  -0.975  -3.423  -5.516
  255    HB2  LEU  33           HB2      LEU  33  -1.082  -3.008  -2.587
  256    HB3  LEU  33           HB1      LEU  33   0.121  -2.558  -3.764
  257    HG   LEU  33           HG       LEU  33  -2.566  -1.273  -3.558
  258   HD11  LEU  33          HD11      LEU  33  -1.790   0.153  -2.053
  259   HD12  LEU  33          HD12      LEU  33  -0.289   0.389  -2.941
  260   HD13  LEU  33          HD13      LEU  33  -0.446  -0.964  -1.823
  261   HD21  LEU  33          HD21      LEU  33  -2.005  -0.003  -5.348
  262   HD22  LEU  33          HD22      LEU  33  -1.014  -1.416  -5.739
  263   HD23  LEU  33          HD23      LEU  33  -0.288  -0.012  -4.947
  264    H    CYS  34           HN       CYS  34  -0.759  -5.565  -6.000
  265    HA   CYS  34           HA       CYS  34  -1.013  -7.486  -3.805
  266    HB2  CYS  34           HB2      CYS  34  -2.128  -7.772  -6.100
  267    HB3  CYS  34           HB1      CYS  34  -0.530  -8.236  -6.668
  268    H    GLY  35           HN       GLY  35   0.817  -7.248  -2.693
  269    HA2  GLY  35           HA2      GLY  35   3.013  -7.567  -2.108
  270    HA3  GLY  35           HA1      GLY  35   3.100  -8.667  -3.466
  271    H    HIS  36           HN       HIS  36   3.704  -7.795  -5.564
  272    HA   HIS  36           HA       HIS  36   5.834  -6.019  -5.443
  273    HB2  HIS  36           HB2      HIS  36   5.057  -7.783  -7.270
  274    HB3  HIS  36           HB1      HIS  36   4.410  -6.330  -8.029
  275    HD1  HIS  36           HD1      HIS  36   6.330  -6.982  -9.874
  276    HD2  HIS  36           HD2      HIS  36   7.614  -5.539  -6.185
  277    HE1  HIS  36           HE1      HIS  36   8.718  -6.241 -10.201
  278    H    HIS  37           HN       HIS  37   2.604  -5.412  -6.940
  279    HA   HIS  37           HA       HIS  37   2.974  -2.692  -7.434
  280    HB2  HIS  37           HB2      HIS  37   0.523  -4.270  -6.648
  281    HB3  HIS  37           HB1      HIS  37   0.442  -2.521  -6.838
  282    HD1  HIS  37           HD1      HIS  37  -0.881  -2.335  -8.962
  283    HD2  HIS  37           HD2      HIS  37   2.294  -4.979  -9.219
  284    HE1  HIS  37           HE1      HIS  37  -0.744  -3.008 -11.380
  285    H    PHE  38           HN       PHE  38   1.875  -4.425  -4.650
  286    HA   PHE  38           HA       PHE  38   1.406  -2.309  -2.926
  287    HB2  PHE  38           HB2      PHE  38   0.595  -4.472  -2.377
  288    HB3  PHE  38           HB1      PHE  38   2.202  -5.176  -2.480
  289    HD1  PHE  38           HD2      PHE  38   0.705  -2.252  -0.825
  290    HD2  PHE  38           HD1      PHE  38   2.988  -5.827  -0.421
  291    HE1  PHE  38           HE2      PHE  38   1.059  -1.761   1.573
  292    HE2  PHE  38           HE1      PHE  38   3.336  -5.361   1.971
  293    HZ   PHE  38           HZ       PHE  38   2.381  -3.314   2.972
  294    H    VAL  39           HN       VAL  39   4.314  -3.832  -3.960
  295    HA   VAL  39           HA       VAL  39   5.948  -2.636  -1.959
  296    HB   VAL  39           HB       VAL  39   6.325  -4.450  -4.203
  297   HG11  VAL  39          HG11      VAL  39   7.726  -3.184  -5.424
  298   HG12  VAL  39          HG12      VAL  39   8.887  -3.649  -4.183
  299   HG13  VAL  39          HG13      VAL  39   8.084  -2.091  -4.087
  300   HG21  VAL  39          HG21      VAL  39   7.308  -4.005  -1.483
  301   HG22  VAL  39          HG22      VAL  39   8.482  -4.736  -2.574
  302   HG23  VAL  39          HG23      VAL  39   6.915  -5.505  -2.321
  303    H    ARG  40           HN       ARG  40   5.661  -2.012  -5.493
  304    HA   ARG  40           HA       ARG  40   7.092   0.328  -5.602
  305    HB2  ARG  40           HB2      ARG  40   4.638  -0.576  -7.107
  306    HB3  ARG  40           HB1      ARG  40   5.448   0.939  -7.475
  307    HG2  ARG  40           HG2      ARG  40   6.436  -0.439  -8.968
  308    HG3  ARG  40           HG1      ARG  40   7.563  -0.598  -7.637
  309    HD2  ARG  40           HD2      ARG  40   6.530  -2.681  -7.002
  310    HD3  ARG  40           HD1      ARG  40   5.294  -2.486  -8.235
  311    HE   ARG  40           HE       ARG  40   6.752  -3.451  -9.683
  312   HH11  ARG  40          HH11      ARG  40   8.617  -1.857  -7.200
  313   HH12  ARG  40          HH12      ARG  40  10.143  -2.258  -7.914
  314   HH21  ARG  40          HH21      ARG  40   8.762  -3.973 -10.625
  315   HH22  ARG  40          HH22      ARG  40  10.226  -3.459  -9.856
  316    H    ALA  41           HN       ALA  41   3.481   0.240  -5.306
  317    HA   ALA  41           HA       ALA  41   3.152   2.922  -4.859
  318    HB1  ALA  41           HB1      ALA  41   1.044   2.431  -3.902
  319    HB2  ALA  41           HB2      ALA  41   1.565   0.848  -3.319
  320    HB3  ALA  41           HB3      ALA  41   1.348   1.128  -5.050
  321    H    LEU  42           HN       LEU  42   3.878   0.404  -2.391
  322    HA   LEU  42           HA       LEU  42   3.848   1.893  -0.098
  323    HB2  LEU  42           HB2      LEU  42   4.845  -0.570  -0.864
  324    HB3  LEU  42           HB1      LEU  42   6.276   0.273  -0.330
  325    HG   LEU  42           HG       LEU  42   3.793  -0.143   1.332
  326   HD11  LEU  42          HD11      LEU  42   4.829  -2.248   1.110
  327   HD12  LEU  42          HD12      LEU  42   5.402  -1.603   2.647
  328   HD13  LEU  42          HD13      LEU  42   6.445  -1.554   1.228
  329   HD21  LEU  42          HD21      LEU  42   4.607   1.556   2.518
  330   HD22  LEU  42          HD22      LEU  42   6.096   1.577   1.579
  331   HD23  LEU  42          HD23      LEU  42   5.942   0.488   2.956
  332    H    VAL  43           HN       VAL  43   6.358   1.786  -2.539
  333    HA   VAL  43           HA       VAL  43   8.100   3.649  -1.201
  334    HB   VAL  43           HB       VAL  43   8.487   3.184  -4.114
  335   HG11  VAL  43          HG11      VAL  43  10.653   3.454  -3.566
  336   HG12  VAL  43          HG12      VAL  43  10.530   2.289  -2.239
  337   HG13  VAL  43          HG13      VAL  43  10.057   3.977  -1.985
  338   HG21  VAL  43          HG21      VAL  43   7.587   1.046  -3.587
  339   HG22  VAL  43          HG22      VAL  43   8.607   0.926  -2.150
  340   HG23  VAL  43          HG23      VAL  43   9.334   0.899  -3.757
  341    H    ARG  44           HN       ARG  44   6.414   3.734  -4.314
  342    HA   ARG  44           HA       ARG  44   6.600   6.259  -5.167
  343    HB2  ARG  44           HB2      ARG  44   3.911   4.913  -4.847
  344    HB3  ARG  44           HB1      ARG  44   4.374   6.048  -6.095
  345    HG2  ARG  44           HG2      ARG  44   6.208   4.016  -6.380
  346    HG3  ARG  44           HG1      ARG  44   4.709   3.180  -5.973
  347    HD2  ARG  44           HD2      ARG  44   3.647   4.723  -7.748
  348    HD3  ARG  44           HD1      ARG  44   5.305   4.966  -8.288
  349    HE   ARG  44           HE       ARG  44   4.354   2.220  -8.023
  350   HH11  ARG  44          HH11      ARG  44   5.169   4.907 -10.090
  351   HH12  ARG  44          HH12      ARG  44   5.292   3.938 -11.520
  352   HH21  ARG  44          HH21      ARG  44   4.515   0.936  -9.904
  353   HH22  ARG  44          HH22      ARG  44   4.919   1.683 -11.414
  354    H    VAL  45           HN       VAL  45   4.705   5.115  -2.510
  355    HA   VAL  45           HA       VAL  45   3.464   7.581  -1.796
  356    HB   VAL  45           HB       VAL  45   3.818   5.046  -0.186
  357   HG11  VAL  45          HG11      VAL  45   2.793   7.572   0.515
  358   HG12  VAL  45          HG12      VAL  45   2.794   6.075   1.453
  359   HG13  VAL  45          HG13      VAL  45   1.432   6.457   0.397
  360   HG21  VAL  45          HG21      VAL  45   1.177   5.327  -1.156
  361   HG22  VAL  45          HG22      VAL  45   2.350   4.060  -1.492
  362   HG23  VAL  45          HG23      VAL  45   2.278   5.487  -2.525
  363    H    CYS  46           HN       CYS  46   5.977   5.535  -0.362
  364    HA   CYS  46           HA       CYS  46   7.207   7.872   0.887
  365    HB2  CYS  46           HB2      CYS  46   5.528   6.951   2.455
  366    HB3  CYS  46           HB1      CYS  46   6.354   5.414   2.410
  367    H    GLY  47           HN       GLY  47   7.329   4.340   1.109
  368    HA2  GLY  47           HA2      GLY  47   9.421   3.480  -0.199
  369    HA3  GLY  47           HA1      GLY  47  10.268   4.479   0.973
  370    H    GLY  48           HN       GLY  48   9.573   1.426   0.309
  371    HA2  GLY  48           HA2      GLY  48   8.580   0.357   2.727
  372    HA3  GLY  48           HA1      GLY  48   9.435  -0.521   1.491
  373    HA   PRO  49           HA       PRO  49  12.419  -1.033   4.764
  374    HB2  PRO  49           HB2      PRO  49  14.091  -2.654   3.402
  375    HB3  PRO  49           HB1      PRO  49  12.530  -3.193   4.026
  376    HG2  PRO  49           HG2      PRO  49  13.235  -2.323   1.256
  377    HG3  PRO  49           HG1      PRO  49  12.301  -3.738   1.781
  378    HD2  PRO  49           HD2      PRO  49  11.127  -1.469   0.934
  379    HD3  PRO  49           HD1      PRO  49  10.390  -2.484   2.159
  380    H    ARG  50           HN       ARG  50  14.173  -1.016   1.686
  381    HA   ARG  50           HA       ARG  50  15.511   1.480   2.336
  382    HB2  ARG  50           HB2      ARG  50  16.940  -1.143   2.097
  383    HB3  ARG  50           HB1      ARG  50  17.742   0.409   2.094
  384    HG2  ARG  50           HG2      ARG  50  16.066  -0.614   4.370
  385    HG3  ARG  50           HG1      ARG  50  17.820  -0.776   4.275
  386    HD2  ARG  50           HD2      ARG  50  18.030   1.665   4.171
  387    HD3  ARG  50           HD1      ARG  50  16.277   1.816   4.290
  388    HE   ARG  50           HE       ARG  50  17.008   0.345   6.480
  389   HH11  ARG  50          HH11      ARG  50  17.848   3.471   5.193
  390   HH12  ARG  50          HH12      ARG  50  18.175   4.165   6.746
  391   HH21  ARG  50          HH21      ARG  50  17.437   1.248   8.529
  392   HH22  ARG  50          HH22      ARG  50  17.942   2.901   8.641
  393    H    TRP  51           HN       TRP  51  15.211  -1.292   0.162
  394    HA   TRP  51           HA       TRP  51  15.241  -1.505  -2.072
  395    HB2  TRP  51           HB2      TRP  51  14.987   1.475  -2.235
  396    HB3  TRP  51           HB1      TRP  51  14.386   0.247  -3.331
  397    HD1  TRP  51           HD1      TRP  51  13.657   1.660   0.163
  398    HE1  TRP  51           HE1      TRP  51  11.238   1.052   0.768
  399    HE3  TRP  51           HE3      TRP  51  12.640  -1.261  -3.802
  400    HZ2  TRP  51           HZ2      TRP  51   9.156  -0.532  -0.347
  401    HZ3  TRP  51           HZ3      TRP  51  10.427  -2.309  -3.971
  402    HH2  TRP  51           HH2      TRP  51   8.706  -1.902  -2.252
  403    H    SER  52           HN       SER  52  17.700  -0.373  -0.406
  404    HA   SER  52           HA       SER  52  19.441  -0.183  -2.757
  405    HB2  SER  52           HB2      SER  52  19.620   1.672  -0.369
  406    HB3  SER  52           HB1      SER  52  20.715   1.652  -1.752
  407    HG   SER  52           HG       SER  52  18.326   1.869  -2.767
  408    H    THR  53           HN       THR  53  21.438  -1.116  -2.520
  409    HA   THR  53           HA       THR  53  22.381  -1.992   0.073
  410    HB   THR  53           HB       THR  53  22.635  -4.383  -0.728
  411    HG1  THR  53           HG1      THR  53  21.608  -5.009  -2.518
  412   HG21  THR  53          HG21      THR  53  19.805  -3.397  -0.346
  413   HG22  THR  53          HG22      THR  53  20.956  -3.725   0.949
  414   HG23  THR  53          HG23      THR  53  20.382  -5.042  -0.076
  415    H    GLU  54           HN       GLU  54  22.826  -2.737  -3.393
  416    HA   GLU  54           HA       GLU  54  25.696  -2.752  -3.089
  417    HB2  GLU  54           HB2      GLU  54  23.937  -3.041  -5.530
  418    HB3  GLU  54           HB1      GLU  54  25.686  -3.219  -5.535
  419    HG2  GLU  54           HG2      GLU  54  25.531  -5.119  -4.048
  420    HG3  GLU  54           HG1      GLU  54  23.782  -4.918  -3.940
  421    H    ALA  55           HN       ALA  55  23.802  -0.275  -2.907
  422    HA   ALA  55           HA       ALA  55  24.736   1.457  -4.993
  423    HB1  ALA  55           HB1      ALA  55  23.567   3.218  -3.775
  424    HB2  ALA  55           HB2      ALA  55  23.337   2.129  -2.406
  425    HB3  ALA  55           HB3      ALA  55  22.551   1.785  -3.948
  Start of MODEL    5
    1    H1   ALA 106           HT1      ALA 106  -1.792  -5.150  15.724
    2    H2   ALA 106           HT2      ALA 106  -1.683  -4.200  14.328
    3    H3   ALA 106           HT3      ALA 106  -3.087  -5.093  14.637
    4    HA   ALA 106           HA       ALA 106  -3.570  -3.763  16.569
    5    HB1  ALA 106           HB1      ALA 106  -1.143  -2.158  15.782
    6    HB2  ALA 106           HB2      ALA 106  -1.220  -3.281  17.140
    7    HB3  ALA 106           HB3      ALA 106  -2.230  -1.835  17.133
    8    H    ALA 107           HN       ALA 107  -2.484  -2.959  13.353
    9    HA   ALA 107           HA       ALA 107  -4.438  -0.797  13.148
   10    HB1  ALA 107           HB1      ALA 107  -2.180  -0.355  12.322
   11    HB2  ALA 107           HB2      ALA 107  -3.375  -0.260  11.028
   12    HB3  ALA 107           HB3      ALA 107  -2.344  -1.683  11.174
   13    H    ALA 108           HN       ALA 108  -3.422  -3.152  10.738
   14    HA   ALA 108           HA       ALA 108  -6.225  -3.976  10.401
   15    HB1  ALA 108           HB1      ALA 108  -6.282  -3.525   8.177
   16    HB2  ALA 108           HB2      ALA 108  -4.554  -3.808   7.964
   17    HB3  ALA 108           HB3      ALA 108  -5.121  -2.286   8.658
   18    H    THR 109           HN       THR 109  -5.758  -5.694   8.233
   19    HA   THR 109           HA       THR 109  -4.726  -7.985   9.615
   20    HB   THR 109           HB       THR 109  -6.680  -8.157   8.138
   21    HG1  THR 109           HG1      THR 109  -5.280  -9.813   6.638
   22   HG21  THR 109          HG21      THR 109  -5.030  -6.708   6.327
   23   HG22  THR 109          HG22      THR 109  -6.722  -7.176   6.143
   24   HG23  THR 109          HG23      THR 109  -5.443  -8.253   5.582
   25    H    ASN 110           HN       ASN 110  -3.761  -8.962   6.791
   26    HA   ASN 110           HA       ASN 110  -0.983  -8.368   7.284
   27    HB2  ASN 110           HB2      ASN 110  -2.483 -10.226   5.493
   28    HB3  ASN 110           HB1      ASN 110  -0.837  -9.794   5.049
   29   HD21  ASN 110          HD21      ASN 110   0.851 -10.534   6.242
   30   HD22  ASN 110          HD22      ASN 110   0.677 -11.733   7.472
   31    HA   PRO 111           HA       PRO 111  -1.316  -4.882   4.437
   32    HB2  PRO 111           HB2      PRO 111   1.089  -3.820   4.962
   33    HB3  PRO 111           HB1      PRO 111  -0.282  -3.618   6.054
   34    HG2  PRO 111           HG2      PRO 111   1.996  -5.561   6.230
   35    HG3  PRO 111           HG1      PRO 111   1.282  -4.563   7.510
   36    HD2  PRO 111           HD2      PRO 111   0.666  -7.175   7.194
   37    HD3  PRO 111           HD1      PRO 111  -0.508  -5.986   7.796
   38    H    ALA 112           HN       ALA 112  -1.296  -6.291   2.657
   39    HA   ALA 112           HA       ALA 112   0.594  -5.973   0.733
   40    HB1  ALA 112           HB1      ALA 112   1.128  -8.568   2.186
   41    HB2  ALA 112           HB2      ALA 112   2.193  -7.170   2.165
   42    HB3  ALA 112           HB3      ALA 112   1.876  -8.051   0.677
   43    H    ARG 113           HN       ARG 113  -1.003  -8.767   2.159
   44    HA   ARG 113           HA       ARG 113  -2.097  -9.662  -0.333
   45    HB2  ARG 113           HB2      ARG 113  -1.847 -10.662   2.353
   46    HB3  ARG 113           HB1      ARG 113  -3.512 -10.844   1.817
   47    HG2  ARG 113           HG2      ARG 113  -1.124 -11.812   0.259
   48    HG3  ARG 113           HG1      ARG 113  -2.059 -12.813   1.371
   49    HD2  ARG 113           HD2      ARG 113  -3.189 -11.392  -1.038
   50    HD3  ARG 113           HD1      ARG 113  -2.722 -13.093  -1.000
   51    HE   ARG 113           HE       ARG 113  -4.611 -12.367   1.042
   52   HH11  ARG 113          HH11      ARG 113  -4.229 -13.389  -2.269
   53   HH12  ARG 113          HH12      ARG 113  -5.815 -14.076  -2.376
   54   HH21  ARG 113          HH21      ARG 113  -6.701 -13.270   0.910
   55   HH22  ARG 113          HH22      ARG 113  -7.219 -14.008  -0.567
   56    H    TYR 114           HN       TYR 114  -3.230  -7.771   2.402
   57    HA   TYR 114           HA       TYR 114  -5.967  -7.823   1.780
   58    HB2  TYR 114           HB2      TYR 114  -6.245  -6.414   3.534
   59    HB3  TYR 114           HB1      TYR 114  -4.590  -6.877   3.879
   60    HD1  TYR 114           HD1      TYR 114  -6.477  -4.254   1.970
   61    HD2  TYR 114           HD2      TYR 114  -3.072  -5.194   4.353
   62    HE1  TYR 114           HE1      TYR 114  -5.842  -1.879   1.994
   63    HE2  TYR 114           HE2      TYR 114  -2.442  -2.826   4.386
   64    HH   TYR 114           HH       TYR 114  -2.804  -0.798   3.083
   65    H    CYS 115           HN       CYS 115  -3.313  -5.990   0.457
   66    HA   CYS 115           HA       CYS 115  -5.097  -4.188  -0.922
   67    HB2  CYS 115           HB2      CYS 115  -2.101  -4.485  -1.302
   68    HB3  CYS 115           HB1      CYS 115  -3.128  -3.201  -1.918
   69    H    CYS 116           HN       CYS 116  -3.264  -7.080  -1.622
   70    HA   CYS 116           HA       CYS 116  -3.398  -7.079  -4.399
   71    HB2  CYS 116           HB2      CYS 116  -2.144  -8.751  -3.061
   72    HB3  CYS 116           HB1      CYS 116  -3.662  -9.454  -2.534
   73    H    LEU 117           HN       LEU 117  -5.782  -7.888  -1.967
   74    HA   LEU 117           HA       LEU 117  -7.745  -8.766  -3.867
   75    HB2  LEU 117           HB2      LEU 117  -7.702  -8.301  -0.920
   76    HB3  LEU 117           HB1      LEU 117  -9.201  -8.620  -1.751
   77    HG   LEU 117           HG       LEU 117  -6.821 -10.473  -1.754
   78   HD11  LEU 117          HD11      LEU 117  -9.375 -10.586  -0.157
   79   HD12  LEU 117          HD12      LEU 117  -7.749 -10.324   0.475
   80   HD13  LEU 117          HD13      LEU 117  -8.173 -11.873  -0.252
   81   HD21  LEU 117          HD21      LEU 117  -9.658 -10.877  -2.698
   82   HD22  LEU 117          HD22      LEU 117  -8.387 -12.098  -2.683
   83   HD23  LEU 117          HD23      LEU 117  -8.242 -10.688  -3.731
   84    H    SER 118           HN       SER 118  -7.465  -5.990  -1.632
   85    HA   SER 118           HA       SER 118  -9.468  -4.572  -3.241
   86    HB2  SER 118           HB2      SER 118  -8.573  -4.229  -0.380
   87    HB3  SER 118           HB1      SER 118  -9.617  -3.078  -1.207
   88    HG   SER 118           HG       SER 118 -10.267  -5.815  -1.158
   89    H    GLY 119           HN       GLY 119  -6.512  -3.803  -1.365
   90    HA2  GLY 119           HA2      GLY 119  -4.705  -2.756  -2.776
   91    HA3  GLY 119           HA1      GLY 119  -5.965  -1.661  -3.334
   92    H    CYS 120           HN       CYS 120  -3.824  -0.412  -2.329
   93    HA   CYS 120           HA       CYS 120  -4.775   0.484   0.297
   94    HB2  CYS 120           HB2      CYS 120  -1.994   0.915   0.327
   95    HB3  CYS 120           HB1      CYS 120  -2.928  -0.150   1.367
   96    H    THR 121           HN       THR 121  -4.227   2.608   0.896
   97    HA   THR 121           HA       THR 121  -3.973   4.383  -1.417
   98    HB   THR 121           HB       THR 121  -4.761   6.151   0.044
   99    HG1  THR 121           HG1      THR 121  -5.383   4.517   2.176
  100   HG21  THR 121          HG21      THR 121  -6.241   4.223  -0.950
  101   HG22  THR 121          HG22      THR 121  -6.935   5.536  -0.002
  102   HG23  THR 121          HG23      THR 121  -6.619   3.968   0.750
  103    H    GLN 122           HN       GLN 122  -2.661   6.301  -1.211
  104    HA   GLN 122           HA       GLN 122  -0.032   5.722  -0.370
  105    HB2  GLN 122           HB2      GLN 122  -1.462   8.168  -1.347
  106    HB3  GLN 122           HB1      GLN 122   0.143   8.334  -0.655
  107    HG2  GLN 122           HG2      GLN 122   1.127   7.011  -2.320
  108    HG3  GLN 122           HG1      GLN 122  -0.424   6.362  -2.834
  109   HE21  GLN 122          HE21      GLN 122   0.079   9.743  -2.138
  110   HE22  GLN 122          HE22      GLN 122  -0.061  10.305  -3.764
  111    H    GLN 123           HN       GLN 123  -2.653   6.198   1.488
  112    HA   GLN 123           HA       GLN 123  -1.245   7.628   3.597
  113    HB2  GLN 123           HB2      GLN 123  -4.062   6.708   3.171
  114    HB3  GLN 123           HB1      GLN 123  -3.492   7.032   4.796
  115    HG2  GLN 123           HG2      GLN 123  -2.998   9.316   4.221
  116    HG3  GLN 123           HG1      GLN 123  -3.409   9.010   2.534
  117   HE21  GLN 123          HE21      GLN 123  -5.222   7.634   5.166
  118   HE22  GLN 123          HE22      GLN 123  -6.648   8.584   4.946
  119    H    ASP 124           HN       ASP 124  -3.016   4.560   3.137
  120    HA   ASP 124           HA       ASP 124  -2.106   3.277   5.445
  121    HB2  ASP 124           HB2      ASP 124  -3.059   2.299   2.766
  122    HB3  ASP 124           HB1      ASP 124  -2.406   1.146   3.919
  123    H    LEU 125           HN       LEU 125  -0.807   3.222   2.153
  124    HA   LEU 125           HA       LEU 125   1.452   1.674   2.670
  125    HB2  LEU 125           HB2      LEU 125   0.950   3.784   0.567
  126    HB3  LEU 125           HB1      LEU 125   2.356   2.773   0.577
  127    HG   LEU 125           HG       LEU 125  -0.034   1.162   0.733
  128   HD11  LEU 125          HD11      LEU 125  -1.266   1.858  -1.048
  129   HD12  LEU 125          HD12      LEU 125   0.135   2.545  -1.869
  130   HD13  LEU 125          HD13      LEU 125  -0.635   3.430  -0.557
  131   HD21  LEU 125          HD21      LEU 125   2.329   0.604  -0.054
  132   HD22  LEU 125          HD22      LEU 125   1.878   1.432  -1.552
  133   HD23  LEU 125          HD23      LEU 125   0.985  -0.002  -1.027
  134    H    LEU 126           HN       LEU 126   0.862   5.146   3.067
  135    HA   LEU 126           HA       LEU 126   3.517   5.936   3.532
  136    HB2  LEU 126           HB2      LEU 126   0.845   7.053   3.933
  137    HB3  LEU 126           HB1      LEU 126   1.995   7.591   5.138
  138    HG   LEU 126           HG       LEU 126   2.213   7.921   2.153
  139   HD11  LEU 126          HD11      LEU 126   0.650   9.448   3.231
  140   HD12  LEU 126          HD12      LEU 126   2.082  10.306   2.663
  141   HD13  LEU 126          HD13      LEU 126   1.900   9.932   4.377
  142   HD21  LEU 126          HD21      LEU 126   4.265   9.210   2.640
  143   HD22  LEU 126          HD22      LEU 126   4.423   7.502   3.045
  144   HD23  LEU 126          HD23      LEU 126   4.166   8.691   4.322
  145    H    THR 127           HN       THR 127   1.150   4.385   5.570
  146    HA   THR 127           HA       THR 127   2.819   4.768   7.933
  147    HB   THR 127           HB       THR 127   1.009   4.359   9.227
  148    HG1  THR 127           HG1      THR 127  -0.681   2.784   8.331
  149   HG21  THR 127          HG21      THR 127   0.266   5.957   7.344
  150   HG22  THR 127          HG22      THR 127  -0.977   5.234   8.363
  151   HG23  THR 127          HG23      THR 127  -0.673   4.586   6.754
  152    H    LEU 128           HN       LEU 128   2.654   2.575   5.403
  153    HA   LEU 128           HA       LEU 128   3.271   0.284   7.100
  154    HB2  LEU 128           HB2      LEU 128   2.738   0.519   4.154
  155    HB3  LEU 128           HB1      LEU 128   3.210  -0.969   4.931
  156    HG   LEU 128           HG       LEU 128   0.723   0.599   5.600
  157   HD11  LEU 128          HD11      LEU 128   0.915  -2.015   4.128
  158   HD12  LEU 128          HD12      LEU 128   0.744  -0.458   3.321
  159   HD13  LEU 128          HD13      LEU 128  -0.521  -1.032   4.406
  160   HD21  LEU 128          HD21      LEU 128   1.027  -0.562   7.509
  161   HD22  LEU 128          HD22      LEU 128   2.074  -1.747   6.730
  162   HD23  LEU 128          HD23      LEU 128   0.323  -1.872   6.556
  163    H    CYS 129           HN       CYS 129   4.864   2.637   5.141
  164    HA   CYS 129           HA       CYS 129   7.139   1.208   4.383
  165    HB2  CYS 129           HB2      CYS 129   8.304   3.396   4.319
  166    HB3  CYS 129           HB1      CYS 129   6.749   3.416   3.505
  167    HA   PRO 130           HA       PRO 130   9.237   0.450   8.178
  168    HB2  PRO 130           HB2      PRO 130  11.797   0.396   6.816
  169    HB3  PRO 130           HB1      PRO 130  10.841  -0.957   7.425
  170    HG2  PRO 130           HG2      PRO 130  11.235  -0.484   4.771
  171    HG3  PRO 130           HG1      PRO 130   9.789  -1.287   5.413
  172    HD2  PRO 130           HD2      PRO 130  10.159   1.569   4.572
  173    HD3  PRO 130           HD1      PRO 130   8.793   0.475   4.259
  174    H    TYR 131           HN       TYR 131   9.767   3.240   6.381
  175    HA   TYR 131           HA       TYR 131  11.044   4.523   8.665
  176    HB2  TYR 131           HB2      TYR 131  12.186   4.556   5.870
  177    HB3  TYR 131           HB1      TYR 131  12.642   5.717   7.111
  178    HD1  TYR 131           HD1      TYR 131  13.920   4.989   9.080
  179    HD2  TYR 131           HD2      TYR 131  12.989   2.288   5.929
  180    HE1  TYR 131           HE1      TYR 131  15.625   3.430   9.921
  181    HE2  TYR 131           HE2      TYR 131  14.689   0.720   6.761
  182    HH   TYR 131           HH       TYR 131  16.152   1.040   9.815
  183    H2   PRO  25           HT1      PRO  25  -0.466  12.671 -10.537
  184    H3   PRO  25           HT2      PRO  25  -0.188  13.331 -12.004
  185    HA   PRO  25           HA       PRO  25   0.276  11.483 -12.958
  186    HB2  PRO  25           HB2      PRO  25   1.417   9.752 -11.026
  187    HB3  PRO  25           HB1      PRO  25   2.238  10.571 -12.363
  188    HG2  PRO  25           HG2      PRO  25   1.993  11.376  -9.517
  189    HG3  PRO  25           HG1      PRO  25   3.304  11.690 -10.669
  190    HD2  PRO  25           HD2      PRO  25   1.634  13.641  -9.957
  191    HD3  PRO  25           HD1      PRO  25   2.190  13.501 -11.635
  192    H    THR  26           HN       THR  26  -0.299  10.672  -9.526
  193    HA   THR  26           HA       THR  26  -2.980   9.829 -10.016
  194    HB   THR  26           HB       THR  26  -1.970   7.868 -10.967
  195    HG1  THR  26           HG1      THR  26  -3.328   6.663  -9.887
  196   HG21  THR  26          HG21      THR  26   0.258   8.109  -9.940
  197   HG22  THR  26          HG22      THR  26  -0.381   6.475  -9.762
  198   HG23  THR  26          HG23      THR  26  -0.414   7.590  -8.394
  199    HA   PRO  27           HA       PRO  27  -2.781  10.400  -5.592
  200    HB2  PRO  27           HB2      PRO  27  -5.412  10.539  -5.154
  201    HB3  PRO  27           HB1      PRO  27  -4.579  11.775  -6.104
  202    HG2  PRO  27           HG2      PRO  27  -6.419   9.647  -6.996
  203    HG3  PRO  27           HG1      PRO  27  -6.027  11.191  -7.768
  204    HD2  PRO  27           HD2      PRO  27  -4.943   8.571  -8.328
  205    HD3  PRO  27           HD1      PRO  27  -4.608  10.102  -9.160
  206    H    GLU  28           HN       GLU  28  -4.742   9.485  -3.859
  207    HA   GLU  28           HA       GLU  28  -3.957   6.722  -3.562
  208    HB2  GLU  28           HB2      GLU  28  -5.488   6.947  -1.482
  209    HB3  GLU  28           HB1      GLU  28  -3.942   7.769  -1.527
  210    HG2  GLU  28           HG2      GLU  28  -4.974   9.864  -1.971
  211    HG3  GLU  28           HG1      GLU  28  -6.537   9.098  -2.248
  212    H    MET  29           HN       MET  29  -4.979   5.993  -5.440
  213    HA   MET  29           HA       MET  29  -7.876   5.945  -5.549
  214    HB2  MET  29           HB2      MET  29  -6.318   6.244  -7.561
  215    HB3  MET  29           HB1      MET  29  -5.988   4.523  -7.399
  216    HG2  MET  29           HG2      MET  29  -8.380   4.051  -7.708
  217    HG3  MET  29           HG1      MET  29  -8.674   5.775  -7.924
  218    HE1  MET  29           HE1      MET  29  -9.891   5.223 -10.256
  219    HE2  MET  29           HE2      MET  29  -9.564   3.509  -9.999
  220    HE3  MET  29           HE3      MET  29  -9.138   4.270 -11.532
  221    H    ARG  30           HN       ARG  30  -6.253   4.492  -3.499
  222    HA   ARG  30           HA       ARG  30  -6.103   2.446  -2.491
  223    HB2  ARG  30           HB2      ARG  30  -8.727   3.364  -2.948
  224    HB3  ARG  30           HB1      ARG  30  -8.733   1.626  -3.106
  225    HG2  ARG  30           HG2      ARG  30  -7.898   3.274  -0.764
  226    HG3  ARG  30           HG1      ARG  30  -9.242   2.177  -0.879
  227    HD2  ARG  30           HD2      ARG  30  -7.876   0.291  -0.827
  228    HD3  ARG  30           HD1      ARG  30  -6.431   1.233  -1.179
  229    HE   ARG  30           HE       ARG  30  -6.784   2.260   1.050
  230   HH11  ARG  30          HH11      ARG  30  -8.073  -0.901   0.354
  231   HH12  ARG  30          HH12      ARG  30  -8.054  -1.416   2.009
  232   HH21  ARG  30          HH21      ARG  30  -6.759   1.590   3.235
  233   HH22  ARG  30          HH22      ARG  30  -7.308  -0.001   3.643
  234    H    GLU  31           HN       GLU  31  -5.260   2.283  -5.270
  235    HA   GLU  31           HA       GLU  31  -6.576   0.170  -6.609
  236    HB2  GLU  31           HB2      GLU  31  -4.672   0.152  -8.118
  237    HB3  GLU  31           HB1      GLU  31  -5.154   1.808  -7.774
  238    HG2  GLU  31           HG2      GLU  31  -3.337   2.053  -6.214
  239    HG3  GLU  31           HG1      GLU  31  -2.897   0.362  -6.432
  240    H    LYS  32           HN       LYS  32  -5.885  -1.884  -7.061
  241    HA   LYS  32           HA       LYS  32  -5.266  -3.377  -4.774
  242    HB2  LYS  32           HB2      LYS  32  -5.272  -4.298  -7.637
  243    HB3  LYS  32           HB1      LYS  32  -5.524  -5.272  -6.200
  244    HG2  LYS  32           HG2      LYS  32  -7.537  -3.899  -5.711
  245    HG3  LYS  32           HG1      LYS  32  -7.329  -3.140  -7.279
  246    HD2  LYS  32           HD2      LYS  32  -7.606  -5.257  -8.400
  247    HD3  LYS  32           HD1      LYS  32  -7.657  -6.109  -6.858
  248    HE2  LYS  32           HE2      LYS  32  -9.696  -4.902  -6.280
  249    HE3  LYS  32           HE1      LYS  32  -9.652  -4.070  -7.828
  250    HZ1  LYS  32           HZ1      LYS  32 -11.175  -5.954  -7.856
  251    HZ2  LYS  32           HZ2      LYS  32  -9.911  -7.007  -7.462
  252    HZ3  LYS  32           HZ3      LYS  32  -9.900  -6.191  -8.943
  253    H    LEU  33           HN       LEU  33  -3.398  -3.411  -3.885
  254    HA   LEU  33           HA       LEU  33  -0.947  -3.566  -5.453
  255    HB2  LEU  33           HB2      LEU  33  -1.296  -2.897  -2.556
  256    HB3  LEU  33           HB1      LEU  33   0.128  -2.753  -3.541
  257    HG   LEU  33           HG       LEU  33  -2.389  -1.204  -3.977
  258   HD11  LEU  33          HD11      LEU  33  -0.591   0.704  -3.506
  259   HD12  LEU  33          HD12      LEU  33   0.022  -0.539  -2.421
  260   HD13  LEU  33          HD13      LEU  33  -1.638   0.029  -2.269
  261   HD21  LEU  33          HD21      LEU  33  -1.401  -0.181  -5.792
  262   HD22  LEU  33          HD22      LEU  33  -0.856  -1.855  -5.938
  263   HD23  LEU  33          HD23      LEU  33   0.227  -0.626  -5.279
  264    H    CYS  34           HN       CYS  34  -0.734  -5.702  -5.920
  265    HA   CYS  34           HA       CYS  34  -0.990  -7.676  -3.794
  266    HB2  CYS  34           HB2      CYS  34  -1.861  -7.900  -6.199
  267    HB3  CYS  34           HB1      CYS  34  -0.198  -8.269  -6.628
  268    H    GLY  35           HN       GLY  35   0.779  -7.054  -2.573
  269    HA2  GLY  35           HA2      GLY  35   2.924  -7.277  -1.793
  270    HA3  GLY  35           HA1      GLY  35   3.153  -8.488  -3.033
  271    H    HIS  36           HN       HIS  36   3.744  -7.681  -5.243
  272    HA   HIS  36           HA       HIS  36   5.824  -5.817  -5.066
  273    HB2  HIS  36           HB2      HIS  36   5.391  -7.728  -6.813
  274    HB3  HIS  36           HB1      HIS  36   4.596  -6.435  -7.713
  275    HD1  HIS  36           HD1      HIS  36   6.575  -6.640  -9.495
  276    HD2  HIS  36           HD2      HIS  36   7.666  -5.361  -5.686
  277    HE1  HIS  36           HE1      HIS  36   8.883  -5.645  -9.722
  278    H    HIS  37           HN       HIS  37   2.606  -5.493  -6.675
  279    HA   HIS  37           HA       HIS  37   2.881  -2.791  -7.366
  280    HB2  HIS  37           HB2      HIS  37   0.440  -4.322  -6.446
  281    HB3  HIS  37           HB1      HIS  37   0.373  -2.640  -6.965
  282    HD1  HIS  37           HD1      HIS  37  -0.903  -2.910  -9.127
  283    HD2  HIS  37           HD2      HIS  37   2.344  -5.461  -8.789
  284    HE1  HIS  37           HE1      HIS  37  -0.669  -4.029 -11.366
  285    H    PHE  38           HN       PHE  38   2.115  -4.451  -4.470
  286    HA   PHE  38           HA       PHE  38   1.460  -2.204  -2.898
  287    HB2  PHE  38           HB2      PHE  38   0.624  -4.338  -2.265
  288    HB3  PHE  38           HB1      PHE  38   2.225  -5.041  -2.255
  289    HD1  PHE  38           HD2      PHE  38   0.369  -2.248  -0.752
  290    HD2  PHE  38           HD1      PHE  38   3.204  -5.376  -0.189
  291    HE1  PHE  38           HE2      PHE  38   0.548  -1.654   1.642
  292    HE2  PHE  38           HE1      PHE  38   3.401  -4.781   2.196
  293    HZ   PHE  38           HZ       PHE  38   2.070  -2.921   3.115
  294    H    VAL  39           HN       VAL  39   4.378  -3.754  -3.853
  295    HA   VAL  39           HA       VAL  39   6.044  -2.477  -1.920
  296    HB   VAL  39           HB       VAL  39   6.529  -4.037  -4.431
  297   HG11  VAL  39          HG11      VAL  39   8.139  -2.530  -4.991
  298   HG12  VAL  39          HG12      VAL  39   9.057  -3.489  -3.831
  299   HG13  VAL  39          HG13      VAL  39   8.340  -1.961  -3.334
  300   HG21  VAL  39          HG21      VAL  39   6.358  -4.930  -2.014
  301   HG22  VAL  39          HG22      VAL  39   7.986  -4.273  -1.832
  302   HG23  VAL  39          HG23      VAL  39   7.667  -5.510  -3.046
  303    H    ARG  40           HN       ARG  40   5.912  -2.047  -5.468
  304    HA   ARG  40           HA       ARG  40   7.143   0.344  -5.707
  305    HB2  ARG  40           HB2      ARG  40   4.711  -0.635  -7.206
  306    HB3  ARG  40           HB1      ARG  40   5.676   0.753  -7.695
  307    HG2  ARG  40           HG2      ARG  40   6.939  -0.646  -8.843
  308    HG3  ARG  40           HG1      ARG  40   7.514  -1.298  -7.318
  309    HD2  ARG  40           HD2      ARG  40   5.992  -3.044  -7.372
  310    HD3  ARG  40           HD1      ARG  40   4.977  -2.265  -8.579
  311    HE   ARG  40           HE       ARG  40   7.671  -3.292  -9.195
  312   HH11  ARG  40          HH11      ARG  40   4.278  -2.971  -9.925
  313   HH12  ARG  40          HH12      ARG  40   4.395  -3.801 -11.441
  314   HH21  ARG  40          HH21      ARG  40   7.834  -4.382 -11.189
  315   HH22  ARG  40          HH22      ARG  40   6.417  -4.600 -12.161
  316    H    ALA  41           HN       ALA  41   3.570  -0.001  -5.153
  317    HA   ALA  41           HA       ALA  41   3.136   2.766  -4.989
  318    HB1  ALA  41           HB1      ALA  41   1.040   2.258  -4.001
  319    HB2  ALA  41           HB2      ALA  41   1.599   0.709  -3.358
  320    HB3  ALA  41           HB3      ALA  41   1.376   0.921  -5.100
  321    H    LEU  42           HN       LEU  42   3.900   0.378  -2.416
  322    HA   LEU  42           HA       LEU  42   3.810   1.979  -0.201
  323    HB2  LEU  42           HB2      LEU  42   4.853  -0.509  -0.811
  324    HB3  LEU  42           HB1      LEU  42   6.263   0.383  -0.304
  325    HG   LEU  42           HG       LEU  42   3.758   0.004   1.335
  326   HD11  LEU  42          HD11      LEU  42   4.693  -2.041   1.583
  327   HD12  LEU  42          HD12      LEU  42   5.724  -1.179   2.729
  328   HD13  LEU  42          HD13      LEU  42   6.294  -1.489   1.090
  329   HD21  LEU  42          HD21      LEU  42   4.543   1.924   2.238
  330   HD22  LEU  42          HD22      LEU  42   6.167   1.675   1.603
  331   HD23  LEU  42          HD23      LEU  42   5.651   0.818   3.056
  332    H    VAL  43           HN       VAL  43   6.343   1.743  -2.592
  333    HA   VAL  43           HA       VAL  43   8.152   3.588  -1.404
  334    HB   VAL  43           HB       VAL  43   8.241   3.257  -4.361
  335   HG11  VAL  43          HG11      VAL  43  10.522   3.199  -4.019
  336   HG12  VAL  43          HG12      VAL  43  10.339   2.447  -2.430
  337   HG13  VAL  43          HG13      VAL  43  10.002   4.171  -2.636
  338   HG21  VAL  43          HG21      VAL  43   7.448   1.088  -3.914
  339   HG22  VAL  43          HG22      VAL  43   8.444   0.957  -2.464
  340   HG23  VAL  43          HG23      VAL  43   9.200   0.945  -4.057
  341    H    ARG  44           HN       ARG  44   6.234   3.850  -4.371
  342    HA   ARG  44           HA       ARG  44   6.350   6.433  -5.069
  343    HB2  ARG  44           HB2      ARG  44   3.736   4.944  -4.735
  344    HB3  ARG  44           HB1      ARG  44   4.066   6.202  -5.896
  345    HG2  ARG  44           HG2      ARG  44   5.977   4.300  -6.455
  346    HG3  ARG  44           HG1      ARG  44   4.538   3.363  -6.050
  347    HD2  ARG  44           HD2      ARG  44   3.414   5.192  -7.630
  348    HD3  ARG  44           HD1      ARG  44   5.040   5.198  -8.306
  349    HE   ARG  44           HE       ARG  44   4.140   2.545  -8.028
  350   HH11  ARG  44          HH11      ARG  44   3.618   5.398  -9.959
  351   HH12  ARG  44          HH12      ARG  44   3.082   4.515 -11.350
  352   HH21  ARG  44          HH21      ARG  44   3.434   1.374  -9.852
  353   HH22  ARG  44          HH22      ARG  44   2.975   2.228 -11.288
  354    H    VAL  45           HN       VAL  45   4.624   5.059  -2.436
  355    HA   VAL  45           HA       VAL  45   3.213   7.357  -1.550
  356    HB   VAL  45           HB       VAL  45   3.780   4.727  -0.198
  357   HG11  VAL  45          HG11      VAL  45   1.974   7.004   0.461
  358   HG12  VAL  45          HG12      VAL  45   3.096   6.117   1.489
  359   HG13  VAL  45          HG13      VAL  45   1.592   5.362   0.975
  360   HG21  VAL  45          HG21      VAL  45   2.033   3.796  -1.273
  361   HG22  VAL  45          HG22      VAL  45   2.467   4.981  -2.495
  362   HG23  VAL  45          HG23      VAL  45   1.143   5.308  -1.382
  363    H    CYS  46           HN       CYS  46   5.722   5.387   0.041
  364    HA   CYS  46           HA       CYS  46   6.387   7.717   1.734
  365    HB2  CYS  46           HB2      CYS  46   5.366   5.575   2.732
  366    HB3  CYS  46           HB1      CYS  46   6.915   4.830   2.393
  367    H    GLY  47           HN       GLY  47   7.591   5.056  -0.154
  368    HA2  GLY  47           HA2      GLY  47   9.632   5.263  -1.419
  369    HA3  GLY  47           HA1      GLY  47  10.265   6.321  -0.168
  370    H    GLY  48           HN       GLY  48   8.557   3.577   0.914
  371    HA2  GLY  48           HA2      GLY  48   9.254   1.840   2.260
  372    HA3  GLY  48           HA1      GLY  48  10.204   1.447   0.843
  373    HA   PRO  49           HA       PRO  49  13.272   2.061   4.186
  374    HB2  PRO  49           HB2      PRO  49  14.625  -0.201   3.881
  375    HB3  PRO  49           HB1      PRO  49  13.018  -0.209   4.613
  376    HG2  PRO  49           HG2      PRO  49  13.796  -0.892   1.812
  377    HG3  PRO  49           HG1      PRO  49  12.713  -1.762   2.915
  378    HD2  PRO  49           HD2      PRO  49  11.874  -0.010   0.983
  379    HD3  PRO  49           HD1      PRO  49  10.942  -0.394   2.431
  380    H    ARG  50           HN       ARG  50  13.458   3.460   1.772
  381    HA   ARG  50           HA       ARG  50  14.940   4.549   0.489
  382    HB2  ARG  50           HB2      ARG  50  16.995   2.989   1.976
  383    HB3  ARG  50           HB1      ARG  50  17.248   4.473   1.088
  384    HG2  ARG  50           HG2      ARG  50  15.924   5.711   2.664
  385    HG3  ARG  50           HG1      ARG  50  15.496   4.226   3.516
  386    HD2  ARG  50           HD2      ARG  50  17.224   5.349   4.747
  387    HD3  ARG  50           HD1      ARG  50  17.900   3.889   4.027
  388    HE   ARG  50           HE       ARG  50  18.584   5.655   2.193
  389   HH11  ARG  50          HH11      ARG  50  18.703   5.936   5.665
  390   HH12  ARG  50          HH12      ARG  50  20.053   7.020   5.657
  391   HH21  ARG  50          HH21      ARG  50  20.361   7.082   2.177
  392   HH22  ARG  50          HH22      ARG  50  20.994   7.674   3.677
  393    H    TRP  51           HN       TRP  51  15.084   1.080   0.636
  394    HA   TRP  51           HA       TRP  51  15.533  -0.515  -0.892
  395    HB2  TRP  51           HB2      TRP  51  15.151   1.692  -2.883
  396    HB3  TRP  51           HB1      TRP  51  14.830  -0.022  -3.074
  397    HD1  TRP  51           HD1      TRP  51  13.430   3.026  -1.160
  398    HE1  TRP  51           HE1      TRP  51  10.991   2.485  -0.551
  399    HE3  TRP  51           HE3      TRP  51  13.295  -1.758  -2.742
  400    HZ2  TRP  51           HZ2      TRP  51   9.237   0.268  -0.733
  401    HZ3  TRP  51           HZ3      TRP  51  11.220  -3.042  -2.477
  402    HH2  TRP  51           HH2      TRP  51   9.221  -2.000  -1.488
  403    H    SER  52           HN       SER  52  17.711   1.558  -0.063
  404    HA   SER  52           HA       SER  52  19.585   1.918  -2.055
  405    HB2  SER  52           HB2      SER  52  20.116   1.296   0.862
  406    HB3  SER  52           HB1      SER  52  21.265   2.031  -0.256
  407    HG   SER  52           HG       SER  52  19.597   3.299   1.239
  408    H    THR  53           HN       THR  53  21.730   0.797  -2.251
  409    HA   THR  53           HA       THR  53  21.763  -2.045  -1.690
  410    HB   THR  53           HB       THR  53  22.219  -2.628  -4.098
  411    HG1  THR  53           HG1      THR  53  20.851  -0.742  -5.306
  412   HG21  THR  53          HG21      THR  53  19.460  -1.552  -3.504
  413   HG22  THR  53          HG22      THR  53  20.066  -3.144  -3.048
  414   HG23  THR  53          HG23      THR  53  19.867  -2.732  -4.751
  415    H    GLU  54           HN       GLU  54  23.284   0.693  -3.349
  416    HA   GLU  54           HA       GLU  54  25.889  -0.530  -3.282
  417    HB2  GLU  54           HB2      GLU  54  25.147   2.322  -3.964
  418    HB3  GLU  54           HB1      GLU  54  26.653   1.505  -4.352
  419    HG2  GLU  54           HG2      GLU  54  25.432  -0.035  -5.812
  420    HG3  GLU  54           HG1      GLU  54  23.936   0.821  -5.445
  421    H    ALA  55           HN       ALA  55  27.530   1.560  -2.620
  422    HA   ALA  55           HA       ALA  55  26.853   2.712  -0.094
  423    HB1  ALA  55           HB1      ALA  55  28.447   1.493   1.285
  424    HB2  ALA  55           HB2      ALA  55  28.856   0.455  -0.080
  425    HB3  ALA  55           HB3      ALA  55  27.238   0.397   0.618
  Start of MODEL    6
    1    H1   ALA 106           HT1      ALA 106  -0.939   0.589  18.144
    2    H2   ALA 106           HT2      ALA 106   0.331   0.464  17.034
    3    H3   ALA 106           HT3      ALA 106  -0.147  -0.892  17.926
    4    HA   ALA 106           HA       ALA 106  -2.288  -0.903  16.834
    5    HB1  ALA 106           HB1      ALA 106  -1.177   1.343  15.156
    6    HB2  ALA 106           HB2      ALA 106  -2.368   1.539  16.441
    7    HB3  ALA 106           HB3      ALA 106  -2.767   0.593  15.007
    8    H    ALA 107           HN       ALA 107  -2.533  -2.321  15.143
    9    HA   ALA 107           HA       ALA 107  -0.493  -2.686  13.150
   10    HB1  ALA 107           HB1      ALA 107  -0.866  -4.834  15.236
   11    HB2  ALA 107           HB2      ALA 107   0.563  -3.821  15.034
   12    HB3  ALA 107           HB3      ALA 107   0.111  -4.971  13.775
   13    H    ALA 108           HN       ALA 108  -1.344  -3.566  11.353
   14    HA   ALA 108           HA       ALA 108  -4.090  -4.594  11.531
   15    HB1  ALA 108           HB1      ALA 108  -4.529  -3.307   9.778
   16    HB2  ALA 108           HB2      ALA 108  -3.281  -4.134   8.839
   17    HB3  ALA 108           HB3      ALA 108  -2.866  -2.718   9.812
   18    H    THR 109           HN       THR 109  -4.257  -5.812   9.082
   19    HA   THR 109           HA       THR 109  -3.042  -8.353   9.605
   20    HB   THR 109           HB       THR 109  -5.344  -8.054   8.645
   21    HG1  THR 109           HG1      THR 109  -3.458  -9.821   7.953
   22   HG21  THR 109          HG21      THR 109  -4.642  -6.216   7.052
   23   HG22  THR 109          HG22      THR 109  -5.662  -7.478   6.357
   24   HG23  THR 109          HG23      THR 109  -3.928  -7.478   6.046
   25    H    ASN 110           HN       ASN 110  -2.627  -9.137   6.864
   26    HA   ASN 110           HA       ASN 110   0.060  -8.133   6.493
   27    HB2  ASN 110           HB2      ASN 110  -1.530 -10.180   4.916
   28    HB3  ASN 110           HB1      ASN 110   0.175  -9.811   4.668
   29   HD21  ASN 110          HD21      ASN 110   0.814 -11.897   5.129
   30   HD22  ASN 110          HD22      ASN 110   0.789 -12.544   6.731
   31    HA   PRO 111           HA       PRO 111  -1.793  -4.955   3.840
   32    HB2  PRO 111           HB2      PRO 111   0.505  -3.560   3.448
   33    HB3  PRO 111           HB1      PRO 111  -0.498  -3.397   4.888
   34    HG2  PRO 111           HG2      PRO 111   1.968  -5.059   4.490
   35    HG3  PRO 111           HG1      PRO 111   1.553  -3.987   5.843
   36    HD2  PRO 111           HD2      PRO 111   1.219  -6.632   6.029
   37    HD3  PRO 111           HD1      PRO 111   0.046  -5.506   6.745
   38    H    ALA 112           HN       ALA 112   0.297  -7.451   3.090
   39    HA   ALA 112           HA       ALA 112   0.848  -6.594   0.372
   40    HB1  ALA 112           HB1      ALA 112   1.294  -9.324   1.561
   41    HB2  ALA 112           HB2      ALA 112   2.428  -7.987   1.724
   42    HB3  ALA 112           HB3      ALA 112   2.055  -8.631   0.126
   43    H    ARG 113           HN       ARG 113  -0.921  -9.197   1.953
   44    HA   ARG 113           HA       ARG 113  -2.365  -9.922  -0.424
   45    HB2  ARG 113           HB2      ARG 113  -2.008 -10.937   2.270
   46    HB3  ARG 113           HB1      ARG 113  -3.700 -10.985   1.802
   47    HG2  ARG 113           HG2      ARG 113  -1.595 -12.059  -0.029
   48    HG3  ARG 113           HG1      ARG 113  -2.187 -13.024   1.325
   49    HD2  ARG 113           HD2      ARG 113  -3.917 -11.804  -0.825
   50    HD3  ARG 113           HD1      ARG 113  -3.380 -13.484  -0.792
   51    HE   ARG 113           HE       ARG 113  -4.741 -12.713   1.604
   52   HH11  ARG 113          HH11      ARG 113  -5.194 -13.777  -1.683
   53   HH12  ARG 113          HH12      ARG 113  -6.746 -14.482  -1.376
   54   HH21  ARG 113          HH21      ARG 113  -6.783 -13.640   2.016
   55   HH22  ARG 113          HH22      ARG 113  -7.648 -14.405   0.725
   56    H    TYR 114           HN       TYR 114  -2.762  -7.792   2.234
   57    HA   TYR 114           HA       TYR 114  -5.547  -7.387   2.207
   58    HB2  TYR 114           HB2      TYR 114  -4.550  -6.616   4.126
   59    HB3  TYR 114           HB1      TYR 114  -3.151  -5.990   3.280
   60    HD1  TYR 114           HD1      TYR 114  -6.571  -4.993   2.292
   61    HD2  TYR 114           HD2      TYR 114  -3.119  -3.986   4.562
   62    HE1  TYR 114           HE1      TYR 114  -7.414  -2.709   2.557
   63    HE2  TYR 114           HE2      TYR 114  -3.944  -1.704   4.839
   64    HH   TYR 114           HH       TYR 114  -7.144  -0.803   4.073
   65    H    CYS 115           HN       CYS 115  -2.950  -5.388   0.728
   66    HA   CYS 115           HA       CYS 115  -4.861  -3.812  -0.699
   67    HB2  CYS 115           HB2      CYS 115  -1.981  -4.013  -1.515
   68    HB3  CYS 115           HB1      CYS 115  -3.069  -2.635  -1.609
   69    H    CYS 116           HN       CYS 116  -3.085  -6.741  -1.374
   70    HA   CYS 116           HA       CYS 116  -3.234  -6.766  -4.157
   71    HB2  CYS 116           HB2      CYS 116  -1.923  -8.429  -2.956
   72    HB3  CYS 116           HB1      CYS 116  -3.368  -9.078  -2.205
   73    H    LEU 117           HN       LEU 117  -5.622  -7.650  -1.724
   74    HA   LEU 117           HA       LEU 117  -7.497  -8.660  -3.638
   75    HB2  LEU 117           HB2      LEU 117  -7.437  -8.220  -0.713
   76    HB3  LEU 117           HB1      LEU 117  -8.998  -8.365  -1.481
   77    HG   LEU 117           HG       LEU 117  -6.821 -10.434  -1.727
   78   HD11  LEU 117          HD11      LEU 117  -8.124 -11.744  -0.112
   79   HD12  LEU 117          HD12      LEU 117  -9.187 -10.360   0.139
   80   HD13  LEU 117          HD13      LEU 117  -7.486 -10.260   0.596
   81   HD21  LEU 117          HD21      LEU 117  -8.668 -11.869  -2.484
   82   HD22  LEU 117          HD22      LEU 117  -8.433 -10.477  -3.540
   83   HD23  LEU 117          HD23      LEU 117  -9.765 -10.492  -2.384
   84    H    SER 118           HN       SER 118  -7.518  -5.808  -1.474
   85    HA   SER 118           HA       SER 118  -9.543  -4.614  -3.224
   86    HB2  SER 118           HB2      SER 118  -8.800  -4.094  -0.350
   87    HB3  SER 118           HB1      SER 118  -9.888  -3.055  -1.262
   88    HG   SER 118           HG       SER 118 -11.409  -4.456  -0.944
   89    H    GLY 119           HN       GLY 119  -6.451  -3.848  -1.617
   90    HA2  GLY 119           HA2      GLY 119  -4.841  -2.558  -2.927
   91    HA3  GLY 119           HA1      GLY 119  -6.192  -1.586  -3.501
   92    H    CYS 120           HN       CYS 120  -3.897  -0.452  -2.293
   93    HA   CYS 120           HA       CYS 120  -5.128   0.594   0.143
   94    HB2  CYS 120           HB2      CYS 120  -2.223  -0.127  -0.144
   95    HB3  CYS 120           HB1      CYS 120  -2.915   0.733   1.221
   96    H    THR 121           HN       THR 121  -4.746   2.702   0.695
   97    HA   THR 121           HA       THR 121  -4.143   4.431  -1.546
   98    HB   THR 121           HB       THR 121  -4.999   6.212  -0.285
   99    HG1  THR 121           HG1      THR 121  -5.271   6.065   1.995
  100   HG21  THR 121          HG21      THR 121  -6.639   4.523  -0.915
  101   HG22  THR 121          HG22      THR 121  -7.135   5.470   0.480
  102   HG23  THR 121          HG23      THR 121  -6.531   3.821   0.691
  103    H    GLN 122           HN       GLN 122  -2.820   6.339  -1.210
  104    HA   GLN 122           HA       GLN 122  -0.192   5.651  -0.392
  105    HB2  GLN 122           HB2      GLN 122  -1.575   8.133  -1.324
  106    HB3  GLN 122           HB1      GLN 122  -0.027   8.311  -0.516
  107    HG2  GLN 122           HG2      GLN 122   1.095   7.053  -2.150
  108    HG3  GLN 122           HG1      GLN 122  -0.409   6.431  -2.813
  109   HE21  GLN 122          HE21      GLN 122   1.802   7.863  -4.106
  110   HE22  GLN 122          HE22      GLN 122   1.091   9.252  -4.853
  111    H    GLN 123           HN       GLN 123  -2.891   6.302   1.424
  112    HA   GLN 123           HA       GLN 123  -1.452   7.585   3.590
  113    HB2  GLN 123           HB2      GLN 123  -4.278   6.799   3.092
  114    HB3  GLN 123           HB1      GLN 123  -3.733   6.928   4.755
  115    HG2  GLN 123           HG2      GLN 123  -3.584   9.099   2.677
  116    HG3  GLN 123           HG1      GLN 123  -4.768   8.985   3.972
  117   HE21  GLN 123          HE21      GLN 123  -1.489   9.709   3.147
  118   HE22  GLN 123          HE22      GLN 123  -1.042  10.407   4.663
  119    H    ASP 124           HN       ASP 124  -3.190   4.519   2.999
  120    HA   ASP 124           HA       ASP 124  -2.360   3.192   5.311
  121    HB2  ASP 124           HB2      ASP 124  -3.623   2.461   2.822
  122    HB3  ASP 124           HB1      ASP 124  -2.389   1.270   3.219
  123    H    LEU 125           HN       LEU 125  -0.946   3.154   2.063
  124    HA   LEU 125           HA       LEU 125   1.316   1.659   2.669
  125    HB2  LEU 125           HB2      LEU 125   0.904   3.761   0.538
  126    HB3  LEU 125           HB1      LEU 125   2.274   2.703   0.607
  127    HG   LEU 125           HG       LEU 125  -0.085   1.109   0.732
  128   HD11  LEU 125          HD11      LEU 125  -1.511   2.376  -0.451
  129   HD12  LEU 125          HD12      LEU 125  -0.523   1.883  -1.827
  130   HD13  LEU 125          HD13      LEU 125  -0.234   3.438  -1.046
  131   HD21  LEU 125          HD21      LEU 125   2.222   0.560  -0.096
  132   HD22  LEU 125          HD22      LEU 125   1.818   1.484  -1.548
  133   HD23  LEU 125          HD23      LEU 125   0.895   0.036  -1.132
  134    H    LEU 126           HN       LEU 126   0.664   5.104   3.109
  135    HA   LEU 126           HA       LEU 126   3.309   5.914   3.643
  136    HB2  LEU 126           HB2      LEU 126   0.611   6.997   4.022
  137    HB3  LEU 126           HB1      LEU 126   1.754   7.539   5.231
  138    HG   LEU 126           HG       LEU 126   2.034   7.857   2.248
  139   HD11  LEU 126          HD11      LEU 126   1.803  10.255   2.743
  140   HD12  LEU 126          HD12      LEU 126   1.482   9.858   4.431
  141   HD13  LEU 126          HD13      LEU 126   0.362   9.334   3.176
  142   HD21  LEU 126          HD21      LEU 126   4.007   9.224   2.782
  143   HD22  LEU 126          HD22      LEU 126   4.214   7.543   3.277
  144   HD23  LEU 126          HD23      LEU 126   3.844   8.778   4.481
  145    H    THR 127           HN       THR 127   0.921   4.245   5.529
  146    HA   THR 127           HA       THR 127   2.479   4.557   7.978
  147    HB   THR 127           HB       THR 127   0.636   4.018   9.177
  148    HG1  THR 127           HG1      THR 127  -0.587   2.262   8.768
  149   HG21  THR 127          HG21      THR 127  -0.065   5.710   7.355
  150   HG22  THR 127          HG22      THR 127  -1.326   4.916   8.294
  151   HG23  THR 127          HG23      THR 127  -0.960   4.360   6.661
  152    H    LEU 128           HN       LEU 128   2.423   2.471   5.338
  153    HA   LEU 128           HA       LEU 128   3.057   0.112   6.927
  154    HB2  LEU 128           HB2      LEU 128   2.817   0.434   3.941
  155    HB3  LEU 128           HB1      LEU 128   3.024  -1.071   4.797
  156    HG   LEU 128           HG       LEU 128   0.659   0.720   5.258
  157   HD11  LEU 128          HD11      LEU 128   0.697  -1.689   3.473
  158   HD12  LEU 128          HD12      LEU 128   0.869  -0.044   2.860
  159   HD13  LEU 128          HD13      LEU 128  -0.605  -0.523   3.703
  160   HD21  LEU 128          HD21      LEU 128   0.898  -0.775   7.030
  161   HD22  LEU 128          HD22      LEU 128   1.402  -2.075   5.956
  162   HD23  LEU 128          HD23      LEU 128  -0.278  -1.544   5.961
  163    H    CYS 129           HN       CYS 129   4.597   2.681   5.282
  164    HA   CYS 129           HA       CYS 129   7.065   1.353   4.719
  165    HB2  CYS 129           HB2      CYS 129   7.946   3.524   4.213
  166    HB3  CYS 129           HB1      CYS 129   6.300   3.466   3.603
  167    HA   PRO 130           HA       PRO 130   9.034   1.528   8.664
  168    HB2  PRO 130           HB2      PRO 130  11.602   2.279   7.521
  169    HB3  PRO 130           HB1      PRO 130  11.089   0.720   8.164
  170    HG2  PRO 130           HG2      PRO 130  11.562   1.128   5.526
  171    HG3  PRO 130           HG1      PRO 130  10.364  -0.038   6.118
  172    HD2  PRO 130           HD2      PRO 130   9.945   2.750   5.086
  173    HD3  PRO 130           HD1      PRO 130   9.017   1.275   4.734
  174    H    TYR 131           HN       TYR 131   8.160   4.209   7.289
  175    HA   TYR 131           HA       TYR 131   9.678   5.941   9.125
  176    HB2  TYR 131           HB2      TYR 131   8.677   6.580   6.345
  177    HB3  TYR 131           HB1      TYR 131   9.289   7.789   7.468
  178    HD1  TYR 131           HD2      TYR 131  10.250   4.700   5.639
  179    HD2  TYR 131           HD1      TYR 131  11.589   8.217   7.623
  180    HE1  TYR 131           HE2      TYR 131  12.538   4.268   4.848
  181    HE2  TYR 131           HE1      TYR 131  13.881   7.795   6.836
  182    HH   TYR 131           HH       TYR 131  15.246   5.889   6.078
  183    H2   PRO  25           HT1      PRO  25  -1.702  15.516  -7.624
  184    H3   PRO  25           HT2      PRO  25  -0.395  16.314  -8.189
  185    HA   PRO  25           HA       PRO  25   0.771  14.665  -7.621
  186    HB2  PRO  25           HB2      PRO  25   0.481  14.724  -4.746
  187    HB3  PRO  25           HB1      PRO  25   1.853  15.239  -5.739
  188    HG2  PRO  25           HG2      PRO  25   0.253  16.981  -4.382
  189    HG3  PRO  25           HG1      PRO  25   1.117  17.398  -5.872
  190    HD2  PRO  25           HD2      PRO  25  -1.760  16.603  -5.510
  191    HD3  PRO  25           HD1      PRO  25  -1.076  17.910  -6.496
  192    H    THR  26           HN       THR  26  -2.084  14.111  -7.949
  193    HA   THR  26           HA       THR  26  -3.516  12.362  -7.858
  194    HB   THR  26           HB       THR  26  -2.713  10.167  -7.577
  195    HG1  THR  26           HG1      THR  26  -0.405  10.088  -6.585
  196   HG21  THR  26          HG21      THR  26  -1.720  11.303  -9.501
  197   HG22  THR  26          HG22      THR  26  -0.602  10.119  -8.823
  198   HG23  THR  26          HG23      THR  26  -0.371  11.837  -8.497
  199    HA   PRO  27           HA       PRO  27  -4.994  12.431  -3.656
  200    HB2  PRO  27           HB2      PRO  27  -7.465  11.550  -4.118
  201    HB3  PRO  27           HB1      PRO  27  -6.924  13.097  -4.775
  202    HG2  PRO  27           HG2      PRO  27  -7.343  10.503  -6.151
  203    HG3  PRO  27           HG1      PRO  27  -7.505  12.151  -6.780
  204    HD2  PRO  27           HD2      PRO  27  -5.280  10.391  -7.071
  205    HD3  PRO  27           HD1      PRO  27  -5.395  12.084  -7.593
  206    H    GLU  28           HN       GLU  28  -6.893  10.631  -2.688
  207    HA   GLU  28           HA       GLU  28  -5.215   8.356  -2.120
  208    HB2  GLU  28           HB2      GLU  28  -7.202   7.674  -0.686
  209    HB3  GLU  28           HB1      GLU  28  -6.337   9.132  -0.257
  210    HG2  GLU  28           HG2      GLU  28  -8.498   9.726  -2.056
  211    HG3  GLU  28           HG1      GLU  28  -9.073   8.838  -0.650
  212    H    MET  29           HN       MET  29  -5.378   7.928  -4.475
  213    HA   MET  29           HA       MET  29  -7.738   6.581  -5.426
  214    HB2  MET  29           HB2      MET  29  -5.349   7.641  -6.587
  215    HB3  MET  29           HB1      MET  29  -5.492   5.946  -7.033
  216    HG2  MET  29           HG2      MET  29  -7.682   6.325  -7.958
  217    HG3  MET  29           HG1      MET  29  -7.649   8.002  -7.418
  218    HE1  MET  29           HE1      MET  29  -4.799   6.341 -10.649
  219    HE2  MET  29           HE2      MET  29  -5.975   5.349  -9.787
  220    HE3  MET  29           HE3      MET  29  -4.593   6.027  -8.925
  221    H    ARG  30           HN       ARG  30  -8.226   4.740  -4.537
  222    HA   ARG  30           HA       ARG  30  -6.265   2.946  -3.465
  223    HB2  ARG  30           HB2      ARG  30  -9.192   3.184  -3.453
  224    HB3  ARG  30           HB1      ARG  30  -8.581   1.537  -3.409
  225    HG2  ARG  30           HG2      ARG  30  -6.993   2.788  -1.585
  226    HG3  ARG  30           HG1      ARG  30  -8.536   3.617  -1.371
  227    HD2  ARG  30           HD2      ARG  30  -9.644   1.486  -1.066
  228    HD3  ARG  30           HD1      ARG  30  -8.122   0.642  -1.333
  229    HE   ARG  30           HE       ARG  30  -7.961   2.524   0.792
  230   HH11  ARG  30          HH11      ARG  30  -9.008  -0.694  -0.029
  231   HH12  ARG  30          HH12      ARG  30  -8.862  -1.295   1.588
  232   HH21  ARG  30          HH21      ARG  30  -7.767   1.742   2.930
  233   HH22  ARG  30          HH22      ARG  30  -8.158   0.090   3.269
  234    H    GLU  31           HN       GLU  31  -5.230   1.430  -4.548
  235    HA   GLU  31           HA       GLU  31  -6.558   0.044  -6.752
  236    HB2  GLU  31           HB2      GLU  31  -4.450   0.135  -8.081
  237    HB3  GLU  31           HB1      GLU  31  -5.240   1.695  -7.893
  238    HG2  GLU  31           HG2      GLU  31  -3.675   2.335  -6.186
  239    HG3  GLU  31           HG1      GLU  31  -2.947   0.735  -6.226
  240    H    LYS  32           HN       LYS  32  -5.959  -2.028  -7.065
  241    HA   LYS  32           HA       LYS  32  -5.227  -3.442  -4.775
  242    HB2  LYS  32           HB2      LYS  32  -5.263  -4.465  -7.601
  243    HB3  LYS  32           HB1      LYS  32  -5.489  -5.383  -6.125
  244    HG2  LYS  32           HG2      LYS  32  -7.509  -3.935  -5.686
  245    HG3  LYS  32           HG1      LYS  32  -7.338  -3.371  -7.342
  246    HD2  LYS  32           HD2      LYS  32  -7.572  -5.644  -8.170
  247    HD3  LYS  32           HD1      LYS  32  -7.668  -6.256  -6.521
  248    HE2  LYS  32           HE2      LYS  32  -9.698  -4.923  -6.183
  249    HE3  LYS  32           HE1      LYS  32  -9.617  -4.388  -7.856
  250    HZ1  LYS  32           HZ1      LYS  32 -11.161  -6.220  -7.605
  251    HZ2  LYS  32           HZ2      LYS  32  -9.948  -7.195  -6.941
  252    HZ3  LYS  32           HZ3      LYS  32  -9.843  -6.698  -8.555
  253    H    LEU  33           HN       LEU  33  -3.339  -3.532  -3.905
  254    HA   LEU  33           HA       LEU  33  -0.902  -3.608  -5.528
  255    HB2  LEU  33           HB2      LEU  33  -0.875  -3.222  -2.605
  256    HB3  LEU  33           HB1      LEU  33   0.181  -2.625  -3.855
  257    HG   LEU  33           HG       LEU  33  -2.609  -1.645  -3.485
  258   HD11  LEU  33          HD11      LEU  33  -1.921   0.011  -2.100
  259   HD12  LEU  33          HD12      LEU  33  -0.292   0.051  -2.774
  260   HD13  LEU  33          HD13      LEU  33  -0.746  -1.218  -1.634
  261   HD21  LEU  33          HD21      LEU  33  -2.215  -0.269  -5.233
  262   HD22  LEU  33          HD22      LEU  33  -1.062  -1.537  -5.674
  263   HD23  LEU  33          HD23      LEU  33  -0.507  -0.080  -4.838
  264    H    CYS  34           HN       CYS  34  -0.599  -5.708  -6.018
  265    HA   CYS  34           HA       CYS  34  -0.705  -7.656  -3.839
  266    HB2  CYS  34           HB2      CYS  34  -1.792  -7.915  -6.208
  267    HB3  CYS  34           HB1      CYS  34  -0.181  -8.457  -6.662
  268    H    GLY  35           HN       GLY  35   1.107  -7.495  -2.749
  269    HA2  GLY  35           HA2      GLY  35   3.325  -7.675  -2.203
  270    HA3  GLY  35           HA1      GLY  35   3.448  -8.730  -3.594
  271    H    HIS  36           HN       HIS  36   3.994  -7.760  -5.682
  272    HA   HIS  36           HA       HIS  36   6.000  -5.836  -5.461
  273    HB2  HIS  36           HB2      HIS  36   5.567  -7.621  -7.322
  274    HB3  HIS  36           HB1      HIS  36   4.668  -6.311  -8.089
  275    HD1  HIS  36           HD1      HIS  36   6.551  -6.276  -9.973
  276    HD2  HIS  36           HD2      HIS  36   7.789  -5.238  -6.134
  277    HE1  HIS  36           HE1      HIS  36   8.799  -5.156 -10.238
  278    H    HIS  37           HN       HIS  37   2.741  -5.471  -6.991
  279    HA   HIS  37           HA       HIS  37   2.922  -2.730  -7.481
  280    HB2  HIS  37           HB2      HIS  37   0.616  -4.513  -6.757
  281    HB3  HIS  37           HB1      HIS  37   0.376  -2.770  -6.781
  282    HD1  HIS  37           HD1      HIS  37  -0.869  -2.328  -8.897
  283    HD2  HIS  37           HD2      HIS  37   2.254  -5.001  -9.374
  284    HE1  HIS  37           HE1      HIS  37  -0.759  -2.822 -11.363
  285    H    PHE  38           HN       PHE  38   2.025  -4.557  -4.693
  286    HA   PHE  38           HA       PHE  38   1.429  -2.479  -2.943
  287    HB2  PHE  38           HB2      PHE  38   0.741  -4.687  -2.413
  288    HB3  PHE  38           HB1      PHE  38   2.383  -5.301  -2.529
  289    HD1  PHE  38           HD2      PHE  38   0.761  -2.457  -0.857
  290    HD2  PHE  38           HD1      PHE  38   3.190  -5.937  -0.466
  291    HE1  PHE  38           HE2      PHE  38   1.095  -1.956   1.541
  292    HE2  PHE  38           HE1      PHE  38   3.523  -5.455   1.930
  293    HZ   PHE  38           HZ       PHE  38   2.478  -3.457   2.936
  294    H    VAL  39           HN       VAL  39   4.415  -3.865  -3.980
  295    HA   VAL  39           HA       VAL  39   6.007  -2.586  -1.997
  296    HB   VAL  39           HB       VAL  39   6.506  -4.174  -4.453
  297   HG11  VAL  39          HG11      VAL  39   7.984  -2.663  -5.251
  298   HG12  VAL  39          HG12      VAL  39   9.033  -3.426  -4.061
  299   HG13  VAL  39          HG13      VAL  39   8.235  -1.907  -3.680
  300   HG21  VAL  39          HG21      VAL  39   6.755  -4.542  -1.724
  301   HG22  VAL  39          HG22      VAL  39   8.419  -4.372  -2.289
  302   HG23  VAL  39          HG23      VAL  39   7.372  -5.606  -2.990
  303    H    ARG  40           HN       ARG  40   5.744  -2.019  -5.509
  304    HA   ARG  40           HA       ARG  40   6.992   0.366  -5.772
  305    HB2  ARG  40           HB2      ARG  40   4.607  -0.847  -7.099
  306    HB3  ARG  40           HB1      ARG  40   5.009   0.822  -7.467
  307    HG2  ARG  40           HG2      ARG  40   5.965  -0.608  -9.101
  308    HG3  ARG  40           HG1      ARG  40   7.261   0.098  -8.151
  309    HD2  ARG  40           HD2      ARG  40   6.320  -2.449  -7.111
  310    HD3  ARG  40           HD1      ARG  40   6.920  -2.568  -8.755
  311    HE   ARG  40           HE       ARG  40   8.455  -1.789  -6.391
  312   HH11  ARG  40          HH11      ARG  40   8.338  -2.395  -9.821
  313   HH12  ARG  40          HH12      ARG  40  10.058  -2.515  -9.986
  314   HH21  ARG  40          HH21      ARG  40  10.716  -1.948  -6.599
  315   HH22  ARG  40          HH22      ARG  40  11.411  -2.263  -8.155
  316    H    ALA  41           HN       ALA  41   3.427   0.124  -5.217
  317    HA   ALA  41           HA       ALA  41   3.063   2.832  -4.808
  318    HB1  ALA  41           HB1      ALA  41   0.994   2.294  -3.724
  319    HB2  ALA  41           HB2      ALA  41   1.540   0.666  -3.313
  320    HB3  ALA  41           HB3      ALA  41   1.243   1.101  -4.998
  321    H    LEU  42           HN       LEU  42   3.770   0.311  -2.317
  322    HA   LEU  42           HA       LEU  42   3.793   1.855  -0.062
  323    HB2  LEU  42           HB2      LEU  42   4.683  -0.659  -0.710
  324    HB3  LEU  42           HB1      LEU  42   6.175   0.142  -0.282
  325    HG   LEU  42           HG       LEU  42   3.742  -0.148   1.481
  326   HD11  LEU  42          HD11      LEU  42   4.706  -2.212   1.605
  327   HD12  LEU  42          HD12      LEU  42   5.654  -1.369   2.831
  328   HD13  LEU  42          HD13      LEU  42   6.315  -1.609   1.215
  329   HD21  LEU  42          HD21      LEU  42   4.535   1.702   2.457
  330   HD22  LEU  42          HD22      LEU  42   6.069   1.599   1.599
  331   HD23  LEU  42          HD23      LEU  42   5.819   0.654   3.066
  332    H    VAL  43           HN       VAL  43   6.265   1.685  -2.551
  333    HA   VAL  43           HA       VAL  43   8.081   3.475  -1.241
  334    HB   VAL  43           HB       VAL  43   8.317   3.137  -4.191
  335   HG11  VAL  43          HG11      VAL  43  10.580   3.128  -3.749
  336   HG12  VAL  43          HG12      VAL  43  10.361   2.327  -2.185
  337   HG13  VAL  43          HG13      VAL  43   9.999   4.053  -2.357
  338   HG21  VAL  43          HG21      VAL  43   7.475   0.970  -3.685
  339   HG22  VAL  43          HG22      VAL  43   8.552   0.840  -2.292
  340   HG23  VAL  43          HG23      VAL  43   9.217   0.848  -3.925
  341    H    ARG  44           HN       ARG  44   6.379   3.746  -4.312
  342    HA   ARG  44           HA       ARG  44   6.482   6.288  -5.063
  343    HB2  ARG  44           HB2      ARG  44   3.893   4.767  -4.715
  344    HB3  ARG  44           HB1      ARG  44   4.152   6.085  -5.831
  345    HG2  ARG  44           HG2      ARG  44   6.138   4.154  -6.322
  346    HG3  ARG  44           HG1      ARG  44   4.587   3.320  -6.188
  347    HD2  ARG  44           HD2      ARG  44   4.726   5.817  -7.782
  348    HD3  ARG  44           HD1      ARG  44   5.411   4.344  -8.439
  349    HE   ARG  44           HE       ARG  44   2.742   4.027  -7.436
  350   HH11  ARG  44          HH11      ARG  44   4.674   4.899 -10.203
  351   HH12  ARG  44          HH12      ARG  44   3.427   4.535 -11.348
  352   HH21  ARG  44          HH21      ARG  44   1.097   3.544  -8.938
  353   HH22  ARG  44          HH22      ARG  44   1.395   3.763 -10.629
  354    H    VAL  45           HN       VAL  45   4.535   5.042  -2.501
  355    HA   VAL  45           HA       VAL  45   3.239   7.407  -1.659
  356    HB   VAL  45           HB       VAL  45   3.706   4.796  -0.224
  357   HG11  VAL  45          HG11      VAL  45   2.106   7.187   0.408
  358   HG12  VAL  45          HG12      VAL  45   2.931   6.042   1.465
  359   HG13  VAL  45          HG13      VAL  45   1.384   5.613   0.742
  360   HG21  VAL  45          HG21      VAL  45   1.056   5.094  -1.244
  361   HG22  VAL  45          HG22      VAL  45   2.243   3.828  -1.537
  362   HG23  VAL  45          HG23      VAL  45   2.227   5.271  -2.550
  363    H    CYS  46           HN       CYS  46   5.703   5.365  -0.120
  364    HA   CYS  46           HA       CYS  46   6.604   7.693   1.459
  365    HB2  CYS  46           HB2      CYS  46   5.166   5.931   2.634
  366    HB3  CYS  46           HB1      CYS  46   6.523   4.846   2.431
  367    H    GLY  47           HN       GLY  47   7.433   4.346   0.724
  368    HA2  GLY  47           HA2      GLY  47   9.689   4.499  -0.707
  369    HA3  GLY  47           HA1      GLY  47  10.290   4.943   0.882
  370    H    GLY  48           HN       GLY  48  10.826   3.362   2.270
  371    HA2  GLY  48           HA2      GLY  48   9.756   1.013   2.895
  372    HA3  GLY  48           HA1      GLY  48  10.475   0.625   1.343
  373    HA   PRO  49           HA       PRO  49  13.824  -0.194   4.318
  374    HB2  PRO  49           HB2      PRO  49  14.795  -2.383   3.138
  375    HB3  PRO  49           HB1      PRO  49  13.281  -2.432   4.047
  376    HG2  PRO  49           HG2      PRO  49  13.682  -2.258   1.093
  377    HG3  PRO  49           HG1      PRO  49  12.575  -3.295   2.012
  378    HD2  PRO  49           HD2      PRO  49  11.836  -0.942   0.849
  379    HD3  PRO  49           HD1      PRO  49  11.017  -1.621   2.251
  380    H    ARG  50           HN       ARG  50  13.902   1.781   2.197
  381    HA   ARG  50           HA       ARG  50  15.431   3.083   1.176
  382    HB2  ARG  50           HB2      ARG  50  16.823   2.020   3.085
  383    HB3  ARG  50           HB1      ARG  50  17.640   1.195   1.774
  384    HG2  ARG  50           HG2      ARG  50  18.187   3.336   0.761
  385    HG3  ARG  50           HG1      ARG  50  17.326   4.172   2.054
  386    HD2  ARG  50           HD2      ARG  50  18.898   3.124   3.680
  387    HD3  ARG  50           HD1      ARG  50  19.808   2.482   2.314
  388    HE   ARG  50           HE       ARG  50  19.538   5.248   1.984
  389   HH11  ARG  50          HH11      ARG  50  21.133   2.961   4.075
  390   HH12  ARG  50          HH12      ARG  50  22.446   4.025   4.453
  391   HH21  ARG  50          HH21      ARG  50  21.264   6.656   2.477
  392   HH22  ARG  50          HH22      ARG  50  22.520   6.126   3.544
  393    H    TRP  51           HN       TRP  51  15.386  -0.333   0.478
  394    HA   TRP  51           HA       TRP  51  15.434  -1.472  -1.430
  395    HB2  TRP  51           HB2      TRP  51  15.227   1.154  -2.823
  396    HB3  TRP  51           HB1      TRP  51  14.651  -0.411  -3.339
  397    HD1  TRP  51           HD1      TRP  51  13.778   2.287  -0.696
  398    HE1  TRP  51           HE1      TRP  51  11.325   1.923  -0.033
  399    HE3  TRP  51           HE3      TRP  51  12.945  -1.987  -3.241
  400    HZ2  TRP  51           HZ2      TRP  51   9.296   0.003  -0.534
  401    HZ3  TRP  51           HZ3      TRP  51  10.738  -3.053  -3.083
  402    HH2  TRP  51           HH2      TRP  51   8.942  -2.031  -1.745
  403    H    SER  52           HN       SER  52  16.989  -2.375  -2.421
  404    HA   SER  52           HA       SER  52  19.005  -2.900  -3.321
  405    HB2  SER  52           HB2      SER  52  18.941   0.011  -4.105
  406    HB3  SER  52           HB1      SER  52  20.110  -1.160  -4.710
  407    HG   SER  52           HG       SER  52  17.470  -0.791  -5.387
  408    H    THR  53           HN       THR  53  21.212  -2.916  -2.860
  409    HA   THR  53           HA       THR  53  22.378  -0.936  -1.129
  410    HB   THR  53           HB       THR  53  23.039  -2.945   0.489
  411    HG1  THR  53           HG1      THR  53  20.351  -3.622  -0.074
  412   HG21  THR  53          HG21      THR  53  20.406  -1.484   0.719
  413   HG22  THR  53          HG22      THR  53  21.981  -0.815   1.148
  414   HG23  THR  53          HG23      THR  53  21.334  -2.191   2.041
  415    H    GLU  54           HN       GLU  54  22.763  -4.354  -2.098
  416    HA   GLU  54           HA       GLU  54  24.591  -5.539  -2.741
  417    HB2  GLU  54           HB2      GLU  54  25.426  -3.199  -4.393
  418    HB3  GLU  54           HB1      GLU  54  25.346  -4.901  -4.806
  419    HG2  GLU  54           HG2      GLU  54  22.913  -4.784  -4.888
  420    HG3  GLU  54           HG1      GLU  54  22.989  -3.070  -4.483
  421    H    ALA  55           HN       ALA  55  25.139  -4.441  -0.321
  422    HA   ALA  55           HA       ALA  55  27.997  -4.273  -0.385
  423    HB1  ALA  55           HB1      ALA  55  28.210  -2.077   0.667
  424    HB2  ALA  55           HB2      ALA  55  26.469  -1.833   0.519
  425    HB3  ALA  55           HB3      ALA  55  27.470  -1.955  -0.928
  Start of MODEL    7
    1    H1   ALA 106           HT1      ALA 106   0.941  -0.273  11.561
    2    H2   ALA 106           HT2      ALA 106   2.565  -0.265  11.089
    3    H3   ALA 106           HT3      ALA 106   2.158  -0.057  12.718
    4    HA   ALA 106           HA       ALA 106   1.692  -2.506  11.117
    5    HB1  ALA 106           HB1      ALA 106   3.447  -3.521  12.430
    6    HB2  ALA 106           HB2      ALA 106   3.668  -2.029  13.345
    7    HB3  ALA 106           HB3      ALA 106   4.068  -2.078  11.627
    8    H    ALA 107           HN       ALA 107  -0.514  -2.470  11.841
    9    HA   ALA 107           HA       ALA 107  -0.853  -3.826  14.351
   10    HB1  ALA 107           HB1      ALA 107  -0.814  -1.509  15.126
   11    HB2  ALA 107           HB2      ALA 107  -2.410  -2.227  15.341
   12    HB3  ALA 107           HB3      ALA 107  -2.119  -1.109  14.008
   13    H    ALA 108           HN       ALA 108  -1.386  -4.069  11.403
   14    HA   ALA 108           HA       ALA 108  -4.241  -4.764  11.617
   15    HB1  ALA 108           HB1      ALA 108  -4.772  -3.564   9.818
   16    HB2  ALA 108           HB2      ALA 108  -3.423  -4.241   8.898
   17    HB3  ALA 108           HB3      ALA 108  -3.172  -2.825   9.929
   18    H    THR 109           HN       THR 109  -4.437  -5.903   9.084
   19    HA   THR 109           HA       THR 109  -3.282  -8.485   9.552
   20    HB   THR 109           HB       THR 109  -5.568  -8.110   8.570
   21    HG1  THR 109           HG1      THR 109  -4.694 -10.133   8.262
   22   HG21  THR 109          HG21      THR 109  -4.841  -6.244   7.044
   23   HG22  THR 109          HG22      THR 109  -5.823  -7.492   6.272
   24   HG23  THR 109          HG23      THR 109  -4.078  -7.467   6.025
   25    H    ASN 110           HN       ASN 110  -2.800  -9.256   6.860
   26    HA   ASN 110           HA       ASN 110  -0.122  -8.224   6.517
   27    HB2  ASN 110           HB2      ASN 110  -1.674 -10.317   4.967
   28    HB3  ASN 110           HB1      ASN 110   0.012  -9.900   4.672
   29   HD21  ASN 110          HD21      ASN 110   0.832 -11.878   5.169
   30   HD22  ASN 110          HD22      ASN 110   0.828 -12.537   6.766
   31    HA   PRO 111           HA       PRO 111  -1.953  -5.054   3.858
   32    HB2  PRO 111           HB2      PRO 111   0.401  -3.765   3.346
   33    HB3  PRO 111           HB1      PRO 111  -0.580  -3.495   4.786
   34    HG2  PRO 111           HG2      PRO 111   1.823  -5.257   4.448
   35    HG3  PRO 111           HG1      PRO 111   1.441  -4.127   5.764
   36    HD2  PRO 111           HD2      PRO 111   1.034  -6.749   6.049
   37    HD3  PRO 111           HD1      PRO 111  -0.117  -5.569   6.713
   38    H    ALA 112           HN       ALA 112   0.586  -7.311   3.090
   39    HA   ALA 112           HA       ALA 112   0.854  -6.633   0.348
   40    HB1  ALA 112           HB1      ALA 112   1.298  -9.348   1.565
   41    HB2  ALA 112           HB2      ALA 112   2.446  -8.017   1.683
   42    HB3  ALA 112           HB3      ALA 112   2.034  -8.684   0.105
   43    H    ARG 113           HN       ARG 113  -0.911  -9.234   1.958
   44    HA   ARG 113           HA       ARG 113  -2.367  -9.954  -0.414
   45    HB2  ARG 113           HB2      ARG 113  -2.046 -10.958   2.305
   46    HB3  ARG 113           HB1      ARG 113  -3.707 -11.074   1.747
   47    HG2  ARG 113           HG2      ARG 113  -1.393 -12.098   0.133
   48    HG3  ARG 113           HG1      ARG 113  -2.218 -13.080   1.345
   49    HD2  ARG 113           HD2      ARG 113  -3.525 -11.770  -1.037
   50    HD3  ARG 113           HD1      ARG 113  -3.084 -13.473  -0.923
   51    HE   ARG 113           HE       ARG 113  -4.925 -12.364   1.064
   52   HH11  ARG 113          HH11      ARG 113  -4.367 -14.414  -1.700
   53   HH12  ARG 113          HH12      ARG 113  -5.867 -15.263  -1.535
   54   HH21  ARG 113          HH21      ARG 113  -6.901 -13.477   1.289
   55   HH22  ARG 113          HH22      ARG 113  -7.309 -14.730   0.163
   56    H    TYR 114           HN       TYR 114  -2.757  -7.716   2.132
   57    HA   TYR 114           HA       TYR 114  -5.590  -7.435   2.077
   58    HB2  TYR 114           HB2      TYR 114  -4.746  -6.696   4.064
   59    HB3  TYR 114           HB1      TYR 114  -3.281  -6.072   3.338
   60    HD1  TYR 114           HD1      TYR 114  -6.686  -5.057   2.271
   61    HD2  TYR 114           HD2      TYR 114  -3.233  -4.041   4.535
   62    HE1  TYR 114           HE1      TYR 114  -7.525  -2.773   2.522
   63    HE2  TYR 114           HE2      TYR 114  -4.052  -1.755   4.795
   64    HH   TYR 114           HH       TYR 114  -7.244  -0.855   4.058
   65    H    CYS 115           HN       CYS 115  -2.953  -5.455   0.660
   66    HA   CYS 115           HA       CYS 115  -4.829  -3.770  -0.696
   67    HB2  CYS 115           HB2      CYS 115  -1.959  -4.009  -1.538
   68    HB3  CYS 115           HB1      CYS 115  -3.015  -2.604  -1.562
   69    H    CYS 116           HN       CYS 116  -3.450  -6.834  -1.374
   70    HA   CYS 116           HA       CYS 116  -3.549  -6.670  -4.216
   71    HB2  CYS 116           HB2      CYS 116  -2.150  -8.342  -3.116
   72    HB3  CYS 116           HB1      CYS 116  -3.560  -9.079  -2.382
   73    H    LEU 117           HN       LEU 117  -5.740  -8.076  -1.786
   74    HA   LEU 117           HA       LEU 117  -7.705  -8.760  -3.768
   75    HB2  LEU 117           HB2      LEU 117  -7.380  -9.066  -0.855
   76    HB3  LEU 117           HB1      LEU 117  -9.018  -9.059  -1.463
   77    HG   LEU 117           HG       LEU 117  -6.845 -10.946  -2.377
   78   HD11  LEU 117          HD11      LEU 117  -7.505 -11.370  -0.067
   79   HD12  LEU 117          HD12      LEU 117  -8.071 -12.651  -1.139
   80   HD13  LEU 117          HD13      LEU 117  -9.199 -11.426  -0.556
   81   HD21  LEU 117          HD21      LEU 117  -9.802 -10.878  -2.977
   82   HD22  LEU 117          HD22      LEU 117  -8.678 -12.144  -3.474
   83   HD23  LEU 117          HD23      LEU 117  -8.501 -10.508  -4.109
   84    H    SER 118           HN       SER 118  -6.977  -5.931  -2.004
   85    HA   SER 118           HA       SER 118  -9.585  -4.823  -2.783
   86    HB2  SER 118           HB2      SER 118  -9.715  -5.273  -0.395
   87    HB3  SER 118           HB1      SER 118  -8.223  -4.375  -0.122
   88    HG   SER 118           HG       SER 118 -10.405  -3.134  -1.389
   89    H    GLY 119           HN       GLY 119  -6.348  -3.895  -1.565
   90    HA2  GLY 119           HA2      GLY 119  -4.984  -2.476  -3.020
   91    HA3  GLY 119           HA1      GLY 119  -6.458  -1.607  -3.436
   92    H    CYS 120           HN       CYS 120  -3.903  -0.618  -2.240
   93    HA   CYS 120           HA       CYS 120  -5.070   0.454   0.219
   94    HB2  CYS 120           HB2      CYS 120  -2.203  -0.272  -0.251
   95    HB3  CYS 120           HB1      CYS 120  -2.758   0.665   1.124
   96    H    THR 121           HN       THR 121  -4.952   2.509   0.700
   97    HA   THR 121           HA       THR 121  -4.415   4.366  -1.415
   98    HB   THR 121           HB       THR 121  -5.019   6.095   0.235
   99    HG1  THR 121           HG1      THR 121  -4.248   5.277   2.151
  100   HG21  THR 121          HG21      THR 121  -6.661   4.396  -0.943
  101   HG22  THR 121          HG22      THR 121  -7.242   5.660   0.139
  102   HG23  THR 121          HG23      THR 121  -7.054   4.005   0.728
  103    H    GLN 122           HN       GLN 122  -2.909   6.112  -1.272
  104    HA   GLN 122           HA       GLN 122  -0.325   5.378  -0.513
  105    HB2  GLN 122           HB2      GLN 122  -1.665   8.000  -1.134
  106    HB3  GLN 122           HB1      GLN 122  -0.015   7.983  -0.537
  107    HG2  GLN 122           HG2      GLN 122   0.808   6.958  -2.424
  108    HG3  GLN 122           HG1      GLN 122  -0.746   6.252  -2.839
  109   HE21  GLN 122          HE21      GLN 122   1.235   9.102  -2.952
  110   HE22  GLN 122          HE22      GLN 122   0.291   9.963  -4.115
  111    H    GLN 123           HN       GLN 123  -3.012   6.505   1.322
  112    HA   GLN 123           HA       GLN 123  -1.524   7.533   3.522
  113    HB2  GLN 123           HB2      GLN 123  -4.347   6.776   3.021
  114    HB3  GLN 123           HB1      GLN 123  -3.807   6.789   4.692
  115    HG2  GLN 123           HG2      GLN 123  -4.826   8.911   4.042
  116    HG3  GLN 123           HG1      GLN 123  -3.134   9.102   4.494
  117   HE21  GLN 123          HE21      GLN 123  -2.921  11.013   3.347
  118   HE22  GLN 123          HE22      GLN 123  -2.870  11.056   1.621
  119    H    ASP 124           HN       ASP 124  -3.177   4.420   2.904
  120    HA   ASP 124           HA       ASP 124  -2.339   3.105   5.217
  121    HB2  ASP 124           HB2      ASP 124  -3.551   2.342   2.738
  122    HB3  ASP 124           HB1      ASP 124  -2.207   1.247   3.037
  123    H    LEU 125           HN       LEU 125  -0.859   3.063   2.001
  124    HA   LEU 125           HA       LEU 125   1.477   1.727   2.661
  125    HB2  LEU 125           HB2      LEU 125   1.026   3.812   0.517
  126    HB3  LEU 125           HB1      LEU 125   2.386   2.735   0.582
  127    HG   LEU 125           HG       LEU 125  -0.000   1.176   0.714
  128   HD11  LEU 125          HD11      LEU 125  -1.432   2.315  -0.548
  129   HD12  LEU 125          HD12      LEU 125  -0.308   2.084  -1.889
  130   HD13  LEU 125          HD13      LEU 125  -0.226   3.550  -0.910
  131   HD21  LEU 125          HD21      LEU 125   2.297   0.591  -0.135
  132   HD22  LEU 125          HD22      LEU 125   1.885   1.508  -1.589
  133   HD23  LEU 125          HD23      LEU 125   0.946   0.079  -1.148
  134    H    LEU 126           HN       LEU 126   0.592   5.092   3.107
  135    HA   LEU 126           HA       LEU 126   3.162   6.153   3.576
  136    HB2  LEU 126           HB2      LEU 126   0.378   6.971   4.157
  137    HB3  LEU 126           HB1      LEU 126   1.597   7.661   5.206
  138    HG   LEU 126           HG       LEU 126   1.529   7.905   2.195
  139   HD11  LEU 126          HD11      LEU 126   0.926   9.915   4.360
  140   HD12  LEU 126          HD12      LEU 126  -0.246   9.175   3.269
  141   HD13  LEU 126          HD13      LEU 126   0.997  10.253   2.631
  142   HD21  LEU 126          HD21      LEU 126   3.367   9.168   4.230
  143   HD22  LEU 126          HD22      LEU 126   3.348   9.510   2.500
  144   HD23  LEU 126          HD23      LEU 126   3.809   7.908   3.078
  145    H    THR 127           HN       THR 127   0.922   4.350   5.541
  146    HA   THR 127           HA       THR 127   2.631   4.679   7.892
  147    HB   THR 127           HB       THR 127   0.831   4.404   9.196
  148    HG1  THR 127           HG1      THR 127   0.074   2.438   9.223
  149   HG21  THR 127          HG21      THR 127   0.014   5.834   7.205
  150   HG22  THR 127          HG22      THR 127  -1.183   5.192   8.329
  151   HG23  THR 127          HG23      THR 127  -0.929   4.409   6.770
  152    H    LEU 128           HN       LEU 128   2.470   2.606   5.302
  153    HA   LEU 128           HA       LEU 128   2.933   0.204   6.892
  154    HB2  LEU 128           HB2      LEU 128   2.696   0.587   3.914
  155    HB3  LEU 128           HB1      LEU 128   2.955  -0.945   4.702
  156    HG   LEU 128           HG       LEU 128   0.548   0.779   5.236
  157   HD11  LEU 128          HD11      LEU 128   0.535  -1.660   3.509
  158   HD12  LEU 128          HD12      LEU 128   0.837  -0.064   2.823
  159   HD13  LEU 128          HD13      LEU 128  -0.684  -0.394   3.653
  160   HD21  LEU 128          HD21      LEU 128   0.912  -0.733   7.002
  161   HD22  LEU 128          HD22      LEU 128   1.333  -2.021   5.882
  162   HD23  LEU 128          HD23      LEU 128  -0.334  -1.464   5.985
  163    H    CYS 129           HN       CYS 129   4.630   2.686   5.245
  164    HA   CYS 129           HA       CYS 129   7.046   1.234   4.768
  165    HB2  CYS 129           HB2      CYS 129   8.045   3.338   4.239
  166    HB3  CYS 129           HB1      CYS 129   6.401   3.389   3.627
  167    HA   PRO 130           HA       PRO 130   8.932   1.368   8.755
  168    HB2  PRO 130           HB2      PRO 130  11.544   2.058   7.685
  169    HB3  PRO 130           HB1      PRO 130  10.984   0.515   8.330
  170    HG2  PRO 130           HG2      PRO 130  11.536   0.884   5.704
  171    HG3  PRO 130           HG1      PRO 130  10.293  -0.246   6.274
  172    HD2  PRO 130           HD2      PRO 130   9.970   2.539   5.202
  173    HD3  PRO 130           HD1      PRO 130   9.015   1.085   4.839
  174    H    TYR 131           HN       TYR 131  10.951   3.693   7.090
  175    HA   TYR 131           HA       TYR 131  10.481   5.615   9.249
  176    HB2  TYR 131           HB2      TYR 131  12.635   5.538   7.125
  177    HB3  TYR 131           HB1      TYR 131  12.509   6.751   8.395
  178    HD1  TYR 131           HD2      TYR 131  13.273   3.230   7.668
  179    HD2  TYR 131           HD1      TYR 131  13.161   6.254  10.658
  180    HE1  TYR 131           HE2      TYR 131  14.598   1.793   9.160
  181    HE2  TYR 131           HE1      TYR 131  14.487   4.827  12.159
  182    HH   TYR 131           HH       TYR 131  14.980   2.435  12.467
  183    H2   PRO  25           HT1      PRO  25   0.604  12.158 -10.112
  184    H3   PRO  25           HT2      PRO  25   1.594  12.708  -8.937
  185    HA   PRO  25           HA       PRO  25   0.232  14.175  -8.218
  186    HB2  PRO  25           HB2      PRO  25  -1.334  15.087 -10.391
  187    HB3  PRO  25           HB1      PRO  25  -0.023  15.949  -9.571
  188    HG2  PRO  25           HG2      PRO  25   0.044  14.327 -12.056
  189    HG3  PRO  25           HG1      PRO  25   1.016  15.739 -11.606
  190    HD2  PRO  25           HD2      PRO  25   2.088  13.298 -11.588
  191    HD3  PRO  25           HD1      PRO  25   2.492  14.467 -10.317
  192    H    THR  26           HN       THR  26  -0.896  12.559  -7.190
  193    HA   THR  26           HA       THR  26  -3.586  12.095  -8.098
  194    HB   THR  26           HB       THR  26  -3.277   9.538  -7.744
  195    HG1  THR  26           HG1      THR  26  -0.692  10.438  -7.783
  196   HG21  THR  26          HG21      THR  26  -2.954   9.177 -10.100
  197   HG22  THR  26          HG22      THR  26  -2.190  10.755 -10.282
  198   HG23  THR  26          HG23      THR  26  -3.904  10.647  -9.884
  199    HA   PRO  27           HA       PRO  27  -3.882  11.806  -3.661
  200    HB2  PRO  27           HB2      PRO  27  -6.528  11.623  -3.427
  201    HB3  PRO  27           HB1      PRO  27  -5.779  13.088  -4.073
  202    HG2  PRO  27           HG2      PRO  27  -7.193  10.891  -5.504
  203    HG3  PRO  27           HG1      PRO  27  -7.168  12.628  -5.853
  204    HD2  PRO  27           HD2      PRO  27  -5.615  10.645  -7.111
  205    HD3  PRO  27           HD1      PRO  27  -5.377  12.401  -7.226
  206    H    GLU  28           HN       GLU  28  -5.853  10.377  -2.320
  207    HA   GLU  28           HA       GLU  28  -4.777   7.708  -2.498
  208    HB2  GLU  28           HB2      GLU  28  -6.331   7.302  -0.539
  209    HB3  GLU  28           HB1      GLU  28  -5.038   8.460  -0.324
  210    HG2  GLU  28           HG2      GLU  28  -6.550  10.298  -0.526
  211    HG3  GLU  28           HG1      GLU  28  -7.866   9.219  -0.985
  212    H    MET  29           HN       MET  29  -5.715   7.708  -4.705
  213    HA   MET  29           HA       MET  29  -8.534   7.106  -4.903
  214    HB2  MET  29           HB2      MET  29  -7.162   8.361  -6.664
  215    HB3  MET  29           HB1      MET  29  -6.480   6.794  -7.082
  216    HG2  MET  29           HG2      MET  29  -8.701   5.960  -7.634
  217    HG3  MET  29           HG1      MET  29  -9.399   7.518  -7.196
  218    HE1  MET  29           HE1      MET  29 -10.610   7.656  -9.550
  219    HE2  MET  29           HE2      MET  29  -9.923   6.098 -10.007
  220    HE3  MET  29           HE3      MET  29  -9.776   7.479 -11.093
  221    H    ARG  30           HN       ARG  30  -6.356   5.440  -3.547
  222    HA   ARG  30           HA       ARG  30  -5.821   3.282  -3.183
  223    HB2  ARG  30           HB2      ARG  30  -8.677   3.482  -3.714
  224    HB3  ARG  30           HB1      ARG  30  -8.014   1.880  -3.906
  225    HG2  ARG  30           HG2      ARG  30  -6.860   2.640  -1.584
  226    HG3  ARG  30           HG1      ARG  30  -8.419   3.462  -1.493
  227    HD2  ARG  30           HD2      ARG  30  -9.355   1.180  -2.213
  228    HD3  ARG  30           HD1      ARG  30  -7.807   0.558  -1.660
  229    HE   ARG  30           HE       ARG  30  -9.988   1.328  -0.048
  230   HH11  ARG  30          HH11      ARG  30  -6.510   1.491  -0.156
  231   HH12  ARG  30          HH12      ARG  30  -6.333   1.538   1.566
  232   HH21  ARG  30          HH21      ARG  30  -9.762   1.390   2.216
  233   HH22  ARG  30          HH22      ARG  30  -8.180   1.481   2.914
  234    H    GLU  31           HN       GLU  31  -5.876   1.004  -4.134
  235    HA   GLU  31           HA       GLU  31  -6.124   0.383  -6.813
  236    HB2  GLU  31           HB2      GLU  31  -4.472   2.069  -7.347
  237    HB3  GLU  31           HB1      GLU  31  -3.380   1.448  -6.117
  238    HG2  GLU  31           HG2      GLU  31  -2.534   0.670  -8.144
  239    HG3  GLU  31           HG1      GLU  31  -3.353  -0.712  -7.433
  240    H    LYS  32           HN       LYS  32  -5.724  -1.702  -7.147
  241    HA   LYS  32           HA       LYS  32  -5.271  -3.331  -4.895
  242    HB2  LYS  32           HB2      LYS  32  -5.239  -4.163  -7.780
  243    HB3  LYS  32           HB1      LYS  32  -5.640  -5.141  -6.382
  244    HG2  LYS  32           HG2      LYS  32  -7.546  -3.547  -5.967
  245    HG3  LYS  32           HG1      LYS  32  -7.221  -2.898  -7.566
  246    HD2  LYS  32           HD2      LYS  32  -7.802  -4.895  -8.634
  247    HD3  LYS  32           HD1      LYS  32  -7.643  -5.839  -7.155
  248    HE2  LYS  32           HE2      LYS  32  -9.610  -4.802  -6.247
  249    HE3  LYS  32           HE1      LYS  32  -9.746  -3.739  -7.642
  250    HZ1  LYS  32           HZ1      LYS  32 -10.012  -6.698  -7.664
  251    HZ2  LYS  32           HZ2      LYS  32 -10.094  -5.703  -9.030
  252    HZ3  LYS  32           HZ3      LYS  32 -11.275  -5.584  -7.824
  253    H    LEU  33           HN       LEU  33  -3.365  -3.254  -3.992
  254    HA   LEU  33           HA       LEU  33  -0.919  -3.482  -5.565
  255    HB2  LEU  33           HB2      LEU  33  -0.949  -3.081  -2.640
  256    HB3  LEU  33           HB1      LEU  33   0.167  -2.531  -3.862
  257    HG   LEU  33           HG       LEU  33  -2.598  -1.458  -3.571
  258   HD11  LEU  33          HD11      LEU  33  -1.876   0.238  -2.245
  259   HD12  LEU  33          HD12      LEU  33  -0.220   0.143  -2.835
  260   HD13  LEU  33          HD13      LEU  33  -0.812  -1.050  -1.680
  261   HD21  LEU  33          HD21      LEU  33  -2.175  -0.171  -5.366
  262   HD22  LEU  33          HD22      LEU  33  -0.965  -1.411  -5.731
  263   HD23  LEU  33          HD23      LEU  33  -0.489   0.081  -4.907
  264    H    CYS  34           HN       CYS  34  -0.697  -5.584  -6.071
  265    HA   CYS  34           HA       CYS  34  -0.883  -7.562  -3.927
  266    HB2  CYS  34           HB2      CYS  34  -1.932  -7.746  -6.312
  267    HB3  CYS  34           HB1      CYS  34  -0.326  -8.301  -6.763
  268    H    GLY  35           HN       GLY  35   0.938  -7.317  -2.812
  269    HA2  GLY  35           HA2      GLY  35   3.140  -7.594  -2.234
  270    HA3  GLY  35           HA1      GLY  35   3.264  -8.638  -3.632
  271    H    HIS  36           HN       HIS  36   3.771  -7.613  -5.730
  272    HA   HIS  36           HA       HIS  36   5.830  -5.732  -5.466
  273    HB2  HIS  36           HB2      HIS  36   5.353  -7.502  -7.349
  274    HB3  HIS  36           HB1      HIS  36   4.526  -6.143  -8.113
  275    HD1  HIS  36           HD1      HIS  36   6.455  -6.196  -9.960
  276    HD2  HIS  36           HD2      HIS  36   7.646  -5.207  -6.092
  277    HE1  HIS  36           HE1      HIS  36   8.749  -5.167 -10.172
  278    H    HIS  37           HN       HIS  37   2.592  -5.318  -7.018
  279    HA   HIS  37           HA       HIS  37   2.808  -2.574  -7.479
  280    HB2  HIS  37           HB2      HIS  37   0.478  -4.346  -6.817
  281    HB3  HIS  37           HB1      HIS  37   0.253  -2.598  -6.839
  282    HD1  HIS  37           HD1      HIS  37  -0.934  -2.137  -8.980
  283    HD2  HIS  37           HD2      HIS  37   2.185  -4.828  -9.399
  284    HE1  HIS  37           HE1      HIS  37  -0.755  -2.605 -11.447
  285    H    PHE  38           HN       PHE  38   2.068  -4.445  -4.700
  286    HA   PHE  38           HA       PHE  38   1.434  -2.346  -2.937
  287    HB2  PHE  38           HB2      PHE  38   0.669  -4.546  -2.440
  288    HB3  PHE  38           HB1      PHE  38   2.295  -5.205  -2.543
  289    HD1  PHE  38           HD2      PHE  38   0.722  -2.337  -0.868
  290    HD2  PHE  38           HD1      PHE  38   3.069  -5.874  -0.479
  291    HE1  PHE  38           HE2      PHE  38   1.045  -1.863   1.540
  292    HE2  PHE  38           HE1      PHE  38   3.389  -5.417   1.923
  293    HZ   PHE  38           HZ       PHE  38   2.380  -3.405   2.935
  294    H    VAL  39           HN       VAL  39   4.342  -3.815  -4.022
  295    HA   VAL  39           HA       VAL  39   6.024  -2.684  -2.028
  296    HB   VAL  39           HB       VAL  39   6.385  -4.228  -4.532
  297   HG11  VAL  39          HG11      VAL  39   8.087  -3.046  -5.336
  298   HG12  VAL  39          HG12      VAL  39   8.992  -3.583  -3.922
  299   HG13  VAL  39          HG13      VAL  39   8.167  -2.033  -3.896
  300   HG21  VAL  39          HG21      VAL  39   6.474  -4.869  -1.947
  301   HG22  VAL  39          HG22      VAL  39   8.180  -4.501  -2.206
  302   HG23  VAL  39          HG23      VAL  39   7.387  -5.735  -3.181
  303    H    ARG  40           HN       ARG  40   5.838  -1.966  -5.541
  304    HA   ARG  40           HA       ARG  40   7.202   0.402  -5.526
  305    HB2  ARG  40           HB2      ARG  40   4.773  -0.300  -7.187
  306    HB3  ARG  40           HB1      ARG  40   5.880   1.022  -7.528
  307    HG2  ARG  40           HG2      ARG  40   6.962  -0.431  -8.804
  308    HG3  ARG  40           HG1      ARG  40   7.559  -1.134  -7.310
  309    HD2  ARG  40           HD2      ARG  40   6.091  -2.875  -7.392
  310    HD3  ARG  40           HD1      ARG  40   4.911  -1.991  -8.354
  311    HE   ARG  40           HE       ARG  40   7.459  -2.837  -9.547
  312   HH11  ARG  40          HH11      ARG  40   3.978  -2.948  -9.438
  313   HH12  ARG  40          HH12      ARG  40   3.828  -3.775 -10.953
  314   HH21  ARG  40          HH21      ARG  40   7.272  -3.924 -11.543
  315   HH22  ARG  40          HH22      ARG  40   5.701  -4.330 -12.148
  316    H    ALA  41           HN       ALA  41   3.583   0.158  -5.222
  317    HA   ALA  41           HA       ALA  41   3.186   2.875  -4.841
  318    HB1  ALA  41           HB1      ALA  41   1.068   2.334  -3.903
  319    HB2  ALA  41           HB2      ALA  41   1.608   0.745  -3.353
  320    HB3  ALA  41           HB3      ALA  41   1.409   1.066  -5.078
  321    H    LEU  42           HN       LEU  42   3.949   0.358  -2.393
  322    HA   LEU  42           HA       LEU  42   3.838   1.851  -0.091
  323    HB2  LEU  42           HB2      LEU  42   4.812  -0.621  -0.767
  324    HB3  LEU  42           HB1      LEU  42   6.275   0.214  -0.304
  325    HG   LEU  42           HG       LEU  42   3.832  -0.190   1.421
  326   HD11  LEU  42          HD11      LEU  42   4.980  -2.227   1.338
  327   HD12  LEU  42          HD12      LEU  42   5.585  -1.443   2.798
  328   HD13  LEU  42          HD13      LEU  42   6.558  -1.439   1.330
  329   HD21  LEU  42          HD21      LEU  42   4.547   1.711   2.382
  330   HD22  LEU  42          HD22      LEU  42   6.132   1.610   1.621
  331   HD23  LEU  42          HD23      LEU  42   5.794   0.672   3.075
  332    H    VAL  43           HN       VAL  43   6.361   1.791  -2.513
  333    HA   VAL  43           HA       VAL  43   8.082   3.625  -1.118
  334    HB   VAL  43           HB       VAL  43   8.471   3.226  -4.043
  335   HG11  VAL  43          HG11      VAL  43  10.678   3.413  -3.519
  336   HG12  VAL  43          HG12      VAL  43  10.495   2.477  -2.029
  337   HG13  VAL  43          HG13      VAL  43  10.028   4.185  -2.067
  338   HG21  VAL  43          HG21      VAL  43   7.633   1.052  -3.458
  339   HG22  VAL  43          HG22      VAL  43   8.743   0.976  -2.083
  340   HG23  VAL  43          HG23      VAL  43   9.372   0.975  -3.733
  341    H    ARG  44           HN       ARG  44   6.506   3.793  -4.275
  342    HA   ARG  44           HA       ARG  44   6.617   6.323  -5.060
  343    HB2  ARG  44           HB2      ARG  44   3.962   4.903  -4.720
  344    HB3  ARG  44           HB1      ARG  44   4.329   6.129  -5.907
  345    HG2  ARG  44           HG2      ARG  44   6.220   4.166  -6.364
  346    HG3  ARG  44           HG1      ARG  44   4.735   3.284  -6.000
  347    HD2  ARG  44           HD2      ARG  44   4.018   5.415  -7.686
  348    HD3  ARG  44           HD1      ARG  44   5.468   4.690  -8.364
  349    HE   ARG  44           HE       ARG  44   3.895   2.555  -7.821
  350   HH11  ARG  44          HH11      ARG  44   3.414   5.510  -9.605
  351   HH12  ARG  44          HH12      ARG  44   2.287   4.807 -10.716
  352   HH21  ARG  44          HH21      ARG  44   2.412   1.621  -9.280
  353   HH22  ARG  44          HH22      ARG  44   1.716   2.597 -10.530
  354    H    VAL  45           HN       VAL  45   4.717   5.101  -2.454
  355    HA   VAL  45           HA       VAL  45   3.492   7.519  -1.602
  356    HB   VAL  45           HB       VAL  45   3.908   4.861  -0.230
  357   HG11  VAL  45          HG11      VAL  45   3.341   7.078   1.105
  358   HG12  VAL  45          HG12      VAL  45   2.656   5.507   1.508
  359   HG13  VAL  45          HG13      VAL  45   1.714   6.662   0.565
  360   HG21  VAL  45          HG21      VAL  45   1.218   5.486  -1.030
  361   HG22  VAL  45          HG22      VAL  45   2.205   4.064  -1.358
  362   HG23  VAL  45          HG23      VAL  45   2.321   5.478  -2.406
  363    H    CYS  46           HN       CYS  46   5.745   5.359   0.042
  364    HA   CYS  46           HA       CYS  46   6.945   7.654   1.450
  365    HB2  CYS  46           HB2      CYS  46   5.323   6.366   2.807
  366    HB3  CYS  46           HB1      CYS  46   6.275   4.924   2.549
  367    H    GLY  47           HN       GLY  47   7.342   4.156   1.079
  368    HA2  GLY  47           HA2      GLY  47   9.382   3.451  -0.222
  369    HA3  GLY  47           HA1      GLY  47  10.256   4.625   0.743
  370    H    GLY  48           HN       GLY  48   9.409   1.426   0.431
  371    HA2  GLY  48           HA2      GLY  48   9.201   0.538   3.086
  372    HA3  GLY  48           HA1      GLY  48   9.740  -0.421   1.733
  373    HA   PRO  49           HA       PRO  49  13.562  -0.461   4.035
  374    HB2  PRO  49           HB2      PRO  49  14.928  -2.044   2.297
  375    HB3  PRO  49           HB1      PRO  49  13.716  -2.665   3.417
  376    HG2  PRO  49           HG2      PRO  49  13.435  -2.031   0.517
  377    HG3  PRO  49           HG1      PRO  49  12.844  -3.438   1.422
  378    HD2  PRO  49           HD2      PRO  49  11.270  -1.339   0.799
  379    HD3  PRO  49           HD1      PRO  49  11.013  -2.279   2.246
  380    H    ARG  50           HN       ARG  50  15.846  -0.858   2.014
  381    HA   ARG  50           HA       ARG  50  16.357   1.966   1.635
  382    HB2  ARG  50           HB2      ARG  50  18.112  -0.247   0.712
  383    HB3  ARG  50           HB1      ARG  50  18.579   1.371   1.205
  384    HG2  ARG  50           HG2      ARG  50  17.560  -0.807   3.023
  385    HG3  ARG  50           HG1      ARG  50  19.236  -0.279   2.871
  386    HD2  ARG  50           HD2      ARG  50  16.925   1.419   3.810
  387    HD3  ARG  50           HD1      ARG  50  18.156   0.694   4.841
  388    HE   ARG  50           HE       ARG  50  19.518   2.212   2.988
  389   HH11  ARG  50          HH11      ARG  50  17.117   2.770   5.452
  390   HH12  ARG  50          HH12      ARG  50  17.644   4.387   5.780
  391   HH21  ARG  50          HH21      ARG  50  20.218   4.340   3.416
  392   HH22  ARG  50          HH22      ARG  50  19.406   5.279   4.623
  393    H    TRP  51           HN       TRP  51  15.852  -0.876  -0.402
  394    HA   TRP  51           HA       TRP  51  15.304  -1.144  -2.550
  395    HB2  TRP  51           HB2      TRP  51  15.011   1.836  -2.687
  396    HB3  TRP  51           HB1      TRP  51  14.313   0.626  -3.737
  397    HD1  TRP  51           HD1      TRP  51  13.937   1.995  -0.188
  398    HE1  TRP  51           HE1      TRP  51  11.600   1.314   0.668
  399    HE3  TRP  51           HE3      TRP  51  12.642  -1.011  -3.988
  400    HZ2  TRP  51           HZ2      TRP  51   9.475  -0.367  -0.224
  401    HZ3  TRP  51           HZ3      TRP  51  10.458  -2.147  -3.942
  402    HH2  TRP  51           HH2      TRP  51   8.899  -1.790  -2.071
  403    H    SER  52           HN       SER  52  17.851   1.020  -1.679
  404    HA   SER  52           HA       SER  52  19.271   0.266  -4.124
  405    HB2  SER  52           HB2      SER  52  19.303   3.094  -3.069
  406    HB3  SER  52           HB1      SER  52  20.040   2.497  -4.554
  407    HG   SER  52           HG       SER  52  17.509   3.340  -4.121
  408    H    THR  53           HN       THR  53  21.088  -0.681  -3.553
  409    HA   THR  53           HA       THR  53  22.855   0.502  -1.639
  410    HB   THR  53           HB       THR  53  22.003  -0.585   0.139
  411    HG1  THR  53           HG1      THR  53  23.965  -1.668  -0.096
  412   HG21  THR  53          HG21      THR  53  20.095  -1.374  -1.288
  413   HG22  THR  53          HG22      THR  53  20.502  -2.419   0.074
  414   HG23  THR  53          HG23      THR  53  21.004  -2.860  -1.560
  415    H    GLU  54           HN       GLU  54  22.363  -2.832  -2.788
  416    HA   GLU  54           HA       GLU  54  25.126  -2.997  -3.613
  417    HB2  GLU  54           HB2      GLU  54  22.861  -4.992  -3.781
  418    HB3  GLU  54           HB1      GLU  54  24.527  -5.334  -4.224
  419    HG2  GLU  54           HG2      GLU  54  25.246  -4.937  -1.948
  420    HG3  GLU  54           HG1      GLU  54  23.601  -4.504  -1.485
  421    H    ALA  55           HN       ALA  55  22.638  -1.529  -4.991
  422    HA   ALA  55           HA       ALA  55  22.032  -0.928  -7.099
  423    HB1  ALA  55           HB1      ALA  55  23.807  -0.766  -8.753
  424    HB2  ALA  55           HB2      ALA  55  24.831  -1.823  -7.781
  425    HB3  ALA  55           HB3      ALA  55  24.381  -0.229  -7.173
  Start of MODEL    8
    1    H1   ALA 106           HT1      ALA 106  -5.817   0.693  13.818
    2    H2   ALA 106           HT2      ALA 106  -5.375   1.892  14.927
    3    H3   ALA 106           HT3      ALA 106  -4.592   0.393  14.947
    4    HA   ALA 106           HA       ALA 106  -4.484   2.363  12.738
    5    HB1  ALA 106           HB1      ALA 106  -2.412   1.618  14.799
    6    HB2  ALA 106           HB2      ALA 106  -3.267   3.156  14.678
    7    HB3  ALA 106           HB3      ALA 106  -2.139   2.671  13.411
    8    H    ALA 107           HN       ALA 107  -2.978  -0.557  14.126
    9    HA   ALA 107           HA       ALA 107  -1.893  -1.317  11.558
   10    HB1  ALA 107           HB1      ALA 107  -0.640  -1.733  13.627
   11    HB2  ALA 107           HB2      ALA 107  -0.952  -3.223  12.736
   12    HB3  ALA 107           HB3      ALA 107  -1.908  -2.833  14.167
   13    H    ALA 108           HN       ALA 108  -2.361  -3.321  10.492
   14    HA   ALA 108           HA       ALA 108  -4.976  -4.497  11.131
   15    HB1  ALA 108           HB1      ALA 108  -5.916  -4.025   9.137
   16    HB2  ALA 108           HB2      ALA 108  -4.396  -4.199   8.260
   17    HB3  ALA 108           HB3      ALA 108  -4.751  -2.701   9.127
   18    H    THR 109           HN       THR 109  -4.985  -6.082   8.727
   19    HA   THR 109           HA       THR 109  -3.363  -8.265   9.617
   20    HB   THR 109           HB       THR 109  -5.627  -8.562   8.634
   21    HG1  THR 109           HG1      THR 109  -4.781 -10.470   8.310
   22   HG21  THR 109          HG21      THR 109  -5.027  -6.772   6.785
   23   HG22  THR 109          HG22      THR 109  -6.171  -8.077   6.456
   24   HG23  THR 109          HG23      THR 109  -4.504  -8.205   5.895
   25    H    ASN 110           HN       ASN 110  -2.958  -9.117   6.703
   26    HA   ASN 110           HA       ASN 110  -0.291  -8.075   6.457
   27    HB2  ASN 110           HB2      ASN 110  -1.876  -9.938   4.676
   28    HB3  ASN 110           HB1      ASN 110  -0.174  -9.554   4.456
   29   HD21  ASN 110          HD21      ASN 110   1.332 -10.420   5.835
   30   HD22  ASN 110          HD22      ASN 110   0.960 -11.702   6.927
   31    HA   PRO 111           HA       PRO 111  -1.850  -4.629   4.046
   32    HB2  PRO 111           HB2      PRO 111   0.483  -3.348   3.751
   33    HB3  PRO 111           HB1      PRO 111  -0.425  -3.319   5.260
   34    HG2  PRO 111           HG2      PRO 111   1.917  -5.037   4.506
   35    HG3  PRO 111           HG1      PRO 111   1.633  -4.137   6.009
   36    HD2  PRO 111           HD2      PRO 111   1.149  -6.782   5.807
   37    HD3  PRO 111           HD1      PRO 111   0.155  -5.715   6.822
   38    H    ALA 112           HN       ALA 112   0.254  -7.103   3.105
   39    HA   ALA 112           HA       ALA 112   0.602  -6.070   0.395
   40    HB1  ALA 112           HB1      ALA 112   1.534  -8.778   1.184
   41    HB2  ALA 112           HB2      ALA 112   2.337  -7.378   1.884
   42    HB3  ALA 112           HB3      ALA 112   2.294  -7.581   0.133
   43    H    ARG 113           HN       ARG 113  -0.955  -8.671   2.144
   44    HA   ARG 113           HA       ARG 113  -2.041  -9.932  -0.194
   45    HB2  ARG 113           HB2      ARG 113  -1.536 -10.912   2.186
   46    HB3  ARG 113           HB1      ARG 113  -3.154 -10.341   2.553
   47    HG2  ARG 113           HG2      ARG 113  -3.491 -12.546   1.938
   48    HG3  ARG 113           HG1      ARG 113  -3.873 -11.652   0.466
   49    HD2  ARG 113           HD2      ARG 113  -2.495 -13.614  -0.013
   50    HD3  ARG 113           HD1      ARG 113  -1.651 -12.119  -0.413
   51    HE   ARG 113           HE       ARG 113  -0.758 -12.582   2.058
   52   HH11  ARG 113          HH11      ARG 113  -1.077 -14.701  -0.691
   53   HH12  ARG 113          HH12      ARG 113   0.264 -15.700  -0.239
   54   HH21  ARG 113          HH21      ARG 113   1.007 -13.892   2.663
   55   HH22  ARG 113          HH22      ARG 113   1.448 -15.240   1.668
   56    H    TYR 114           HN       TYR 114  -3.454  -8.048   2.477
   57    HA   TYR 114           HA       TYR 114  -6.073  -8.045   1.576
   58    HB2  TYR 114           HB2      TYR 114  -6.494  -6.751   3.362
   59    HB3  TYR 114           HB1      TYR 114  -4.807  -7.020   3.758
   60    HD1  TYR 114           HD1      TYR 114  -6.925  -4.628   1.781
   61    HD2  TYR 114           HD2      TYR 114  -3.515  -5.177   4.269
   62    HE1  TYR 114           HE1      TYR 114  -6.558  -2.198   1.810
   63    HE2  TYR 114           HE2      TYR 114  -3.144  -2.751   4.312
   64    HH   TYR 114           HH       TYR 114  -3.686  -0.784   2.994
   65    H    CYS 115           HN       CYS 115  -3.383  -6.067   0.480
   66    HA   CYS 115           HA       CYS 115  -5.141  -4.291  -0.935
   67    HB2  CYS 115           HB2      CYS 115  -2.119  -4.501  -1.145
   68    HB3  CYS 115           HB1      CYS 115  -3.139  -3.245  -1.839
   69    H    CYS 116           HN       CYS 116  -3.612  -7.289  -1.633
   70    HA   CYS 116           HA       CYS 116  -3.678  -7.029  -4.474
   71    HB2  CYS 116           HB2      CYS 116  -2.276  -8.730  -3.331
   72    HB3  CYS 116           HB1      CYS 116  -3.726  -9.538  -2.768
   73    H    LEU 117           HN       LEU 117  -5.910  -8.052  -1.989
   74    HA   LEU 117           HA       LEU 117  -7.915  -8.900  -3.879
   75    HB2  LEU 117           HB2      LEU 117  -7.607  -8.857  -0.945
   76    HB3  LEU 117           HB1      LEU 117  -9.243  -8.776  -1.553
   77    HG   LEU 117           HG       LEU 117  -7.258 -10.958  -2.198
   78   HD11  LEU 117          HD11      LEU 117  -9.643 -10.953  -0.356
   79   HD12  LEU 117          HD12      LEU 117  -7.951 -11.053   0.126
   80   HD13  LEU 117          HD13      LEU 117  -8.686 -12.368  -0.791
   81   HD21  LEU 117          HD21      LEU 117  -8.860 -10.576  -3.999
   82   HD22  LEU 117          HD22      LEU 117 -10.191 -10.701  -2.851
   83   HD23  LEU 117          HD23      LEU 117  -9.178 -12.106  -3.181
   84    H    SER 118           HN       SER 118  -7.043  -5.994  -2.200
   85    HA   SER 118           HA       SER 118  -9.352  -4.648  -3.413
   86    HB2  SER 118           HB2      SER 118  -9.651  -3.277  -1.371
   87    HB3  SER 118           HB1      SER 118  -9.954  -4.988  -1.079
   88    HG   SER 118           HG       SER 118  -8.466  -3.598   0.376
   89    H    GLY 119           HN       GLY 119  -6.484  -3.812  -1.433
   90    HA2  GLY 119           HA2      GLY 119  -4.637  -2.752  -2.792
   91    HA3  GLY 119           HA1      GLY 119  -5.897  -1.694  -3.414
   92    H    CYS 120           HN       CYS 120  -3.488  -0.828  -2.054
   93    HA   CYS 120           HA       CYS 120  -4.620   0.154   0.471
   94    HB2  CYS 120           HB2      CYS 120  -1.821   0.793   0.168
   95    HB3  CYS 120           HB1      CYS 120  -2.645   0.011   1.501
   96    H    THR 121           HN       THR 121  -4.261   2.252   1.144
   97    HA   THR 121           HA       THR 121  -4.330   4.181  -1.045
   98    HB   THR 121           HB       THR 121  -4.988   5.778   0.775
   99    HG1  THR 121           HG1      THR 121  -4.754   3.411   2.306
  100   HG21  THR 121          HG21      THR 121  -6.498   4.031  -0.580
  101   HG22  THR 121          HG22      THR 121  -7.154   5.260   0.499
  102   HG23  THR 121          HG23      THR 121  -6.935   3.605   1.072
  103    H    GLN 122           HN       GLN 122  -2.962   6.031  -1.033
  104    HA   GLN 122           HA       GLN 122  -0.294   5.573  -0.302
  105    HB2  GLN 122           HB2      GLN 122  -1.884   7.909  -1.230
  106    HB3  GLN 122           HB1      GLN 122  -0.371   8.270  -0.414
  107    HG2  GLN 122           HG2      GLN 122   0.880   7.024  -1.999
  108    HG3  GLN 122           HG1      GLN 122  -0.580   6.361  -2.714
  109   HE21  GLN 122          HE21      GLN 122  -0.263   9.696  -1.741
  110   HE22  GLN 122          HE22      GLN 122  -0.272  10.369  -3.331
  111    H    GLN 123           HN       GLN 123  -2.948   6.219   1.645
  112    HA   GLN 123           HA       GLN 123  -1.446   7.557   3.720
  113    HB2  GLN 123           HB2      GLN 123  -4.248   6.692   3.331
  114    HB3  GLN 123           HB1      GLN 123  -3.655   6.674   4.985
  115    HG2  GLN 123           HG2      GLN 123  -3.643   9.036   3.122
  116    HG3  GLN 123           HG1      GLN 123  -4.744   8.773   4.470
  117   HE21  GLN 123          HE21      GLN 123  -2.612   7.636   6.138
  118   HE22  GLN 123          HE22      GLN 123  -1.666   8.980   6.669
  119    H    ASP 124           HN       ASP 124  -3.040   4.384   3.294
  120    HA   ASP 124           HA       ASP 124  -2.003   3.144   5.564
  121    HB2  ASP 124           HB2      ASP 124  -3.653   2.270   3.646
  122    HB3  ASP 124           HB1      ASP 124  -2.169   1.556   3.036
  123    H    LEU 125           HN       LEU 125  -0.752   3.121   2.250
  124    HA   LEU 125           HA       LEU 125   1.637   1.803   2.745
  125    HB2  LEU 125           HB2      LEU 125   1.056   3.884   0.626
  126    HB3  LEU 125           HB1      LEU 125   2.403   2.801   0.620
  127    HG   LEU 125           HG       LEU 125  -0.032   1.301   0.861
  128   HD11  LEU 125          HD11      LEU 125  -1.311   2.032  -0.870
  129   HD12  LEU 125          HD12      LEU 125   0.079   2.645  -1.759
  130   HD13  LEU 125          HD13      LEU 125  -0.597   3.585  -0.430
  131   HD21  LEU 125          HD21      LEU 125   2.300   0.684   0.004
  132   HD22  LEU 125          HD22      LEU 125   1.798   1.472  -1.497
  133   HD23  LEU 125          HD23      LEU 125   0.906   0.073  -0.887
  134    H    LEU 126           HN       LEU 126   0.788   5.213   3.148
  135    HA   LEU 126           HA       LEU 126   3.387   6.219   3.523
  136    HB2  LEU 126           HB2      LEU 126   0.645   7.115   4.057
  137    HB3  LEU 126           HB1      LEU 126   1.825   7.767   5.172
  138    HG   LEU 126           HG       LEU 126   1.920   8.013   2.168
  139   HD11  LEU 126          HD11      LEU 126   1.291  10.058   4.295
  140   HD12  LEU 126          HD12      LEU 126   0.144   9.354   3.154
  141   HD13  LEU 126          HD13      LEU 126   1.452  10.381   2.568
  142   HD21  LEU 126          HD21      LEU 126   3.754   9.625   2.626
  143   HD22  LEU 126          HD22      LEU 126   4.156   7.962   3.054
  144   HD23  LEU 126          HD23      LEU 126   3.727   9.118   4.315
  145    H    THR 127           HN       THR 127   1.225   4.463   5.614
  146    HA   THR 127           HA       THR 127   2.991   4.906   7.905
  147    HB   THR 127           HB       THR 127   1.243   4.586   9.275
  148    HG1  THR 127           HG1      THR 127   0.558   2.595   9.337
  149   HG21  THR 127          HG21      THR 127   0.334   5.979   7.301
  150   HG22  THR 127          HG22      THR 127  -0.814   5.314   8.461
  151   HG23  THR 127          HG23      THR 127  -0.583   4.528   6.900
  152    H    LEU 128           HN       LEU 128   2.796   2.770   5.381
  153    HA   LEU 128           HA       LEU 128   3.393   0.406   6.978
  154    HB2  LEU 128           HB2      LEU 128   3.000   0.796   4.025
  155    HB3  LEU 128           HB1      LEU 128   3.429  -0.727   4.757
  156    HG   LEU 128           HG       LEU 128   0.941   0.779   5.518
  157   HD11  LEU 128          HD11      LEU 128   1.408  -1.218   3.340
  158   HD12  LEU 128          HD12      LEU 128   0.615   0.354   3.232
  159   HD13  LEU 128          HD13      LEU 128  -0.179  -0.983   4.068
  160   HD21  LEU 128          HD21      LEU 128   1.487  -0.786   7.167
  161   HD22  LEU 128          HD22      LEU 128   2.017  -1.963   5.968
  162   HD23  LEU 128          HD23      LEU 128   0.301  -1.606   6.146
  163    H    CYS 129           HN       CYS 129   4.969   2.862   5.117
  164    HA   CYS 129           HA       CYS 129   7.353   1.506   4.502
  165    HB2  CYS 129           HB2      CYS 129   8.385   3.753   4.348
  166    HB3  CYS 129           HB1      CYS 129   6.865   3.640   3.473
  167    HA   PRO 130           HA       PRO 130   9.250   1.266   8.494
  168    HB2  PRO 130           HB2      PRO 130  11.803   0.705   7.384
  169    HB3  PRO 130           HB1      PRO 130  10.592  -0.456   7.930
  170    HG2  PRO 130           HG2      PRO 130  11.397  -0.107   5.296
  171    HG3  PRO 130           HG1      PRO 130   9.890  -0.885   5.810
  172    HD2  PRO 130           HD2      PRO 130  10.353   1.911   4.850
  173    HD3  PRO 130           HD1      PRO 130   8.985   0.822   4.529
  174    H    TYR 131           HN       TYR 131  11.890   2.360   6.488
  175    HA   TYR 131           HA       TYR 131  12.407   4.536   8.373
  176    HB2  TYR 131           HB2      TYR 131  14.158   3.420   6.171
  177    HB3  TYR 131           HB1      TYR 131  14.636   4.643   7.343
  178    HD1  TYR 131           HD1      TYR 131  15.023   4.032   9.688
  179    HD2  TYR 131           HD2      TYR 131  14.035   1.092   6.776
  180    HE1  TYR 131           HE1      TYR 131  15.776   2.266  11.224
  181    HE2  TYR 131           HE2      TYR 131  14.784  -0.683   8.306
  182    HH   TYR 131           HH       TYR 131  15.407  -0.129  11.597
  183    H2   PRO  25           HT1      PRO  25  -0.803  14.729  -7.399
  184    H3   PRO  25           HT2      PRO  25  -0.826  15.954  -8.478
  185    HA   PRO  25           HA       PRO  25  -0.401  14.726 -10.167
  186    HB2  PRO  25           HB2      PRO  25   1.152  12.524  -9.280
  187    HB3  PRO  25           HB1      PRO  25   1.682  13.899 -10.259
  188    HG2  PRO  25           HG2      PRO  25   1.876  13.476  -7.329
  189    HG3  PRO  25           HG1      PRO  25   2.944  14.391  -8.408
  190    HD2  PRO  25           HD2      PRO  25   1.294  15.659  -6.741
  191    HD3  PRO  25           HD1      PRO  25   1.563  16.274  -8.383
  192    H    THR  26           HN       THR  26  -0.585  12.798  -7.184
  193    HA   THR  26           HA       THR  26  -3.123  11.690  -7.939
  194    HB   THR  26           HB       THR  26  -2.099   9.282  -7.559
  195    HG1  THR  26           HG1      THR  26   0.066  10.743  -8.701
  196   HG21  THR  26          HG21      THR  26  -1.807  10.653 -10.231
  197   HG22  THR  26          HG22      THR  26  -3.340  10.095  -9.562
  198   HG23  THR  26          HG23      THR  26  -2.067   8.932  -9.937
  199    HA   PRO  27           HA       PRO  27  -2.960  11.364  -3.471
  200    HB2  PRO  27           HB2      PRO  27  -5.601  11.267  -3.069
  201    HB3  PRO  27           HB1      PRO  27  -4.818  12.737  -3.658
  202    HG2  PRO  27           HG2      PRO  27  -6.549  10.828  -5.091
  203    HG3  PRO  27           HG1      PRO  27  -6.211  12.528  -5.450
  204    HD2  PRO  27           HD2      PRO  27  -5.021  10.174  -6.622
  205    HD3  PRO  27           HD1      PRO  27  -4.734  11.878  -7.035
  206    H    GLU  28           HN       GLU  28  -4.956   9.975  -2.081
  207    HA   GLU  28           HA       GLU  28  -3.998   7.273  -2.367
  208    HB2  GLU  28           HB2      GLU  28  -5.702   6.899  -0.454
  209    HB3  GLU  28           HB1      GLU  28  -4.237   7.811  -0.151
  210    HG2  GLU  28           HG2      GLU  28  -5.416   9.874  -0.205
  211    HG3  GLU  28           HG1      GLU  28  -6.876   9.088  -0.801
  212    H    MET  29           HN       MET  29  -4.804   6.916  -4.442
  213    HA   MET  29           HA       MET  29  -7.662   6.764  -4.837
  214    HB2  MET  29           HB2      MET  29  -6.021   7.548  -6.602
  215    HB3  MET  29           HB1      MET  29  -5.504   5.872  -6.740
  216    HG2  MET  29           HG2      MET  29  -7.016   5.898  -8.402
  217    HG3  MET  29           HG1      MET  29  -8.101   5.491  -7.077
  218    HE1  MET  29           HE1      MET  29  -9.044   6.731  -9.907
  219    HE2  MET  29           HE2      MET  29 -10.274   7.857  -9.335
  220    HE3  MET  29           HE3      MET  29 -10.139   6.256  -8.609
  221    H    ARG  30           HN       ARG  30  -5.838   4.946  -3.135
  222    HA   ARG  30           HA       ARG  30  -5.614   2.707  -2.625
  223    HB2  ARG  30           HB2      ARG  30  -8.096   3.707  -2.198
  224    HB3  ARG  30           HB1      ARG  30  -8.439   2.288  -3.180
  225    HG2  ARG  30           HG2      ARG  30  -6.551   1.513  -1.249
  226    HG3  ARG  30           HG1      ARG  30  -7.795   2.448  -0.414
  227    HD2  ARG  30           HD2      ARG  30  -9.474   1.068  -1.644
  228    HD3  ARG  30           HD1      ARG  30  -8.137   0.021  -2.123
  229    HE   ARG  30           HE       ARG  30  -7.934   0.215   0.592
  230   HH11  ARG  30          HH11      ARG  30 -10.447  -0.769  -1.612
  231   HH12  ARG  30          HH12      ARG  30 -11.160  -1.891  -0.502
  232   HH21  ARG  30          HH21      ARG  30  -8.867  -1.260   2.062
  233   HH22  ARG  30          HH22      ARG  30 -10.263  -2.169   1.587
  234    H    GLU  31           HN       GLU  31  -4.430   1.806  -4.335
  235    HA   GLU  31           HA       GLU  31  -6.050   0.532  -6.432
  236    HB2  GLU  31           HB2      GLU  31  -4.465   2.020  -7.424
  237    HB3  GLU  31           HB1      GLU  31  -3.166   1.418  -6.405
  238    HG2  GLU  31           HG2      GLU  31  -2.787   0.497  -8.511
  239    HG3  GLU  31           HG1      GLU  31  -3.471  -0.811  -7.558
  240    H    LYS  32           HN       LYS  32  -5.636  -1.542  -7.056
  241    HA   LYS  32           HA       LYS  32  -5.261  -3.351  -4.961
  242    HB2  LYS  32           HB2      LYS  32  -5.157  -3.940  -7.906
  243    HB3  LYS  32           HB1      LYS  32  -5.616  -5.028  -6.608
  244    HG2  LYS  32           HG2      LYS  32  -7.506  -3.499  -6.096
  245    HG3  LYS  32           HG1      LYS  32  -7.122  -2.622  -7.565
  246    HD2  LYS  32           HD2      LYS  32  -8.568  -4.039  -8.540
  247    HD3  LYS  32           HD1      LYS  32  -7.218  -5.175  -8.492
  248    HE2  LYS  32           HE2      LYS  32  -9.368  -4.894  -6.400
  249    HE3  LYS  32           HE1      LYS  32  -9.272  -6.174  -7.610
  250    HZ1  LYS  32           HZ1      LYS  32  -7.293  -5.654  -5.456
  251    HZ2  LYS  32           HZ2      LYS  32  -7.151  -6.854  -6.638
  252    HZ3  LYS  32           HZ3      LYS  32  -8.402  -6.930  -5.504
  253    H    LEU  33           HN       LEU  33  -3.388  -3.341  -4.006
  254    HA   LEU  33           HA       LEU  33  -0.900  -3.594  -5.495
  255    HB2  LEU  33           HB2      LEU  33  -1.340  -3.152  -2.580
  256    HB3  LEU  33           HB1      LEU  33   0.135  -3.036  -3.480
  257    HG   LEU  33           HG       LEU  33  -2.227  -1.234  -3.833
  258   HD11  LEU  33          HD11      LEU  33  -1.381  -0.358  -1.953
  259   HD12  LEU  33          HD12      LEU  33  -0.266   0.401  -3.075
  260   HD13  LEU  33          HD13      LEU  33   0.215  -1.054  -2.209
  261   HD21  LEU  33          HD21      LEU  33  -0.983  -0.030  -5.432
  262   HD22  LEU  33          HD22      LEU  33  -0.846  -1.733  -5.885
  263   HD23  LEU  33          HD23      LEU  33   0.490  -0.925  -5.061
  264    H    CYS  34           HN       CYS  34  -0.610  -5.700  -6.049
  265    HA   CYS  34           HA       CYS  34  -1.047  -7.759  -4.017
  266    HB2  CYS  34           HB2      CYS  34  -1.881  -7.858  -6.456
  267    HB3  CYS  34           HB1      CYS  34  -0.232  -8.323  -6.843
  268    H    GLY  35           HN       GLY  35   0.767  -6.998  -2.826
  269    HA2  GLY  35           HA2      GLY  35   2.877  -7.386  -1.996
  270    HA3  GLY  35           HA1      GLY  35   3.098  -8.567  -3.266
  271    H    HIS  36           HN       HIS  36   3.679  -7.666  -5.470
  272    HA   HIS  36           HA       HIS  36   5.814  -5.869  -5.204
  273    HB2  HIS  36           HB2      HIS  36   5.400  -7.695  -7.019
  274    HB3  HIS  36           HB1      HIS  36   4.570  -6.390  -7.873
  275    HD1  HIS  36           HD1      HIS  36   6.536  -6.491  -9.677
  276    HD2  HIS  36           HD2      HIS  36   7.633  -5.327  -5.833
  277    HE1  HIS  36           HE1      HIS  36   8.820  -5.436  -9.887
  278    H    HIS  37           HN       HIS  37   2.626  -5.419  -6.840
  279    HA   HIS  37           HA       HIS  37   2.941  -2.704  -7.421
  280    HB2  HIS  37           HB2      HIS  37   0.489  -4.253  -6.567
  281    HB3  HIS  37           HB1      HIS  37   0.425  -2.535  -6.955
  282    HD1  HIS  37           HD1      HIS  37  -0.783  -2.526  -9.148
  283    HD2  HIS  37           HD2      HIS  37   2.270  -5.321  -8.972
  284    HE1  HIS  37           HE1      HIS  37  -0.602  -3.496 -11.463
  285    H    PHE  38           HN       PHE  38   2.066  -4.443  -4.585
  286    HA   PHE  38           HA       PHE  38   1.476  -2.272  -2.919
  287    HB2  PHE  38           HB2      PHE  38   0.693  -4.433  -2.307
  288    HB3  PHE  38           HB1      PHE  38   2.303  -5.119  -2.385
  289    HD1  PHE  38           HD2      PHE  38   0.534  -2.348  -0.761
  290    HD2  PHE  38           HD1      PHE  38   3.329  -5.526  -0.356
  291    HE1  PHE  38           HE2      PHE  38   0.829  -1.771   1.615
  292    HE2  PHE  38           HE1      PHE  38   3.639  -4.966   2.030
  293    HZ   PHE  38           HZ       PHE  38   2.388  -3.077   3.020
  294    H    VAL  39           HN       VAL  39   4.403  -3.831  -3.892
  295    HA   VAL  39           HA       VAL  39   6.065  -2.613  -1.938
  296    HB   VAL  39           HB       VAL  39   6.481  -4.211  -4.407
  297   HG11  VAL  39          HG11      VAL  39   8.120  -2.907  -5.200
  298   HG12  VAL  39          HG12      VAL  39   9.060  -3.550  -3.855
  299   HG13  VAL  39          HG13      VAL  39   8.255  -1.995  -3.698
  300   HG21  VAL  39          HG21      VAL  39   6.519  -4.856  -1.852
  301   HG22  VAL  39          HG22      VAL  39   8.206  -4.355  -1.999
  302   HG23  VAL  39          HG23      VAL  39   7.578  -5.647  -3.021
  303    H    ARG  40           HN       ARG  40   5.911  -2.023  -5.477
  304    HA   ARG  40           HA       ARG  40   7.211   0.369  -5.564
  305    HB2  ARG  40           HB2      ARG  40   4.772  -0.473  -7.143
  306    HB3  ARG  40           HB1      ARG  40   5.790   0.904  -7.547
  307    HG2  ARG  40           HG2      ARG  40   6.958  -0.503  -8.793
  308    HG3  ARG  40           HG1      ARG  40   7.585  -1.169  -7.295
  309    HD2  ARG  40           HD2      ARG  40   6.147  -2.955  -7.346
  310    HD3  ARG  40           HD1      ARG  40   4.984  -2.139  -8.388
  311    HE   ARG  40           HE       ARG  40   7.608  -2.881  -9.466
  312   HH11  ARG  40          HH11      ARG  40   4.149  -3.309  -9.401
  313   HH12  ARG  40          HH12      ARG  40   4.107  -4.218 -10.874
  314   HH21  ARG  40          HH21      ARG  40   7.558  -4.073 -11.405
  315   HH22  ARG  40          HH22      ARG  40   6.045  -4.653 -12.013
  316    H    ALA  41           HN       ALA  41   3.599   0.115  -5.290
  317    HA   ALA  41           HA       ALA  41   3.147   2.799  -4.881
  318    HB1  ALA  41           HB1      ALA  41   1.043   2.227  -4.028
  319    HB2  ALA  41           HB2      ALA  41   1.609   0.724  -3.290
  320    HB3  ALA  41           HB3      ALA  41   1.450   0.851  -5.048
  321    H    LEU  42           HN       LEU  42   3.922   0.317  -2.384
  322    HA   LEU  42           HA       LEU  42   3.779   1.857  -0.124
  323    HB2  LEU  42           HB2      LEU  42   4.808  -0.610  -0.726
  324    HB3  LEU  42           HB1      LEU  42   6.254   0.264  -0.290
  325    HG   LEU  42           HG       LEU  42   3.817  -0.086   1.456
  326   HD11  LEU  42          HD11      LEU  42   4.782  -2.127   1.668
  327   HD12  LEU  42          HD12      LEU  42   5.816  -1.247   2.797
  328   HD13  LEU  42          HD13      LEU  42   6.368  -1.555   1.151
  329   HD21  LEU  42          HD21      LEU  42   4.662   1.909   2.199
  330   HD22  LEU  42          HD22      LEU  42   6.299   1.526   1.670
  331   HD23  LEU  42          HD23      LEU  42   5.652   0.786   3.137
  332    H    VAL  43           HN       VAL  43   6.367   1.728  -2.480
  333    HA   VAL  43           HA       VAL  43   8.061   3.620  -1.174
  334    HB   VAL  43           HB       VAL  43   8.356   3.242  -4.114
  335   HG11  VAL  43          HG11      VAL  43  10.591   3.387  -3.665
  336   HG12  VAL  43          HG12      VAL  43  10.431   2.525  -2.130
  337   HG13  VAL  43          HG13      VAL  43   9.973   4.232  -2.239
  338   HG21  VAL  43          HG21      VAL  43   7.588   1.052  -3.593
  339   HG22  VAL  43          HG22      VAL  43   8.639   0.978  -2.176
  340   HG23  VAL  43          HG23      VAL  43   9.338   0.990  -3.796
  341    H    ARG  44           HN       ARG  44   6.429   3.789  -4.306
  342    HA   ARG  44           HA       ARG  44   6.499   6.331  -5.070
  343    HB2  ARG  44           HB2      ARG  44   3.863   4.872  -4.799
  344    HB3  ARG  44           HB1      ARG  44   4.281   6.055  -6.015
  345    HG2  ARG  44           HG2      ARG  44   6.196   4.141  -6.384
  346    HG3  ARG  44           HG1      ARG  44   4.773   3.199  -5.936
  347    HD2  ARG  44           HD2      ARG  44   3.591   4.782  -7.667
  348    HD3  ARG  44           HD1      ARG  44   5.231   4.953  -8.286
  349    HE   ARG  44           HE       ARG  44   4.213   2.250  -7.897
  350   HH11  ARG  44          HH11      ARG  44   5.025   4.844 -10.081
  351   HH12  ARG  44          HH12      ARG  44   5.027   3.830 -11.486
  352   HH21  ARG  44          HH21      ARG  44   4.214   0.912  -9.740
  353   HH22  ARG  44          HH22      ARG  44   4.564   1.596 -11.293
  354    H    VAL  45           HN       VAL  45   4.556   5.063  -2.510
  355    HA   VAL  45           HA       VAL  45   3.210   7.439  -1.739
  356    HB   VAL  45           HB       VAL  45   3.673   4.867  -0.235
  357   HG11  VAL  45          HG11      VAL  45   2.103   7.286   0.341
  358   HG12  VAL  45          HG12      VAL  45   2.875   6.126   1.424
  359   HG13  VAL  45          HG13      VAL  45   1.332   5.735   0.675
  360   HG21  VAL  45          HG21      VAL  45   1.028   5.096  -1.238
  361   HG22  VAL  45          HG22      VAL  45   2.252   3.873  -1.569
  362   HG23  VAL  45          HG23      VAL  45   2.164   5.323  -2.568
  363    H    CYS  46           HN       CYS  46   5.686   5.454  -0.139
  364    HA   CYS  46           HA       CYS  46   6.576   7.827   1.373
  365    HB2  CYS  46           HB2      CYS  46   5.114   6.219   2.648
  366    HB3  CYS  46           HB1      CYS  46   6.362   5.014   2.433
  367    H    GLY  47           HN       GLY  47   7.393   4.436   0.829
  368    HA2  GLY  47           HA2      GLY  47   9.517   4.033  -0.459
  369    HA3  GLY  47           HA1      GLY  47  10.248   5.229   0.599
  370    H    GLY  48           HN       GLY  48   9.889   2.010   0.071
  371    HA2  GLY  48           HA2      GLY  48   9.511   0.909   2.618
  372    HA3  GLY  48           HA1      GLY  48  10.322   0.130   1.284
  373    HA   PRO  49           HA       PRO  49  13.705   0.275   4.214
  374    HB2  PRO  49           HB2      PRO  49  15.400  -1.261   2.773
  375    HB3  PRO  49           HB1      PRO  49  14.029  -1.925   3.662
  376    HG2  PRO  49           HG2      PRO  49  14.241  -1.295   0.752
  377    HG3  PRO  49           HG1      PRO  49  13.576  -2.739   1.540
  378    HD2  PRO  49           HD2      PRO  49  12.022  -0.725   0.644
  379    HD3  PRO  49           HD1      PRO  49  11.576  -1.689   2.043
  380    H    ARG  50           HN       ARG  50  14.943   0.204   0.900
  381    HA   ARG  50           HA       ARG  50  15.875   2.921   1.031
  382    HB2  ARG  50           HB2      ARG  50  18.179   1.692   0.288
  383    HB3  ARG  50           HB1      ARG  50  17.876   2.386   1.870
  384    HG2  ARG  50           HG2      ARG  50  17.022   0.127   2.566
  385    HG3  ARG  50           HG1      ARG  50  17.631  -0.491   1.030
  386    HD2  ARG  50           HD2      ARG  50  19.270  -0.896   2.743
  387    HD3  ARG  50           HD1      ARG  50  19.883   0.338   1.642
  388    HE   ARG  50           HE       ARG  50  18.701   1.754   3.649
  389   HH11  ARG  50          HH11      ARG  50  21.153  -0.718   3.518
  390   HH12  ARG  50          HH12      ARG  50  21.991  -0.139   4.918
  391   HH21  ARG  50          HH21      ARG  50  19.797   2.521   5.491
  392   HH22  ARG  50          HH22      ARG  50  21.220   1.702   6.041
  393    H    TRP  51           HN       TRP  51  15.901  -0.173  -0.656
  394    HA   TRP  51           HA       TRP  51  15.551  -0.757  -2.772
  395    HB2  TRP  51           HB2      TRP  51  14.943   2.096  -3.423
  396    HB3  TRP  51           HB1      TRP  51  14.370   0.639  -4.198
  397    HD1  TRP  51           HD1      TRP  51  13.805   2.706  -1.038
  398    HE1  TRP  51           HE1      TRP  51  11.572   1.978   0.007
  399    HE3  TRP  51           HE3      TRP  51  12.830  -1.205  -4.058
  400    HZ2  TRP  51           HZ2      TRP  51   9.637  -0.056  -0.436
  401    HZ3  TRP  51           HZ3      TRP  51  10.778  -2.510  -3.692
  402    HH2  TRP  51           HH2      TRP  51   9.206  -1.900  -1.900
  403    H    SER  52           HN       SER  52  16.917   2.503  -3.097
  404    HA   SER  52           HA       SER  52  19.454   1.479  -3.986
  405    HB2  SER  52           HB2      SER  52  17.668   2.941  -5.946
  406    HB3  SER  52           HB1      SER  52  19.368   2.563  -6.216
  407    HG   SER  52           HG       SER  52  17.517   1.066  -6.968
  408    H    THR  53           HN       THR  53  17.441   3.887  -2.780
  409    HA   THR  53           HA       THR  53  19.199   6.126  -3.229
  410    HB   THR  53           HB       THR  53  17.678   7.389  -1.806
  411    HG1  THR  53           HG1      THR  53  15.718   5.867  -1.215
  412   HG21  THR  53          HG21      THR  53  16.180   5.555  -3.680
  413   HG22  THR  53          HG22      THR  53  17.029   7.030  -4.141
  414   HG23  THR  53          HG23      THR  53  15.614   7.118  -3.091
  415    H    GLU  54           HN       GLU  54  18.307   4.102  -0.447
  416    HA   GLU  54           HA       GLU  54  19.177   3.902   1.638
  417    HB2  GLU  54           HB2      GLU  54  21.903   4.260   0.509
  418    HB3  GLU  54           HB1      GLU  54  21.287   3.040   1.606
  419    HG2  GLU  54           HG2      GLU  54  20.134   1.935  -0.220
  420    HG3  GLU  54           HG1      GLU  54  20.709   3.170  -1.339
  421    H    ALA  55           HN       ALA  55  18.287   6.135   2.012
  422    HA   ALA  55           HA       ALA  55  20.269   7.697   3.369
  423    HB1  ALA  55           HB1      ALA  55  19.966   9.770   2.160
  424    HB2  ALA  55           HB2      ALA  55  18.846   8.987   1.044
  425    HB3  ALA  55           HB3      ALA  55  20.547   8.519   1.062
  Start of MODEL    9
    1    H1   ALA 106           HT1      ALA 106  -8.679  -3.309  14.471
    2    H2   ALA 106           HT2      ALA 106  -7.832  -2.670  15.787
    3    H3   ALA 106           HT3      ALA 106  -7.045  -2.903  14.309
    4    HA   ALA 106           HA       ALA 106  -9.265  -1.006  14.804
    5    HB1  ALA 106           HB1      ALA 106  -7.566   0.737  14.474
    6    HB2  ALA 106           HB2      ALA 106  -6.322  -0.510  14.366
    7    HB3  ALA 106           HB3      ALA 106  -7.211  -0.278  15.873
    8    H    ALA 107           HN       ALA 107  -6.594  -1.725  12.550
    9    HA   ALA 107           HA       ALA 107  -8.458  -1.683  10.317
   10    HB1  ALA 107           HB1      ALA 107  -7.795   0.668  10.578
   11    HB2  ALA 107           HB2      ALA 107  -7.213  -0.020   9.061
   12    HB3  ALA 107           HB3      ALA 107  -6.103   0.199  10.413
   13    H    ALA 108           HN       ALA 108  -6.950  -1.876   8.199
   14    HA   ALA 108           HA       ALA 108  -5.651  -3.274   6.968
   15    HB1  ALA 108           HB1      ALA 108  -3.950  -3.108   9.445
   16    HB2  ALA 108           HB2      ALA 108  -3.781  -2.187   7.951
   17    HB3  ALA 108           HB3      ALA 108  -3.441  -3.916   7.962
   18    H    THR 109           HN       THR 109  -4.296  -5.493   7.288
   19    HA   THR 109           HA       THR 109  -5.471  -7.371   9.091
   20    HB   THR 109           HB       THR 109  -7.343  -7.448   7.677
   21    HG1  THR 109           HG1      THR 109  -5.950  -9.521   7.940
   22   HG21  THR 109          HG21      THR 109  -6.111  -6.120   5.845
   23   HG22  THR 109          HG22      THR 109  -7.349  -7.276   5.340
   24   HG23  THR 109          HG23      THR 109  -5.642  -7.704   5.214
   25    H    ASN 110           HN       ASN 110  -3.985  -7.119   5.922
   26    HA   ASN 110           HA       ASN 110  -1.557  -8.377   6.800
   27    HB2  ASN 110           HB2      ASN 110  -3.588  -9.893   5.285
   28    HB3  ASN 110           HB1      ASN 110  -1.973  -9.939   4.591
   29   HD21  ASN 110          HD21      ASN 110  -0.315 -10.903   5.711
   30   HD22  ASN 110          HD22      ASN 110  -0.604 -11.953   7.050
   31    HA   PRO 111           HA       PRO 111  -1.190  -4.962   3.722
   32    HB2  PRO 111           HB2      PRO 111   1.383  -4.388   4.522
   33    HB3  PRO 111           HB1      PRO 111  -0.071  -3.659   5.196
   34    HG2  PRO 111           HG2      PRO 111   1.534  -5.959   6.242
   35    HG3  PRO 111           HG1      PRO 111   0.850  -4.578   7.124
   36    HD2  PRO 111           HD2      PRO 111  -0.369  -6.944   7.172
   37    HD3  PRO 111           HD1      PRO 111  -1.319  -5.447   7.042
   38    H    ALA 112           HN       ALA 112  -1.266  -6.401   2.074
   39    HA   ALA 112           HA       ALA 112   0.650  -6.691   0.250
   40    HB1  ALA 112           HB1      ALA 112   0.838  -9.093   2.084
   41    HB2  ALA 112           HB2      ALA 112   2.094  -7.887   1.818
   42    HB3  ALA 112           HB3      ALA 112   1.605  -8.952   0.502
   43    H    ARG 113           HN       ARG 113  -1.203  -9.158   1.955
   44    HA   ARG 113           HA       ARG 113  -2.635 -10.005  -0.394
   45    HB2  ARG 113           HB2      ARG 113  -2.533 -10.733   2.492
   46    HB3  ARG 113           HB1      ARG 113  -4.008 -11.127   1.627
   47    HG2  ARG 113           HG2      ARG 113  -2.593 -13.042   1.584
   48    HG3  ARG 113           HG1      ARG 113  -2.627 -12.356  -0.043
   49    HD2  ARG 113           HD2      ARG 113  -0.484 -11.256   0.374
   50    HD3  ARG 113           HD1      ARG 113  -0.451 -11.932   2.002
   51    HE   ARG 113           HE       ARG 113  -0.693 -13.908  -0.074
   52   HH11  ARG 113          HH11      ARG 113   1.524 -11.991   1.815
   53   HH12  ARG 113          HH12      ARG 113   2.850 -13.083   1.601
   54   HH21  ARG 113          HH21      ARG 113   1.048 -15.349  -0.360
   55   HH22  ARG 113          HH22      ARG 113   2.580 -14.993   0.367
   56    H    TYR 114           HN       TYR 114  -2.847  -7.675   1.997
   57    HA   TYR 114           HA       TYR 114  -5.650  -7.220   2.125
   58    HB2  TYR 114           HB2      TYR 114  -4.500  -6.540   4.006
   59    HB3  TYR 114           HB1      TYR 114  -3.142  -5.924   3.088
   60    HD1  TYR 114           HD1      TYR 114  -6.575  -4.835   2.286
   61    HD2  TYR 114           HD2      TYR 114  -3.001  -3.972   4.438
   62    HE1  TYR 114           HE1      TYR 114  -7.360  -2.540   2.657
   63    HE2  TYR 114           HE2      TYR 114  -3.788  -1.685   4.829
   64    HH   TYR 114           HH       TYR 114  -6.974  -0.700   4.281
   65    H    CYS 115           HN       CYS 115  -2.988  -5.351   0.610
   66    HA   CYS 115           HA       CYS 115  -4.841  -3.673  -0.779
   67    HB2  CYS 115           HB2      CYS 115  -1.960  -3.967  -1.579
   68    HB3  CYS 115           HB1      CYS 115  -2.998  -2.548  -1.659
   69    H    CYS 116           HN       CYS 116  -3.403  -6.733  -1.413
   70    HA   CYS 116           HA       CYS 116  -3.523  -6.643  -4.246
   71    HB2  CYS 116           HB2      CYS 116  -2.137  -8.296  -3.100
   72    HB3  CYS 116           HB1      CYS 116  -3.553  -9.007  -2.352
   73    H    LEU 117           HN       LEU 117  -5.713  -7.958  -1.776
   74    HA   LEU 117           HA       LEU 117  -7.695  -8.703  -3.716
   75    HB2  LEU 117           HB2      LEU 117  -7.370  -8.892  -0.780
   76    HB3  LEU 117           HB1      LEU 117  -8.987  -8.997  -1.431
   77    HG   LEU 117           HG       LEU 117  -6.754 -10.772  -2.387
   78   HD11  LEU 117          HD11      LEU 117  -7.666 -12.494  -0.887
   79   HD12  LEU 117          HD12      LEU 117  -8.729 -11.285  -0.169
   80   HD13  LEU 117          HD13      LEU 117  -6.981 -11.130  -0.003
   81   HD21  LEU 117          HD21      LEU 117  -9.755 -11.044  -2.497
   82   HD22  LEU 117          HD22      LEU 117  -8.579 -12.181  -3.156
   83   HD23  LEU 117          HD23      LEU 117  -8.719 -10.560  -3.839
   84    H    SER 118           HN       SER 118  -6.964  -5.855  -1.956
   85    HA   SER 118           HA       SER 118  -9.575  -4.748  -2.737
   86    HB2  SER 118           HB2      SER 118  -9.606  -5.181  -0.316
   87    HB3  SER 118           HB1      SER 118  -8.157  -4.195  -0.123
   88    HG   SER 118           HG       SER 118 -10.090  -2.866  -1.478
   89    H    GLY 119           HN       GLY 119  -6.347  -3.788  -1.529
   90    HA2  GLY 119           HA2      GLY 119  -4.967  -2.425  -3.030
   91    HA3  GLY 119           HA1      GLY 119  -6.437  -1.557  -3.468
   92    H    CYS 120           HN       CYS 120  -3.895  -0.523  -2.321
   93    HA   CYS 120           HA       CYS 120  -5.061   0.667   0.086
   94    HB2  CYS 120           HB2      CYS 120  -2.181  -0.125  -0.254
   95    HB3  CYS 120           HB1      CYS 120  -2.827   0.771   1.111
   96    H    THR 121           HN       THR 121  -4.669   2.789   0.537
   97    HA   THR 121           HA       THR 121  -3.977   4.441  -1.749
   98    HB   THR 121           HB       THR 121  -4.645   6.334  -0.307
   99    HG1  THR 121           HG1      THR 121  -5.486   5.873   1.768
  100   HG21  THR 121          HG21      THR 121  -6.246   4.519  -1.482
  101   HG22  THR 121          HG22      THR 121  -6.806   6.029  -0.778
  102   HG23  THR 121          HG23      THR 121  -6.897   4.531   0.151
  103    H    GLN 122           HN       GLN 122  -2.597   6.358  -1.410
  104    HA   GLN 122           HA       GLN 122  -0.037   5.651  -0.461
  105    HB2  GLN 122           HB2      GLN 122  -1.352   8.167  -1.414
  106    HB3  GLN 122           HB1      GLN 122   0.176   8.300  -0.564
  107    HG2  GLN 122           HG2      GLN 122   1.310   7.025  -2.187
  108    HG3  GLN 122           HG1      GLN 122  -0.196   6.485  -2.920
  109   HE21  GLN 122          HE21      GLN 122   0.359   9.771  -1.890
  110   HE22  GLN 122          HE22      GLN 122   0.414  10.469  -3.468
  111    H    GLN 123           HN       GLN 123  -2.778   6.237   1.264
  112    HA   GLN 123           HA       GLN 123  -1.440   7.535   3.481
  113    HB2  GLN 123           HB2      GLN 123  -4.244   6.603   2.965
  114    HB3  GLN 123           HB1      GLN 123  -3.712   7.001   4.586
  115    HG2  GLN 123           HG2      GLN 123  -3.131   9.261   3.825
  116    HG3  GLN 123           HG1      GLN 123  -3.722   8.851   2.215
  117   HE21  GLN 123          HE21      GLN 123  -4.611  10.906   4.105
  118   HE22  GLN 123          HE22      GLN 123  -6.292  10.611   4.369
  119    H    ASP 124           HN       ASP 124  -3.124   4.447   2.806
  120    HA   ASP 124           HA       ASP 124  -2.358   3.175   5.194
  121    HB2  ASP 124           HB2      ASP 124  -3.651   2.409   2.754
  122    HB3  ASP 124           HB1      ASP 124  -2.389   1.232   3.100
  123    H    LEU 125           HN       LEU 125  -0.874   3.168   1.986
  124    HA   LEU 125           HA       LEU 125   1.352   1.615   2.647
  125    HB2  LEU 125           HB2      LEU 125   0.968   3.683   0.480
  126    HB3  LEU 125           HB1      LEU 125   2.356   2.650   0.585
  127    HG   LEU 125           HG       LEU 125   0.068   0.984   0.717
  128   HD11  LEU 125          HD11      LEU 125  -1.472   2.054  -0.480
  129   HD12  LEU 125          HD12      LEU 125  -0.386   1.909  -1.864
  130   HD13  LEU 125          HD13      LEU 125  -0.354   3.363  -0.867
  131   HD21  LEU 125          HD21      LEU 125   2.351   0.523  -0.205
  132   HD22  LEU 125          HD22      LEU 125   1.888   1.477  -1.619
  133   HD23  LEU 125          HD23      LEU 125   1.014  -0.008  -1.225
  134    H    LEU 126           HN       LEU 126   0.696   5.058   3.060
  135    HA   LEU 126           HA       LEU 126   3.326   5.874   3.654
  136    HB2  LEU 126           HB2      LEU 126   0.620   6.952   3.950
  137    HB3  LEU 126           HB1      LEU 126   1.706   7.474   5.220
  138    HG   LEU 126           HG       LEU 126   2.132   7.838   2.262
  139   HD11  LEU 126          HD11      LEU 126   1.478   9.825   4.433
  140   HD12  LEU 126          HD12      LEU 126   0.392   9.283   3.154
  141   HD13  LEU 126          HD13      LEU 126   1.831  10.218   2.750
  142   HD21  LEU 126          HD21      LEU 126   4.068   9.201   2.907
  143   HD22  LEU 126          HD22      LEU 126   4.254   7.525   3.424
  144   HD23  LEU 126          HD23      LEU 126   3.808   8.764   4.596
  145    H    THR 127           HN       THR 127   0.888   4.202   5.477
  146    HA   THR 127           HA       THR 127   2.390   4.515   7.960
  147    HB   THR 127           HB       THR 127   0.513   3.998   9.122
  148    HG1  THR 127           HG1      THR 127  -1.016   2.417   8.366
  149   HG21  THR 127          HG21      THR 127  -0.089   5.694   7.230
  150   HG22  THR 127          HG22      THR 127  -1.363   5.013   8.236
  151   HG23  THR 127          HG23      THR 127  -1.079   4.369   6.621
  152    H    LEU 128           HN       LEU 128   2.428   2.417   5.331
  153    HA   LEU 128           HA       LEU 128   2.974   0.077   6.991
  154    HB2  LEU 128           HB2      LEU 128   2.680   0.358   4.012
  155    HB3  LEU 128           HB1      LEU 128   2.985  -1.140   4.850
  156    HG   LEU 128           HG       LEU 128   0.567   0.542   5.436
  157   HD11  LEU 128          HD11      LEU 128  -0.136  -1.740   3.938
  158   HD12  LEU 128          HD12      LEU 128   1.126  -0.892   3.047
  159   HD13  LEU 128          HD13      LEU 128  -0.347  -0.043   3.506
  160   HD21  LEU 128          HD21      LEU 128   0.894  -0.977   7.156
  161   HD22  LEU 128          HD22      LEU 128   1.486  -2.217   6.055
  162   HD23  LEU 128          HD23      LEU 128  -0.230  -1.815   6.082
  163    H    CYS 129           HN       CYS 129   4.602   2.553   5.259
  164    HA   CYS 129           HA       CYS 129   6.993   1.146   4.675
  165    HB2  CYS 129           HB2      CYS 129   8.027   3.326   4.373
  166    HB3  CYS 129           HB1      CYS 129   6.440   3.300   3.621
  167    HA   PRO 130           HA       PRO 130   8.835   1.057   8.693
  168    HB2  PRO 130           HB2      PRO 130  11.452   0.643   7.657
  169    HB3  PRO 130           HB1      PRO 130  10.291  -0.587   8.154
  170    HG2  PRO 130           HG2      PRO 130  11.162  -0.169   5.550
  171    HG3  PRO 130           HG1      PRO 130   9.687  -1.037   6.009
  172    HD2  PRO 130           HD2      PRO 130  10.018   1.791   5.087
  173    HD3  PRO 130           HD1      PRO 130   8.726   0.627   4.709
  174    H    TYR 131           HN       TYR 131   9.559   3.455   6.454
  175    HA   TYR 131           HA       TYR 131  10.751   5.120   8.521
  176    HB2  TYR 131           HB2      TYR 131  12.098   4.552   5.876
  177    HB3  TYR 131           HB1      TYR 131  12.525   5.912   6.907
  178    HD1  TYR 131           HD1      TYR 131  13.486   5.475   9.177
  179    HD2  TYR 131           HD2      TYR 131  12.891   2.363   6.338
  180    HE1  TYR 131           HE1      TYR 131  15.032   4.035  10.439
  181    HE2  TYR 131           HE2      TYR 131  14.433   0.915   7.591
  182    HH   TYR 131           HH       TYR 131  16.283   1.135   9.185
  183    H2   PRO  25           HT1      PRO  25 -11.741  15.061  -9.859
  184    H3   PRO  25           HT2      PRO  25 -11.862  16.209  -8.706
  185    HA   PRO  25           HA       PRO  25 -13.762  15.557  -7.983
  186    HB2  PRO  25           HB2      PRO  25 -15.132  14.330 -10.154
  187    HB3  PRO  25           HB1      PRO  25 -15.503  15.870  -9.366
  188    HG2  PRO  25           HG2      PRO  25 -13.936  15.336 -11.824
  189    HG3  PRO  25           HG1      PRO  25 -14.893  16.761 -11.385
  190    HD2  PRO  25           HD2      PRO  25 -12.227  16.853 -11.359
  191    HD3  PRO  25           HD1      PRO  25 -13.171  17.676 -10.104
  192    H    THR  26           HN       THR  26 -11.651  14.061  -7.619
  193    HA   THR  26           HA       THR  26 -12.686  11.409  -7.435
  194    HB   THR  26           HB       THR  26 -12.010  11.155  -9.705
  195    HG1  THR  26           HG1      THR  26 -11.358   9.329  -8.751
  196   HG21  THR  26          HG21      THR  26  -9.323  12.276  -8.899
  197   HG22  THR  26          HG22      THR  26 -10.541  13.115  -9.859
  198   HG23  THR  26          HG23      THR  26  -9.755  11.671 -10.498
  199    HA   PRO  27           HA       PRO  27  -9.580  11.539  -4.237
  200    HB2  PRO  27           HB2      PRO  27 -10.216   9.263  -3.004
  201    HB3  PRO  27           HB1      PRO  27 -11.339  10.627  -3.031
  202    HG2  PRO  27           HG2      PRO  27 -11.432   8.075  -4.537
  203    HG3  PRO  27           HG1      PRO  27 -12.761   9.114  -3.999
  204    HD2  PRO  27           HD2      PRO  27 -11.569   9.009  -6.589
  205    HD3  PRO  27           HD1      PRO  27 -12.830  10.122  -6.024
  206    H    GLU  28           HN       GLU  28  -8.449   9.210  -3.132
  207    HA   GLU  28           HA       GLU  28  -6.403   8.685  -5.034
  208    HB2  GLU  28           HB2      GLU  28  -6.815   7.447  -2.321
  209    HB3  GLU  28           HB1      GLU  28  -5.329   7.492  -3.239
  210    HG2  GLU  28           HG2      GLU  28  -6.740   9.851  -2.039
  211    HG3  GLU  28           HG1      GLU  28  -5.258   9.103  -1.446
  212    H    MET  29           HN       MET  29  -9.297   7.402  -4.287
  213    HA   MET  29           HA       MET  29 -10.373   5.386  -4.522
  214    HB2  MET  29           HB2      MET  29 -10.383   6.608  -6.683
  215    HB3  MET  29           HB1      MET  29  -8.975   5.675  -7.153
  216    HG2  MET  29           HG2      MET  29 -10.231   3.649  -7.167
  217    HG3  MET  29           HG1      MET  29 -11.625   4.448  -6.445
  218    HE1  MET  29           HE1      MET  29 -12.987   6.655  -9.309
  219    HE2  MET  29           HE2      MET  29 -11.904   7.152  -8.009
  220    HE3  MET  29           HE3      MET  29 -13.233   6.042  -7.674
  221    H    ARG  30           HN       ARG  30  -7.641   5.067  -3.469
  222    HA   ARG  30           HA       ARG  30  -6.088   3.482  -3.065
  223    HB2  ARG  30           HB2      ARG  30  -8.521   1.800  -3.533
  224    HB3  ARG  30           HB1      ARG  30  -7.056   1.265  -2.752
  225    HG2  ARG  30           HG2      ARG  30  -8.063   3.676  -1.564
  226    HG3  ARG  30           HG1      ARG  30  -9.247   2.385  -1.550
  227    HD2  ARG  30           HD2      ARG  30  -7.556   0.889  -0.541
  228    HD3  ARG  30           HD1      ARG  30  -6.452   2.258  -0.463
  229    HE   ARG  30           HE       ARG  30  -9.004   2.599   0.838
  230   HH11  ARG  30          HH11      ARG  30  -5.627   1.827   1.139
  231   HH12  ARG  30          HH12      ARG  30  -5.575   2.130   2.843
  232   HH21  ARG  30          HH21      ARG  30  -8.953   3.000   3.086
  233   HH22  ARG  30          HH22      ARG  30  -7.465   2.795   3.950
  234    H    GLU  31           HN       GLU  31  -5.984   0.807  -4.007
  235    HA   GLU  31           HA       GLU  31  -6.085   0.387  -6.742
  236    HB2  GLU  31           HB2      GLU  31  -4.497   2.213  -7.021
  237    HB3  GLU  31           HB1      GLU  31  -3.421   1.501  -5.825
  238    HG2  GLU  31           HG2      GLU  31  -2.527   1.038  -7.965
  239    HG3  GLU  31           HG1      GLU  31  -3.175  -0.469  -7.330
  240    H    LYS  32           HN       LYS  32  -5.735  -1.675  -7.109
  241    HA   LYS  32           HA       LYS  32  -5.232  -3.397  -4.952
  242    HB2  LYS  32           HB2      LYS  32  -5.191  -4.096  -7.871
  243    HB3  LYS  32           HB1      LYS  32  -5.577  -5.142  -6.517
  244    HG2  LYS  32           HG2      LYS  32  -7.502  -3.573  -6.032
  245    HG3  LYS  32           HG1      LYS  32  -7.193  -2.880  -7.615
  246    HD2  LYS  32           HD2      LYS  32  -7.763  -4.847  -8.734
  247    HD3  LYS  32           HD1      LYS  32  -7.560  -5.838  -7.290
  248    HE2  LYS  32           HE2      LYS  32  -9.530  -4.797  -6.312
  249    HE3  LYS  32           HE1      LYS  32  -9.734  -3.803  -7.750
  250    HZ1  LYS  32           HZ1      LYS  32 -10.030  -5.841  -9.043
  251    HZ2  LYS  32           HZ2      LYS  32 -11.194  -5.708  -7.825
  252    HZ3  LYS  32           HZ3      LYS  32  -9.889  -6.767  -7.635
  253    H    LEU  33           HN       LEU  33  -3.330  -3.358  -4.041
  254    HA   LEU  33           HA       LEU  33  -0.878  -3.572  -5.619
  255    HB2  LEU  33           HB2      LEU  33  -0.899  -3.140  -2.700
  256    HB3  LEU  33           HB1      LEU  33   0.209  -2.600  -3.934
  257    HG   LEU  33           HG       LEU  33  -2.556  -1.532  -3.660
  258   HD11  LEU  33          HD11      LEU  33  -1.867   0.120  -2.273
  259   HD12  LEU  33          HD12      LEU  33  -0.223   0.119  -2.906
  260   HD13  LEU  33          HD13      LEU  33  -0.729  -1.126  -1.764
  261   HD21  LEU  33          HD21      LEU  33  -2.085  -0.193  -5.420
  262   HD22  LEU  33          HD22      LEU  33  -0.945  -1.495  -5.805
  263   HD23  LEU  33          HD23      LEU  33  -0.384  -0.036  -4.975
  264    H    CYS  34           HN       CYS  34  -0.611  -5.677  -6.080
  265    HA   CYS  34           HA       CYS  34  -0.820  -7.614  -3.899
  266    HB2  CYS  34           HB2      CYS  34  -1.833  -7.837  -6.312
  267    HB3  CYS  34           HB1      CYS  34  -0.231  -8.448  -6.695
  268    H    GLY  35           HN       GLY  35   0.995  -7.262  -2.787
  269    HA2  GLY  35           HA2      GLY  35   3.186  -7.534  -2.173
  270    HA3  GLY  35           HA1      GLY  35   3.329  -8.629  -3.530
  271    H    HIS  36           HN       HIS  36   3.849  -7.669  -5.668
  272    HA   HIS  36           HA       HIS  36   5.905  -5.783  -5.445
  273    HB2  HIS  36           HB2      HIS  36   5.447  -7.587  -7.293
  274    HB3  HIS  36           HB1      HIS  36   4.591  -6.262  -8.082
  275    HD1  HIS  36           HD1      HIS  36   6.512  -6.331  -9.941
  276    HD2  HIS  36           HD2      HIS  36   7.705  -5.221  -6.110
  277    HE1  HIS  36           HE1      HIS  36   8.788  -5.267 -10.192
  278    H    HIS  37           HN       HIS  37   2.674  -5.403  -7.018
  279    HA   HIS  37           HA       HIS  37   2.873  -2.666  -7.516
  280    HB2  HIS  37           HB2      HIS  37   0.550  -4.432  -6.812
  281    HB3  HIS  37           HB1      HIS  37   0.322  -2.688  -6.891
  282    HD1  HIS  37           HD1      HIS  37  -0.865  -2.293  -9.041
  283    HD2  HIS  37           HD2      HIS  37   2.242  -5.009  -9.389
  284    HE1  HIS  37           HE1      HIS  37  -0.708  -2.853 -11.491
  285    H    PHE  38           HN       PHE  38   2.113  -4.496  -4.707
  286    HA   PHE  38           HA       PHE  38   1.459  -2.372  -2.981
  287    HB2  PHE  38           HB2      PHE  38   0.712  -4.597  -2.503
  288    HB3  PHE  38           HB1      PHE  38   2.356  -5.210  -2.509
  289    HD1  PHE  38           HD2      PHE  38   0.651  -2.344  -0.952
  290    HD2  PHE  38           HD1      PHE  38   3.007  -5.846  -0.382
  291    HE1  PHE  38           HE2      PHE  38   0.796  -1.847   1.453
  292    HE2  PHE  38           HE1      PHE  38   3.164  -5.353   2.029
  293    HZ   PHE  38           HZ       PHE  38   2.062  -3.343   2.949
  294    H    VAL  39           HN       VAL  39   4.388  -3.812  -4.043
  295    HA   VAL  39           HA       VAL  39   6.046  -2.620  -2.057
  296    HB   VAL  39           HB       VAL  39   6.432  -4.268  -4.476
  297   HG11  VAL  39          HG11      VAL  39   8.045  -3.050  -5.409
  298   HG12  VAL  39          HG12      VAL  39   9.025  -3.502  -4.015
  299   HG13  VAL  39          HG13      VAL  39   8.157  -1.974  -4.018
  300   HG21  VAL  39          HG21      VAL  39   6.673  -4.661  -1.816
  301   HG22  VAL  39          HG22      VAL  39   8.353  -4.356  -2.265
  302   HG23  VAL  39          HG23      VAL  39   7.454  -5.658  -3.043
  303    H    ARG  40           HN       ARG  40   5.869  -1.998  -5.592
  304    HA   ARG  40           HA       ARG  40   7.191   0.377  -5.685
  305    HB2  ARG  40           HB2      ARG  40   4.722  -0.409  -7.243
  306    HB3  ARG  40           HB1      ARG  40   5.775   0.938  -7.655
  307    HG2  ARG  40           HG2      ARG  40   6.873  -0.508  -8.925
  308    HG3  ARG  40           HG1      ARG  40   7.521  -1.174  -7.436
  309    HD2  ARG  40           HD2      ARG  40   6.068  -2.939  -7.450
  310    HD3  ARG  40           HD1      ARG  40   4.874  -2.103  -8.436
  311    HE   ARG  40           HE       ARG  40   7.438  -2.938  -9.601
  312   HH11  ARG  40          HH11      ARG  40   3.959  -3.098  -9.499
  313   HH12  ARG  40          HH12      ARG  40   3.827  -3.961 -10.995
  314   HH21  ARG  40          HH21      ARG  40   7.273  -4.071 -11.572
  315   HH22  ARG  40          HH22      ARG  40   5.710  -4.513 -12.172
  316    H    ALA  41           HN       ALA  41   3.590   0.123  -5.262
  317    HA   ALA  41           HA       ALA  41   3.209   2.852  -4.890
  318    HB1  ALA  41           HB1      ALA  41   1.124   2.306  -3.830
  319    HB2  ALA  41           HB2      ALA  41   1.665   0.676  -3.424
  320    HB3  ALA  41           HB3      ALA  41   1.392   1.124  -5.109
  321    H    LEU  42           HN       LEU  42   3.894   0.329  -2.400
  322    HA   LEU  42           HA       LEU  42   3.874   1.816  -0.119
  323    HB2  LEU  42           HB2      LEU  42   4.860  -0.647  -0.836
  324    HB3  LEU  42           HB1      LEU  42   6.313   0.197  -0.366
  325    HG   LEU  42           HG       LEU  42   3.880  -0.273   1.352
  326   HD11  LEU  42          HD11      LEU  42   5.031  -2.271   1.368
  327   HD12  LEU  42          HD12      LEU  42   5.770  -1.421   2.725
  328   HD13  LEU  42          HD13      LEU  42   6.600  -1.491   1.173
  329   HD21  LEU  42          HD21      LEU  42   4.533   1.651   2.314
  330   HD22  LEU  42          HD22      LEU  42   6.126   1.590   1.565
  331   HD23  LEU  42          HD23      LEU  42   5.802   0.646   3.019
  332    H    VAL  43           HN       VAL  43   6.339   1.782  -2.595
  333    HA   VAL  43           HA       VAL  43   8.127   3.581  -1.261
  334    HB   VAL  43           HB       VAL  43   8.289   3.281  -4.225
  335   HG11  VAL  43          HG11      VAL  43  10.565   3.363  -3.863
  336   HG12  VAL  43          HG12      VAL  43  10.430   2.606  -2.272
  337   HG13  VAL  43          HG13      VAL  43   9.984   4.306  -2.486
  338   HG21  VAL  43          HG21      VAL  43   7.563   1.085  -3.688
  339   HG22  VAL  43          HG22      VAL  43   8.671   1.014  -2.314
  340   HG23  VAL  43          HG23      VAL  43   9.303   1.035  -3.961
  341    H    ARG  44           HN       ARG  44   6.401   3.874  -4.324
  342    HA   ARG  44           HA       ARG  44   6.468   6.448  -4.998
  343    HB2  ARG  44           HB2      ARG  44   3.842   4.972  -4.717
  344    HB3  ARG  44           HB1      ARG  44   4.223   6.205  -5.894
  345    HG2  ARG  44           HG2      ARG  44   6.135   4.287  -6.358
  346    HG3  ARG  44           HG1      ARG  44   4.686   3.358  -5.970
  347    HD2  ARG  44           HD2      ARG  44   3.515   4.976  -7.610
  348    HD3  ARG  44           HD1      ARG  44   5.147   5.304  -8.180
  349    HE   ARG  44           HE       ARG  44   4.274   2.521  -8.067
  350   HH11  ARG  44          HH11      ARG  44   5.010   5.350  -9.963
  351   HH12  ARG  44          HH12      ARG  44   5.121   4.480 -11.455
  352   HH21  ARG  44          HH21      ARG  44   4.417   1.365 -10.030
  353   HH22  ARG  44          HH22      ARG  44   4.783   2.216 -11.495
  354    H    VAL  45           HN       VAL  45   4.613   5.073  -2.451
  355    HA   VAL  45           HA       VAL  45   3.238   7.376  -1.540
  356    HB   VAL  45           HB       VAL  45   3.794   4.742  -0.186
  357   HG11  VAL  45          HG11      VAL  45   2.084   7.051   0.494
  358   HG12  VAL  45          HG12      VAL  45   2.998   5.954   1.527
  359   HG13  VAL  45          HG13      VAL  45   1.470   5.431   0.827
  360   HG21  VAL  45          HG21      VAL  45   1.137   5.000  -1.218
  361   HG22  VAL  45          HG22      VAL  45   2.348   3.759  -1.514
  362   HG23  VAL  45          HG23      VAL  45   2.321   5.216  -2.506
  363    H    CYS  46           HN       CYS  46   5.673   5.322   0.014
  364    HA   CYS  46           HA       CYS  46   6.549   7.621   1.649
  365    HB2  CYS  46           HB2      CYS  46   5.201   5.732   2.739
  366    HB3  CYS  46           HB1      CYS  46   6.609   4.725   2.471
  367    H    GLY  47           HN       GLY  47   7.525   4.357   0.706
  368    HA2  GLY  47           HA2      GLY  47   9.723   4.627  -0.746
  369    HA3  GLY  47           HA1      GLY  47  10.350   5.154   0.809
  370    H    GLY  48           HN       GLY  48  10.917   3.661   2.310
  371    HA2  GLY  48           HA2      GLY  48  10.179   1.308   3.083
  372    HA3  GLY  48           HA1      GLY  48  10.690   0.863   1.467
  373    HA   PRO  49           HA       PRO  49  14.456   0.084   3.845
  374    HB2  PRO  49           HB2      PRO  49  15.639  -1.468   1.975
  375    HB3  PRO  49           HB1      PRO  49  14.377  -2.059   3.056
  376    HG2  PRO  49           HG2      PRO  49  14.138  -1.141   0.228
  377    HG3  PRO  49           HG1      PRO  49  13.430  -2.570   1.006
  378    HD2  PRO  49           HD2      PRO  49  12.041  -0.306   0.605
  379    HD3  PRO  49           HD1      PRO  49  11.729  -1.341   1.982
  380    H    ARG  50           HN       ARG  50  15.080   0.268   0.357
  381    HA   ARG  50           HA       ARG  50  16.495   2.784   0.615
  382    HB2  ARG  50           HB2      ARG  50  17.841   0.199  -0.044
  383    HB3  ARG  50           HB1      ARG  50  18.544   1.755  -0.424
  384    HG2  ARG  50           HG2      ARG  50  19.547   1.584   1.557
  385    HG3  ARG  50           HG1      ARG  50  17.979   2.017   2.234
  386    HD2  ARG  50           HD2      ARG  50  18.905   0.028   3.318
  387    HD3  ARG  50           HD1      ARG  50  17.408  -0.338   2.462
  388    HE   ARG  50           HE       ARG  50  19.636  -0.832   0.794
  389   HH11  ARG  50          HH11      ARG  50  17.942  -2.127   3.550
  390   HH12  ARG  50          HH12      ARG  50  18.424  -3.762   3.239
  391   HH21  ARG  50          HH21      ARG  50  20.272  -2.981   0.377
  392   HH22  ARG  50          HH22      ARG  50  19.746  -4.246   1.436
  393    H    TRP  51           HN       TRP  51  15.849  -0.044  -1.402
  394    HA   TRP  51           HA       TRP  51  15.258  -0.330  -3.547
  395    HB2  TRP  51           HB2      TRP  51  14.531   2.576  -3.578
  396    HB3  TRP  51           HB1      TRP  51  13.865   1.262  -4.524
  397    HD1  TRP  51           HD1      TRP  51  13.823   2.613  -0.940
  398    HE1  TRP  51           HE1      TRP  51  11.740   1.658   0.227
  399    HE3  TRP  51           HE3      TRP  51  12.354  -0.556  -4.557
  400    HZ2  TRP  51           HZ2      TRP  51   9.727  -0.274  -0.357
  401    HZ3  TRP  51           HZ3      TRP  51  10.367  -1.943  -4.200
  402    HH2  TRP  51           HH2      TRP  51   9.061  -1.762  -2.120
  403    H    SER  52           HN       SER  52  17.812   1.551  -2.674
  404    HA   SER  52           HA       SER  52  19.669   2.346  -3.699
  405    HB2  SER  52           HB2      SER  52  18.713   0.445  -5.839
  406    HB3  SER  52           HB1      SER  52  20.284   1.243  -5.866
  407    HG   SER  52           HG       SER  52  20.349   0.247  -3.579
  408    H    THR  53           HN       THR  53  20.496   3.456  -5.771
  409    HA   THR  53           HA       THR  53  18.475   4.774  -7.368
  410    HB   THR  53           HB       THR  53  19.367   7.071  -6.754
  411    HG1  THR  53           HG1      THR  53  21.198   6.270  -5.556
  412   HG21  THR  53          HG21      THR  53  17.840   5.546  -4.642
  413   HG22  THR  53          HG22      THR  53  17.150   6.357  -6.050
  414   HG23  THR  53          HG23      THR  53  17.922   7.303  -4.777
  415    H    GLU  54           HN       GLU  54  21.879   4.794  -6.344
  416    HA   GLU  54           HA       GLU  54  22.770   5.760  -8.915
  417    HB2  GLU  54           HB2      GLU  54  24.334   4.763  -6.530
  418    HB3  GLU  54           HB1      GLU  54  25.031   5.527  -7.951
  419    HG2  GLU  54           HG2      GLU  54  23.792   7.577  -7.452
  420    HG3  GLU  54           HG1      GLU  54  23.116   6.809  -6.017
  421    H    ALA  55           HN       ALA  55  21.347   3.150  -8.709
  422    HA   ALA  55           HA       ALA  55  23.298   1.109  -9.213
  423    HB1  ALA  55           HB1      ALA  55  21.418  -0.335  -9.656
  424    HB2  ALA  55           HB2      ALA  55  20.334   1.052  -9.761
  425    HB3  ALA  55           HB3      ALA  55  21.084   0.635  -8.220
  Start of MODEL   10
    1    H1   ALA 106           HT1      ALA 106  -0.802  -0.315  16.994
    2    H2   ALA 106           HT2      ALA 106   0.314  -1.481  16.486
    3    H3   ALA 106           HT3      ALA 106  -1.330  -1.866  16.571
    4    HA   ALA 106           HA       ALA 106  -1.835  -0.309  14.820
    5    HB1  ALA 106           HB1      ALA 106  -0.047   1.288  15.320
    6    HB2  ALA 106           HB2      ALA 106  -0.049   0.824  13.618
    7    HB3  ALA 106           HB3      ALA 106   1.145   0.135  14.717
    8    H    ALA 107           HN       ALA 107  -0.375  -3.098  15.491
    9    HA   ALA 107           HA       ALA 107   0.524  -3.916  12.891
   10    HB1  ALA 107           HB1      ALA 107   1.466  -4.880  14.933
   11    HB2  ALA 107           HB2      ALA 107   0.771  -6.122  13.891
   12    HB3  ALA 107           HB3      ALA 107  -0.103  -5.583  15.325
   13    H    ALA 108           HN       ALA 108  -0.813  -4.283  11.259
   14    HA   ALA 108           HA       ALA 108  -3.536  -5.246  11.802
   15    HB1  ALA 108           HB1      ALA 108  -4.186  -3.846  10.200
   16    HB2  ALA 108           HB2      ALA 108  -3.097  -4.616   9.038
   17    HB3  ALA 108           HB3      ALA 108  -2.519  -3.286  10.051
   18    H    THR 109           HN       THR 109  -4.021  -6.244   9.209
   19    HA   THR 109           HA       THR 109  -2.942  -8.883   9.462
   20    HB   THR 109           HB       THR 109  -5.257  -8.393   8.633
   21    HG1  THR 109           HG1      THR 109  -4.204  -9.731   6.474
   22   HG21  THR 109          HG21      THR 109  -4.609  -6.444   7.211
   23   HG22  THR 109          HG22      THR 109  -5.616  -7.631   6.380
   24   HG23  THR 109          HG23      THR 109  -3.880  -7.579   6.073
   25    H    ASN 110           HN       ASN 110  -2.675  -9.422   6.611
   26    HA   ASN 110           HA       ASN 110   0.054  -8.511   6.263
   27    HB2  ASN 110           HB2      ASN 110  -1.657 -10.366   4.579
   28    HB3  ASN 110           HB1      ASN 110   0.048 -10.024   4.290
   29   HD21  ASN 110          HD21      ASN 110   0.693 -12.125   4.569
   30   HD22  ASN 110          HD22      ASN 110   0.698 -12.909   6.109
   31    HA   PRO 111           HA       PRO 111  -1.770  -5.063   3.916
   32    HB2  PRO 111           HB2      PRO 111   0.553  -3.678   3.637
   33    HB3  PRO 111           HB1      PRO 111  -0.450  -3.611   5.086
   34    HG2  PRO 111           HG2      PRO 111   1.985  -5.285   4.562
   35    HG3  PRO 111           HG1      PRO 111   1.589  -4.310   5.992
   36    HD2  PRO 111           HD2      PRO 111   1.204  -6.952   5.985
   37    HD3  PRO 111           HD1      PRO 111   0.041  -5.861   6.769
   38    H    ALA 112           HN       ALA 112   0.202  -7.553   2.982
   39    HA   ALA 112           HA       ALA 112   0.730  -6.497   0.310
   40    HB1  ALA 112           HB1      ALA 112   1.350  -9.270   1.301
   41    HB2  ALA 112           HB2      ALA 112   2.391  -7.886   1.626
   42    HB3  ALA 112           HB3      ALA 112   2.095  -8.390  -0.038
   43    H    ARG 113           HN       ARG 113  -0.918  -9.198   1.860
   44    HA   ARG 113           HA       ARG 113  -2.347  -9.974  -0.504
   45    HB2  ARG 113           HB2      ARG 113  -2.300 -10.800   2.368
   46    HB3  ARG 113           HB1      ARG 113  -3.628 -11.323   1.355
   47    HG2  ARG 113           HG2      ARG 113  -0.737 -11.798   0.683
   48    HG3  ARG 113           HG1      ARG 113  -1.739 -12.948   1.570
   49    HD2  ARG 113           HD2      ARG 113  -2.321 -11.897  -1.198
   50    HD3  ARG 113           HD1      ARG 113  -1.601 -13.466  -0.837
   51    HE   ARG 113           HE       ARG 113  -4.058 -13.166   0.534
   52   HH11  ARG 113          HH11      ARG 113  -2.750 -13.739  -2.646
   53   HH12  ARG 113          HH12      ARG 113  -4.140 -14.612  -3.199
   54   HH21  ARG 113          HH21      ARG 113  -5.888 -14.314  -0.187
   55   HH22  ARG 113          HH22      ARG 113  -5.923 -14.938  -1.801
   56    H    TYR 114           HN       TYR 114  -2.786  -7.819   2.112
   57    HA   TYR 114           HA       TYR 114  -5.616  -7.555   2.066
   58    HB2  TYR 114           HB2      TYR 114  -4.801  -6.864   4.075
   59    HB3  TYR 114           HB1      TYR 114  -3.306  -6.268   3.387
   60    HD1  TYR 114           HD1      TYR 114  -6.662  -5.102   2.319
   61    HD2  TYR 114           HD2      TYR 114  -3.197  -4.290   4.646
   62    HE1  TYR 114           HE1      TYR 114  -7.419  -2.800   2.635
   63    HE2  TYR 114           HE2      TYR 114  -3.929  -1.978   4.967
   64    HH   TYR 114           HH       TYR 114  -7.085  -0.940   4.224
   65    H    CYS 115           HN       CYS 115  -2.996  -5.512   0.717
   66    HA   CYS 115           HA       CYS 115  -4.891  -3.810  -0.600
   67    HB2  CYS 115           HB2      CYS 115  -1.982  -3.997  -1.355
   68    HB3  CYS 115           HB1      CYS 115  -3.064  -2.612  -1.454
   69    H    CYS 116           HN       CYS 116  -3.543  -6.853  -1.315
   70    HA   CYS 116           HA       CYS 116  -3.527  -6.635  -4.155
   71    HB2  CYS 116           HB2      CYS 116  -2.207  -8.364  -3.072
   72    HB3  CYS 116           HB1      CYS 116  -3.643  -9.059  -2.347
   73    H    LEU 117           HN       LEU 117  -5.794  -8.181  -1.877
   74    HA   LEU 117           HA       LEU 117  -7.705  -8.706  -3.950
   75    HB2  LEU 117           HB2      LEU 117  -7.471  -9.204  -1.052
   76    HB3  LEU 117           HB1      LEU 117  -9.083  -9.182  -1.725
   77    HG   LEU 117           HG       LEU 117  -6.848 -10.960  -2.704
   78   HD11  LEU 117          HD11      LEU 117  -7.530 -11.537  -0.426
   79   HD12  LEU 117          HD12      LEU 117  -8.023 -12.770  -1.586
   80   HD13  LEU 117          HD13      LEU 117  -9.210 -11.630  -0.954
   81   HD21  LEU 117          HD21      LEU 117  -8.514 -10.434  -4.414
   82   HD22  LEU 117          HD22      LEU 117  -9.802 -10.945  -3.323
   83   HD23  LEU 117          HD23      LEU 117  -8.626 -12.121  -3.912
   84    H    SER 118           HN       SER 118  -7.019  -6.010  -1.997
   85    HA   SER 118           HA       SER 118  -9.655  -4.882  -2.664
   86    HB2  SER 118           HB2      SER 118  -9.593  -5.388  -0.272
   87    HB3  SER 118           HB1      SER 118  -8.125  -4.428  -0.096
   88    HG   SER 118           HG       SER 118 -10.742  -3.621  -0.304
   89    H    GLY 119           HN       GLY 119  -6.385  -3.899  -1.569
   90    HA2  GLY 119           HA2      GLY 119  -5.078  -2.457  -3.045
   91    HA3  GLY 119           HA1      GLY 119  -6.578  -1.639  -3.471
   92    H    CYS 120           HN       CYS 120  -3.996  -0.641  -2.235
   93    HA   CYS 120           HA       CYS 120  -5.223   0.498   0.168
   94    HB2  CYS 120           HB2      CYS 120  -2.357  -0.271  -0.220
   95    HB3  CYS 120           HB1      CYS 120  -2.924   0.711   1.115
   96    H    THR 121           HN       THR 121  -5.049   2.545   0.658
   97    HA   THR 121           HA       THR 121  -4.497   4.391  -1.457
   98    HB   THR 121           HB       THR 121  -5.089   6.128   0.139
   99    HG1  THR 121           HG1      THR 121  -5.022   4.016   2.055
  100   HG21  THR 121          HG21      THR 121  -6.786   4.482  -0.875
  101   HG22  THR 121          HG22      THR 121  -7.320   5.610   0.365
  102   HG23  THR 121          HG23      THR 121  -6.992   3.925   0.779
  103    H    GLN 122           HN       GLN 122  -2.986   6.128  -1.297
  104    HA   GLN 122           HA       GLN 122  -0.398   5.323  -0.579
  105    HB2  GLN 122           HB2      GLN 122  -1.638   8.013  -1.175
  106    HB3  GLN 122           HB1      GLN 122   0.065   7.839  -0.791
  107    HG2  GLN 122           HG2      GLN 122   0.559   6.801  -2.759
  108    HG3  GLN 122           HG1      GLN 122  -1.053   6.109  -2.921
  109   HE21  GLN 122          HE21      GLN 122   0.867   9.013  -3.288
  110   HE22  GLN 122          HE22      GLN 122  -0.201   9.817  -4.382
  111    H    GLN 123           HN       GLN 123  -3.024   6.405   1.281
  112    HA   GLN 123           HA       GLN 123  -1.535   7.530   3.440
  113    HB2  GLN 123           HB2      GLN 123  -4.349   6.537   3.131
  114    HB3  GLN 123           HB1      GLN 123  -3.720   7.045   4.685
  115    HG2  GLN 123           HG2      GLN 123  -3.287   9.265   3.815
  116    HG3  GLN 123           HG1      GLN 123  -3.842   8.762   2.220
  117   HE21  GLN 123          HE21      GLN 123  -5.369   7.686   5.161
  118   HE22  GLN 123          HE22      GLN 123  -6.833   8.580   4.965
  119    H    ASP 124           HN       ASP 124  -3.201   4.417   2.874
  120    HA   ASP 124           HA       ASP 124  -2.404   3.102   5.190
  121    HB2  ASP 124           HB2      ASP 124  -3.726   2.318   2.886
  122    HB3  ASP 124           HB1      ASP 124  -2.215   1.428   2.773
  123    H    LEU 125           HN       LEU 125  -0.856   3.061   2.014
  124    HA   LEU 125           HA       LEU 125   1.472   1.732   2.684
  125    HB2  LEU 125           HB2      LEU 125   1.050   3.870   0.584
  126    HB3  LEU 125           HB1      LEU 125   2.396   2.778   0.635
  127    HG   LEU 125           HG       LEU 125  -0.042   1.267   0.717
  128   HD11  LEU 125          HD11      LEU 125  -1.382   2.388  -0.649
  129   HD12  LEU 125          HD12      LEU 125  -0.163   2.200  -1.911
  130   HD13  LEU 125          HD13      LEU 125  -0.162   3.639  -0.892
  131   HD21  LEU 125          HD21      LEU 125   2.323   0.681  -0.074
  132   HD22  LEU 125          HD22      LEU 125   1.851   1.486  -1.578
  133   HD23  LEU 125          HD23      LEU 125   0.954   0.073  -1.012
  134    H    LEU 126           HN       LEU 126   0.628   5.138   3.074
  135    HA   LEU 126           HA       LEU 126   3.173   6.144   3.692
  136    HB2  LEU 126           HB2      LEU 126   0.382   6.988   4.094
  137    HB3  LEU 126           HB1      LEU 126   1.500   7.620   5.284
  138    HG   LEU 126           HG       LEU 126   1.730   7.972   2.300
  139   HD11  LEU 126          HD11      LEU 126   0.934   9.900   4.474
  140   HD12  LEU 126          HD12      LEU 126  -0.113   9.246   3.215
  141   HD13  LEU 126          HD13      LEU 126   1.215  10.324   2.784
  142   HD21  LEU 126          HD21      LEU 126   3.916   7.903   3.375
  143   HD22  LEU 126          HD22      LEU 126   3.390   9.108   4.549
  144   HD23  LEU 126          HD23      LEU 126   3.533   9.540   2.845
  145    H    THR 127           HN       THR 127   0.816   4.384   5.565
  146    HA   THR 127           HA       THR 127   2.308   4.740   8.034
  147    HB   THR 127           HB       THR 127   0.479   3.994   9.179
  148    HG1  THR 127           HG1      THR 127  -0.647   2.231   8.621
  149   HG21  THR 127          HG21      THR 127  -0.198   5.815   7.470
  150   HG22  THR 127          HG22      THR 127  -1.470   4.938   8.316
  151   HG23  THR 127          HG23      THR 127  -1.058   4.508   6.658
  152    H    LEU 128           HN       LEU 128   2.403   2.614   5.396
  153    HA   LEU 128           HA       LEU 128   3.185   0.324   7.015
  154    HB2  LEU 128           HB2      LEU 128   3.029   0.557   4.022
  155    HB3  LEU 128           HB1      LEU 128   3.194  -0.907   4.954
  156    HG   LEU 128           HG       LEU 128   0.804   0.904   5.172
  157   HD11  LEU 128          HD11      LEU 128   0.950  -1.645   3.605
  158   HD12  LEU 128          HD12      LEU 128   1.136  -0.053   2.869
  159   HD13  LEU 128          HD13      LEU 128  -0.375  -0.482   3.673
  160   HD21  LEU 128          HD21      LEU 128   0.994  -0.457   7.079
  161   HD22  LEU 128          HD22      LEU 128   1.467  -1.846   6.107
  162   HD23  LEU 128          HD23      LEU 128  -0.189  -1.254   6.037
  163    H    CYS 129           HN       CYS 129   4.559   3.025   5.513
  164    HA   CYS 129           HA       CYS 129   7.164   1.850   5.056
  165    HB2  CYS 129           HB2      CYS 129   7.776   3.880   4.118
  166    HB3  CYS 129           HB1      CYS 129   6.046   3.873   3.829
  167    HA   PRO 130           HA       PRO 130   9.122   2.701   8.927
  168    HB2  PRO 130           HB2      PRO 130  11.124   4.564   7.853
  169    HB3  PRO 130           HB1      PRO 130  11.347   2.953   8.536
  170    HG2  PRO 130           HG2      PRO 130  11.662   3.430   5.910
  171    HG3  PRO 130           HG1      PRO 130  10.991   1.902   6.510
  172    HD2  PRO 130           HD2      PRO 130   9.560   4.286   5.385
  173    HD3  PRO 130           HD1      PRO 130   9.282   2.561   5.061
  174    H    TYR 131           HN       TYR 131  10.520   4.879   9.947
  175    HA   TYR 131           HA       TYR 131  10.185   6.780  11.134
  176    HB2  TYR 131           HB2      TYR 131   8.622   7.590   8.675
  177    HB3  TYR 131           HB1      TYR 131   9.203   8.679   9.927
  178    HD1  TYR 131           HD2      TYR 131  10.214   6.500   7.142
  179    HD2  TYR 131           HD1      TYR 131  11.498   9.370  10.007
  180    HE1  TYR 131           HE2      TYR 131  12.340   6.752   5.929
  181    HE2  TYR 131           HE1      TYR 131  13.626   9.633   8.801
  182    HH   TYR 131           HH       TYR 131  14.132   8.363   5.670
  183    H2   PRO  25           HT1      PRO  25  -4.073  17.790  -7.021
  184    H3   PRO  25           HT2      PRO  25  -2.566  18.304  -7.375
  185    HA   PRO  25           HA       PRO  25  -1.674  17.401  -5.678
  186    HB2  PRO  25           HB2      PRO  25  -3.460  17.511  -3.509
  187    HB3  PRO  25           HB1      PRO  25  -2.060  18.558  -3.788
  188    HG2  PRO  25           HG2      PRO  25  -4.927  19.020  -4.427
  189    HG3  PRO  25           HG1      PRO  25  -3.681  20.182  -3.941
  190    HD2  PRO  25           HD2      PRO  25  -4.509  20.061  -6.473
  191    HD3  PRO  25           HD1      PRO  25  -2.796  20.324  -6.095
  192    H    THR  26           HN       THR  26  -1.569  15.253  -5.538
  193    HA   THR  26           HA       THR  26  -3.795  13.630  -6.273
  194    HB   THR  26           HB       THR  26  -2.283  11.713  -5.807
  195    HG1  THR  26           HG1      THR  26  -0.603  12.030  -4.572
  196   HG21  THR  26          HG21      THR  26  -2.254  12.809  -8.000
  197   HG22  THR  26          HG22      THR  26  -0.652  12.217  -7.560
  198   HG23  THR  26          HG23      THR  26  -1.026  13.935  -7.422
  199    HA   PRO  27           HA       PRO  27  -5.156  12.896  -2.070
  200    HB2  PRO  27           HB2      PRO  27  -7.509  11.781  -2.715
  201    HB3  PRO  27           HB1      PRO  27  -7.194  13.496  -2.985
  202    HG2  PRO  27           HG2      PRO  27  -7.455  11.323  -4.941
  203    HG3  PRO  27           HG1      PRO  27  -7.588  13.070  -5.182
  204    HD2  PRO  27           HD2      PRO  27  -5.310  11.329  -5.658
  205    HD3  PRO  27           HD1      PRO  27  -5.511  13.042  -6.083
  206    H    GLU  28           HN       GLU  28  -6.803  10.725  -1.453
  207    HA   GLU  28           HA       GLU  28  -4.843   8.613  -1.341
  208    HB2  GLU  28           HB2      GLU  28  -6.762   7.428  -0.081
  209    HB3  GLU  28           HB1      GLU  28  -5.936   8.781   0.662
  210    HG2  GLU  28           HG2      GLU  28  -7.745  10.250   0.186
  211    HG3  GLU  28           HG1      GLU  28  -8.528   9.043  -0.829
  212    H    MET  29           HN       MET  29  -4.823   8.324  -3.618
  213    HA   MET  29           HA       MET  29  -7.115   7.129  -4.907
  214    HB2  MET  29           HB2      MET  29  -5.025   8.526  -5.897
  215    HB3  MET  29           HB1      MET  29  -4.452   6.879  -6.147
  216    HG2  MET  29           HG2      MET  29  -6.563   6.382  -7.350
  217    HG3  MET  29           HG1      MET  29  -6.986   8.087  -7.215
  218    HE1  MET  29           HE1      MET  29  -4.043   9.421  -7.587
  219    HE2  MET  29           HE2      MET  29  -5.542  10.039  -8.281
  220    HE3  MET  29           HE3      MET  29  -4.134   9.780  -9.311
  221    H    ARG  30           HN       ARG  30  -7.663   5.156  -4.588
  222    HA   ARG  30           HA       ARG  30  -5.879   3.246  -3.400
  223    HB2  ARG  30           HB2      ARG  30  -8.762   3.457  -3.875
  224    HB3  ARG  30           HB1      ARG  30  -8.114   1.825  -3.966
  225    HG2  ARG  30           HG2      ARG  30  -6.899   2.775  -1.731
  226    HG3  ARG  30           HG1      ARG  30  -8.461   3.590  -1.666
  227    HD2  ARG  30           HD2      ARG  30  -9.582   1.440  -1.896
  228    HD3  ARG  30           HD1      ARG  30  -8.015   0.635  -1.954
  229    HE   ARG  30           HE       ARG  30  -8.185   2.187   0.376
  230   HH11  ARG  30          HH11      ARG  30  -9.504  -0.721  -1.012
  231   HH12  ARG  30          HH12      ARG  30  -9.787  -1.477   0.519
  232   HH21  ARG  30          HH21      ARG  30  -8.554   1.200   2.399
  233   HH22  ARG  30          HH22      ARG  30  -9.249  -0.385   2.460
  234    H    GLU  31           HN       GLU  31  -5.712   1.047  -4.213
  235    HA   GLU  31           HA       GLU  31  -6.130   0.300  -6.884
  236    HB2  GLU  31           HB2      GLU  31  -4.477   1.961  -7.480
  237    HB3  GLU  31           HB1      GLU  31  -3.377   1.368  -6.244
  238    HG2  GLU  31           HG2      GLU  31  -2.513   0.480  -8.182
  239    HG3  GLU  31           HG1      GLU  31  -3.461  -0.852  -7.535
  240    H    LYS  32           HN       LYS  32  -5.742  -1.804  -7.160
  241    HA   LYS  32           HA       LYS  32  -5.295  -3.364  -4.863
  242    HB2  LYS  32           HB2      LYS  32  -5.245  -4.278  -7.725
  243    HB3  LYS  32           HB1      LYS  32  -5.648  -5.218  -6.301
  244    HG2  LYS  32           HG2      LYS  32  -7.550  -3.583  -5.943
  245    HG3  LYS  32           HG1      LYS  32  -7.234  -3.038  -7.583
  246    HD2  LYS  32           HD2      LYS  32  -7.786  -5.131  -8.506
  247    HD3  LYS  32           HD1      LYS  32  -7.690  -5.937  -6.942
  248    HE2  LYS  32           HE2      LYS  32  -9.644  -4.644  -6.205
  249    HE3  LYS  32           HE1      LYS  32  -9.761  -3.927  -7.807
  250    HZ1  LYS  32           HZ1      LYS  32  -9.971  -6.831  -7.218
  251    HZ2  LYS  32           HZ2      LYS  32 -10.151  -6.108  -8.735
  252    HZ3  LYS  32           HZ3      LYS  32 -11.281  -5.803  -7.514
  253    H    LEU  33           HN       LEU  33  -3.393  -3.255  -3.952
  254    HA   LEU  33           HA       LEU  33  -0.936  -3.487  -5.493
  255    HB2  LEU  33           HB2      LEU  33  -1.039  -3.118  -2.560
  256    HB3  LEU  33           HB1      LEU  33   0.137  -2.593  -3.734
  257    HG   LEU  33           HG       LEU  33  -2.610  -1.454  -3.526
  258   HD11  LEU  33          HD11      LEU  33  -1.910   0.130  -2.096
  259   HD12  LEU  33          HD12      LEU  33  -0.292   0.187  -2.786
  260   HD13  LEU  33          HD13      LEU  33  -0.719  -1.091  -1.651
  261   HD21  LEU  33          HD21      LEU  33  -2.112  -0.152  -5.299
  262   HD22  LEU  33          HD22      LEU  33  -0.963  -1.446  -5.669
  263   HD23  LEU  33          HD23      LEU  33  -0.420   0.012  -4.831
  264    H    CYS  34           HN       CYS  34  -0.755  -5.605  -6.033
  265    HA   CYS  34           HA       CYS  34  -0.952  -7.594  -3.901
  266    HB2  CYS  34           HB2      CYS  34  -1.992  -7.747  -6.294
  267    HB3  CYS  34           HB1      CYS  34  -0.393  -8.325  -6.737
  268    H    GLY  35           HN       GLY  35   0.885  -7.177  -2.808
  269    HA2  GLY  35           HA2      GLY  35   3.078  -7.489  -2.215
  270    HA3  GLY  35           HA1      GLY  35   3.203  -8.571  -3.584
  271    H    HIS  36           HN       HIS  36   3.636  -7.552  -5.735
  272    HA   HIS  36           HA       HIS  36   5.724  -5.703  -5.531
  273    HB2  HIS  36           HB2      HIS  36   5.199  -7.478  -7.385
  274    HB3  HIS  36           HB1      HIS  36   4.343  -6.131  -8.141
  275    HD1  HIS  36           HD1      HIS  36   6.411  -6.560  -9.955
  276    HD2  HIS  36           HD2      HIS  36   7.307  -4.784  -6.300
  277    HE1  HIS  36           HE1      HIS  36   8.634  -5.408 -10.261
  278    H    HIS  37           HN       HIS  37   2.446  -5.254  -6.983
  279    HA   HIS  37           HA       HIS  37   2.706  -2.510  -7.461
  280    HB2  HIS  37           HB2      HIS  37   0.344  -4.227  -6.735
  281    HB3  HIS  37           HB1      HIS  37   0.168  -2.475  -6.834
  282    HD1  HIS  37           HD1      HIS  37  -1.081  -2.151  -8.969
  283    HD2  HIS  37           HD2      HIS  37   2.089  -4.794  -9.322
  284    HE1  HIS  37           HE1      HIS  37  -0.915  -2.701 -11.415
  285    H    PHE  38           HN       PHE  38   2.067  -4.380  -4.667
  286    HA   PHE  38           HA       PHE  38   1.482  -2.252  -2.893
  287    HB2  PHE  38           HB2      PHE  38   0.670  -4.450  -2.395
  288    HB3  PHE  38           HB1      PHE  38   2.285  -5.136  -2.502
  289    HD1  PHE  38           HD2      PHE  38   0.709  -2.276  -0.804
  290    HD2  PHE  38           HD1      PHE  38   3.118  -5.770  -0.463
  291    HE1  PHE  38           HE2      PHE  38   1.052  -1.807   1.595
  292    HE2  PHE  38           HE1      PHE  38   3.458  -5.324   1.939
  293    HZ   PHE  38           HZ       PHE  38   2.433  -3.323   2.974
  294    H    VAL  39           HN       VAL  39   4.297  -3.774  -4.092
  295    HA   VAL  39           HA       VAL  39   6.096  -2.787  -2.127
  296    HB   VAL  39           HB       VAL  39   6.321  -4.220  -4.739
  297   HG11  VAL  39          HG11      VAL  39   8.837  -3.257  -3.467
  298   HG12  VAL  39          HG12      VAL  39   8.025  -2.290  -4.684
  299   HG13  VAL  39          HG13      VAL  39   8.580  -3.907  -5.081
  300   HG21  VAL  39          HG21      VAL  39   6.205  -5.118  -2.261
  301   HG22  VAL  39          HG22      VAL  39   7.948  -4.856  -2.351
  302   HG23  VAL  39          HG23      VAL  39   7.157  -5.927  -3.504
  303    H    ARG  40           HN       ARG  40   5.728  -1.920  -5.597
  304    HA   ARG  40           HA       ARG  40   7.221   0.443  -5.416
  305    HB2  ARG  40           HB2      ARG  40   4.949  -0.172  -7.323
  306    HB3  ARG  40           HB1      ARG  40   6.182   1.063  -7.545
  307    HG2  ARG  40           HG2      ARG  40   7.236  -0.484  -8.738
  308    HG3  ARG  40           HG1      ARG  40   7.670  -1.201  -7.190
  309    HD2  ARG  40           HD2      ARG  40   6.167  -2.861  -7.389
  310    HD3  ARG  40           HD1      ARG  40   5.026  -1.887  -8.307
  311    HE   ARG  40           HE       ARG  40   7.490  -2.715  -9.635
  312   HH11  ARG  40          HH11      ARG  40   4.055  -3.113  -9.206
  313   HH12  ARG  40          HH12      ARG  40   3.838  -3.973 -10.692
  314   HH21  ARG  40          HH21      ARG  40   7.212  -3.843 -11.598
  315   HH22  ARG  40          HH22      ARG  40   5.633  -4.389 -12.052
  316    H    ALA  41           HN       ALA  41   3.633  -0.017  -5.003
  317    HA   ALA  41           HA       ALA  41   3.139   2.756  -4.884
  318    HB1  ALA  41           HB1      ALA  41   1.000   2.239  -4.119
  319    HB2  ALA  41           HB2      ALA  41   1.522   0.783  -3.273
  320    HB3  ALA  41           HB3      ALA  41   1.441   0.802  -5.037
  321    H    LEU  42           HN       LEU  42   4.075   0.371  -2.426
  322    HA   LEU  42           HA       LEU  42   3.809   1.882  -0.123
  323    HB2  LEU  42           HB2      LEU  42   4.925  -0.548  -0.823
  324    HB3  LEU  42           HB1      LEU  42   6.297   0.351  -0.222
  325    HG   LEU  42           HG       LEU  42   3.750  -0.207   1.297
  326   HD11  LEU  42          HD11      LEU  42   5.066  -2.196   1.114
  327   HD12  LEU  42          HD12      LEU  42   5.308  -1.534   2.730
  328   HD13  LEU  42          HD13      LEU  42   6.545  -1.315   1.496
  329   HD21  LEU  42          HD21      LEU  42   4.382   1.749   2.267
  330   HD22  LEU  42          HD22      LEU  42   6.063   1.566   1.768
  331   HD23  LEU  42          HD23      LEU  42   5.454   0.657   3.151
  332    H    VAL  43           HN       VAL  43   6.541   1.735  -2.332
  333    HA   VAL  43           HA       VAL  43   8.131   3.665  -0.925
  334    HB   VAL  43           HB       VAL  43   8.786   3.192  -3.773
  335   HG11  VAL  43          HG11      VAL  43  10.942   3.162  -2.992
  336   HG12  VAL  43          HG12      VAL  43  10.490   2.290  -1.519
  337   HG13  VAL  43          HG13      VAL  43  10.190   4.031  -1.648
  338   HG21  VAL  43          HG21      VAL  43   7.772   1.081  -3.382
  339   HG22  VAL  43          HG22      VAL  43   8.636   0.903  -1.845
  340   HG23  VAL  43          HG23      VAL  43   9.523   0.883  -3.374
  341    H    ARG  44           HN       ARG  44   6.362   3.654  -3.938
  342    HA   ARG  44           HA       ARG  44   6.732   6.106  -4.983
  343    HB2  ARG  44           HB2      ARG  44   5.411   4.586  -6.104
  344    HB3  ARG  44           HB1      ARG  44   4.464   4.214  -4.709
  345    HG2  ARG  44           HG2      ARG  44   4.261   6.867  -6.039
  346    HG3  ARG  44           HG1      ARG  44   3.401   5.439  -6.630
  347    HD2  ARG  44           HD2      ARG  44   2.592   5.141  -4.257
  348    HD3  ARG  44           HD1      ARG  44   3.149   6.781  -3.976
  349    HE   ARG  44           HE       ARG  44   0.737   6.039  -5.206
  350   HH11  ARG  44          HH11      ARG  44   3.347   8.320  -5.600
  351   HH12  ARG  44          HH12      ARG  44   2.374   9.480  -6.441
  352   HH21  ARG  44          HH21      ARG  44  -0.546   7.563  -6.315
  353   HH22  ARG  44          HH22      ARG  44   0.165   9.052  -6.843
  354    H    VAL  45           HN       VAL  45   4.745   5.017  -2.435
  355    HA   VAL  45           HA       VAL  45   3.549   7.479  -1.767
  356    HB   VAL  45           HB       VAL  45   3.840   4.877  -0.267
  357   HG11  VAL  45          HG11      VAL  45   3.588   6.969   1.190
  358   HG12  VAL  45          HG12      VAL  45   2.477   5.627   1.448
  359   HG13  VAL  45          HG13      VAL  45   1.947   7.047   0.545
  360   HG21  VAL  45          HG21      VAL  45   1.181   5.739  -0.983
  361   HG22  VAL  45          HG22      VAL  45   2.000   4.206  -1.266
  362   HG23  VAL  45          HG23      VAL  45   2.228   5.548  -2.385
  363    H    CYS  46           HN       CYS  46   5.808   5.409  -0.039
  364    HA   CYS  46           HA       CYS  46   7.159   7.715   1.163
  365    HB2  CYS  46           HB2      CYS  46   5.327   6.894   2.617
  366    HB3  CYS  46           HB1      CYS  46   6.085   5.323   2.649
  367    H    GLY  47           HN       GLY  47   7.055   4.168   1.333
  368    HA2  GLY  47           HA2      GLY  47   9.483   3.587   0.155
  369    HA3  GLY  47           HA1      GLY  47   9.866   3.932   1.833
  370    H    GLY  48           HN       GLY  48   9.151   2.543   3.450
  371    HA2  GLY  48           HA2      GLY  48   7.654   0.614   3.983
  372    HA3  GLY  48           HA1      GLY  48   8.204  -0.062   2.464
  373    HA   PRO  49           HA       PRO  49  11.060  -2.158   5.223
  374    HB2  PRO  49           HB2      PRO  49  12.198  -3.687   3.261
  375    HB3  PRO  49           HB1      PRO  49  10.655  -4.063   4.029
  376    HG2  PRO  49           HG2      PRO  49  11.167  -2.713   1.418
  377    HG3  PRO  49           HG1      PRO  49   9.996  -3.987   1.814
  378    HD2  PRO  49           HD2      PRO  49   9.281  -1.413   1.648
  379    HD3  PRO  49           HD1      PRO  49   8.525  -2.485   2.807
  380    H    ARG  50           HN       ARG  50  13.488  -2.962   3.584
  381    HA   ARG  50           HA       ARG  50  15.059  -0.628   4.190
  382    HB2  ARG  50           HB2      ARG  50  15.970  -3.100   2.797
  383    HB3  ARG  50           HB1      ARG  50  16.939  -1.998   3.763
  384    HG2  ARG  50           HG2      ARG  50  15.749  -2.715   5.777
  385    HG3  ARG  50           HG1      ARG  50  14.780  -3.825   4.805
  386    HD2  ARG  50           HD2      ARG  50  16.798  -5.035   4.160
  387    HD3  ARG  50           HD1      ARG  50  17.781  -3.913   5.100
  388    HE   ARG  50           HE       ARG  50  15.776  -5.147   6.700
  389   HH11  ARG  50          HH11      ARG  50  18.896  -5.675   5.239
  390   HH12  ARG  50          HH12      ARG  50  19.385  -6.860   6.403
  391   HH21  ARG  50          HH21      ARG  50  16.413  -6.707   8.237
  392   HH22  ARG  50          HH22      ARG  50  17.973  -7.447   8.107
  393    H    TRP  51           HN       TRP  51  14.650  -2.583   1.246
  394    HA   TRP  51           HA       TRP  51  14.740  -2.130  -0.937
  395    HB2  TRP  51           HB2      TRP  51  14.778   0.779  -0.225
  396    HB3  TRP  51           HB1      TRP  51  14.318   0.032  -1.734
  397    HD1  TRP  51           HD1      TRP  51  13.010   0.552   1.794
  398    HE1  TRP  51           HE1      TRP  51  10.477   0.121   1.780
  399    HE3  TRP  51           HE3      TRP  51  12.636  -1.227  -2.876
  400    HZ2  TRP  51           HZ2      TRP  51   8.567  -0.896  -0.054
  401    HZ3  TRP  51           HZ3      TRP  51  10.431  -1.932  -3.718
  402    HH2  TRP  51           HH2      TRP  51   8.433  -1.730  -2.298
  403    H    SER  52           HN       SER  52  17.098  -1.177   1.243
  404    HA   SER  52           HA       SER  52  19.338  -0.885   1.145
  405    HB2  SER  52           HB2      SER  52  18.975  -1.949  -1.651
  406    HB3  SER  52           HB1      SER  52  20.523  -1.787  -0.825
  407    HG   SER  52           HG       SER  52  18.677  -3.145   0.652
  408    H    THR  53           HN       THR  53  20.806   0.711   0.675
  409    HA   THR  53           HA       THR  53  20.416   2.463  -1.596
  410    HB   THR  53           HB       THR  53  20.312   4.528  -0.205
  411    HG1  THR  53           HG1      THR  53  20.253   4.403   1.925
  412   HG21  THR  53          HG21      THR  53  18.268   3.311  -1.177
  413   HG22  THR  53          HG22      THR  53  17.987   4.515   0.082
  414   HG23  THR  53          HG23      THR  53  17.954   2.798   0.481
  415    H    GLU  54           HN       GLU  54  22.101   1.870   1.462
  416    HA   GLU  54           HA       GLU  54  24.431   3.359   0.631
  417    HB2  GLU  54           HB2      GLU  54  24.032   1.561   3.028
  418    HB3  GLU  54           HB1      GLU  54  25.371   2.672   2.780
  419    HG2  GLU  54           HG2      GLU  54  22.479   3.451   3.075
  420    HG3  GLU  54           HG1      GLU  54  23.713   3.568   4.330
  421    H    ALA  55           HN       ALA  55  23.512   0.948  -0.893
  422    HA   ALA  55           HA       ALA  55  25.472  -1.092  -0.446
  423    HB1  ALA  55           HB1      ALA  55  23.285  -1.622  -1.389
  424    HB2  ALA  55           HB2      ALA  55  24.580  -2.099  -2.486
  425    HB3  ALA  55           HB3      ALA  55  23.649  -0.637  -2.805
  Start of MODEL   11
    1    H1   ALA 106           HT1      ALA 106  -4.942  -3.391  18.822
    2    H2   ALA 106           HT2      ALA 106  -4.511  -4.942  18.304
    3    H3   ALA 106           HT3      ALA 106  -5.318  -3.894  17.250
    4    HA   ALA 106           HA       ALA 106  -3.445  -2.401  17.218
    5    HB1  ALA 106           HB1      ALA 106  -2.658  -2.859  19.489
    6    HB2  ALA 106           HB2      ALA 106  -1.356  -3.014  18.308
    7    HB3  ALA 106           HB3      ALA 106  -2.116  -4.458  18.979
    8    H    ALA 107           HN       ALA 107  -1.949  -2.602  15.561
    9    HA   ALA 107           HA       ALA 107  -0.985  -3.464  13.693
   10    HB1  ALA 107           HB1      ALA 107  -1.140  -6.105  15.141
   11    HB2  ALA 107           HB2      ALA 107   0.170  -4.934  15.291
   12    HB3  ALA 107           HB3      ALA 107  -0.128  -5.730  13.746
   13    H    ALA 108           HN       ALA 108  -1.469  -4.589  11.735
   14    HA   ALA 108           HA       ALA 108  -4.257  -5.539  11.600
   15    HB1  ALA 108           HB1      ALA 108  -4.633  -4.097   9.955
   16    HB2  ALA 108           HB2      ALA 108  -3.260  -4.738   9.044
   17    HB3  ALA 108           HB3      ALA 108  -3.016  -3.432  10.210
   18    H    THR 109           HN       THR 109  -4.289  -6.491   9.073
   19    HA   THR 109           HA       THR 109  -2.945  -9.012   9.336
   20    HB   THR 109           HB       THR 109  -5.263  -8.723   8.390
   21    HG1  THR 109           HG1      THR 109  -4.915 -10.318   6.785
   22   HG21  THR 109          HG21      THR 109  -4.588  -6.702   6.985
   23   HG22  THR 109          HG22      THR 109  -5.604  -7.910   6.193
   24   HG23  THR 109          HG23      THR 109  -3.874  -7.860   5.860
   25    H    ASN 110           HN       ASN 110  -2.411  -9.564   6.636
   26    HA   ASN 110           HA       ASN 110   0.161  -8.284   6.326
   27    HB2  ASN 110           HB2      ASN 110  -1.224 -10.437   4.711
   28    HB3  ASN 110           HB1      ASN 110   0.408  -9.855   4.395
   29   HD21  ASN 110          HD21      ASN 110   1.341 -11.840   4.766
   30   HD22  ASN 110          HD22      ASN 110   1.466 -12.532   6.345
   31    HA   PRO 111           HA       PRO 111  -1.942  -5.157   3.820
   32    HB2  PRO 111           HB2      PRO 111   0.313  -3.687   3.323
   33    HB3  PRO 111           HB1      PRO 111  -0.667  -3.533   4.781
   34    HG2  PRO 111           HG2      PRO 111   1.859  -5.089   4.360
   35    HG3  PRO 111           HG1      PRO 111   1.396  -4.054   5.726
   36    HD2  PRO 111           HD2      PRO 111   1.213  -6.720   5.880
   37    HD3  PRO 111           HD1      PRO 111  -0.007  -5.669   6.633
   38    H    ALA 112           HN       ALA 112   0.582  -7.327   2.965
   39    HA   ALA 112           HA       ALA 112   0.859  -6.512   0.242
   40    HB1  ALA 112           HB1      ALA 112   1.425  -9.275   1.266
   41    HB2  ALA 112           HB2      ALA 112   2.475  -7.909   1.635
   42    HB3  ALA 112           HB3      ALA 112   2.222  -8.396  -0.040
   43    H    ARG 113           HN       ARG 113  -0.860  -9.124   1.863
   44    HA   ARG 113           HA       ARG 113  -2.251  -9.962  -0.513
   45    HB2  ARG 113           HB2      ARG 113  -1.644 -11.171   1.847
   46    HB3  ARG 113           HB1      ARG 113  -3.317 -10.724   2.139
   47    HG2  ARG 113           HG2      ARG 113  -2.457 -12.233  -0.310
   48    HG3  ARG 113           HG1      ARG 113  -2.915 -13.031   1.196
   49    HD2  ARG 113           HD2      ARG 113  -4.641 -11.176  -0.439
   50    HD3  ARG 113           HD1      ARG 113  -4.805 -12.928  -0.330
   51    HE   ARG 113           HE       ARG 113  -5.262 -11.072   1.916
   52   HH11  ARG 113          HH11      ARG 113  -5.922 -14.043   0.216
   53   HH12  ARG 113          HH12      ARG 113  -7.176 -14.535   1.305
   54   HH21  ARG 113          HH21      ARG 113  -6.907 -11.717   3.355
   55   HH22  ARG 113          HH22      ARG 113  -7.734 -13.216   3.088
   56    H    TYR 114           HN       TYR 114  -2.878  -7.971   2.266
   57    HA   TYR 114           HA       TYR 114  -5.642  -7.610   2.039
   58    HB2  TYR 114           HB2      TYR 114  -4.917  -6.890   4.061
   59    HB3  TYR 114           HB1      TYR 114  -3.380  -6.337   3.435
   60    HD1  TYR 114           HD1      TYR 114  -6.640  -5.077   2.176
   61    HD2  TYR 114           HD2      TYR 114  -3.300  -4.366   4.707
   62    HE1  TYR 114           HE1      TYR 114  -7.350  -2.753   2.453
   63    HE2  TYR 114           HE2      TYR 114  -3.994  -2.041   4.999
   64    HH   TYR 114           HH       TYR 114  -5.359  -0.360   3.819
   65    H    CYS 115           HN       CYS 115  -3.041  -5.427   0.859
   66    HA   CYS 115           HA       CYS 115  -4.894  -3.769  -0.518
   67    HB2  CYS 115           HB2      CYS 115  -1.969  -3.993  -1.203
   68    HB3  CYS 115           HB1      CYS 115  -3.038  -2.611  -1.405
   69    H    CYS 116           HN       CYS 116  -3.561  -6.815  -1.275
   70    HA   CYS 116           HA       CYS 116  -3.514  -6.538  -4.109
   71    HB2  CYS 116           HB2      CYS 116  -2.202  -8.282  -3.066
   72    HB3  CYS 116           HB1      CYS 116  -3.633  -8.994  -2.349
   73    H    LEU 117           HN       LEU 117  -5.880  -7.922  -1.844
   74    HA   LEU 117           HA       LEU 117  -7.727  -8.554  -3.951
   75    HB2  LEU 117           HB2      LEU 117  -7.562  -8.925  -1.045
   76    HB3  LEU 117           HB1      LEU 117  -9.180  -8.788  -1.691
   77    HG   LEU 117           HG       LEU 117  -7.132 -10.784  -2.653
   78   HD11  LEU 117          HD11      LEU 117  -8.474 -12.445  -1.445
   79   HD12  LEU 117          HD12      LEU 117  -9.457 -11.147  -0.770
   80   HD13  LEU 117          HD13      LEU 117  -7.746 -11.264  -0.357
   81   HD21  LEU 117          HD21      LEU 117  -9.048 -11.838  -3.752
   82   HD22  LEU 117          HD22      LEU 117  -8.796 -10.191  -4.334
   83   HD23  LEU 117          HD23      LEU 117 -10.091 -10.533  -3.186
   84    H    SER 118           HN       SER 118  -7.079  -5.752  -2.093
   85    HA   SER 118           HA       SER 118  -9.595  -4.590  -3.074
   86    HB2  SER 118           HB2      SER 118  -9.841  -3.318  -0.973
   87    HB3  SER 118           HB1      SER 118  -9.915  -5.060  -0.704
   88    HG   SER 118           HG       SER 118  -8.408  -3.452   0.578
   89    H    GLY 119           HN       GLY 119  -6.429  -3.753  -1.629
   90    HA2  GLY 119           HA2      GLY 119  -4.958  -2.356  -3.015
   91    HA3  GLY 119           HA1      GLY 119  -6.384  -1.418  -3.445
   92    H    CYS 120           HN       CYS 120  -4.056  -0.236  -2.352
   93    HA   CYS 120           HA       CYS 120  -5.173   0.711   0.171
   94    HB2  CYS 120           HB2      CYS 120  -2.337  -0.192  -0.219
   95    HB3  CYS 120           HB1      CYS 120  -2.852   0.806   1.132
   96    H    THR 121           HN       THR 121  -4.877   2.788   0.702
   97    HA   THR 121           HA       THR 121  -4.190   4.593  -1.436
   98    HB   THR 121           HB       THR 121  -4.815   6.375   0.125
   99    HG1  THR 121           HG1      THR 121  -5.699   5.541   2.228
  100   HG21  THR 121          HG21      THR 121  -6.465   4.691  -1.046
  101   HG22  THR 121          HG22      THR 121  -7.044   6.008  -0.029
  102   HG23  THR 121          HG23      THR 121  -6.929   4.369   0.619
  103    H    GLN 122           HN       GLN 122  -2.721   6.393  -1.117
  104    HA   GLN 122           HA       GLN 122  -0.156   5.604  -0.294
  105    HB2  GLN 122           HB2      GLN 122  -1.452   8.242  -0.936
  106    HB3  GLN 122           HB1      GLN 122   0.175   8.202  -0.280
  107    HG2  GLN 122           HG2      GLN 122   1.039   7.114  -2.135
  108    HG3  GLN 122           HG1      GLN 122  -0.541   6.545  -2.655
  109   HE21  GLN 122          HE21      GLN 122   1.671   9.217  -2.587
  110   HE22  GLN 122          HE22      GLN 122   0.854  10.195  -3.753
  111    H    GLN 123           HN       GLN 123  -2.903   6.565   1.498
  112    HA   GLN 123           HA       GLN 123  -1.471   7.582   3.752
  113    HB2  GLN 123           HB2      GLN 123  -4.267   6.544   3.371
  114    HB3  GLN 123           HB1      GLN 123  -3.658   7.028   4.936
  115    HG2  GLN 123           HG2      GLN 123  -3.261   9.281   4.089
  116    HG3  GLN 123           HG1      GLN 123  -3.882   8.788   2.515
  117   HE21  GLN 123          HE21      GLN 123  -5.936   7.081   3.706
  118   HE22  GLN 123          HE22      GLN 123  -7.159   8.151   4.294
  119    H    ASP 124           HN       ASP 124  -3.147   4.521   3.015
  120    HA   ASP 124           HA       ASP 124  -2.336   3.115   5.283
  121    HB2  ASP 124           HB2      ASP 124  -3.554   2.487   2.756
  122    HB3  ASP 124           HB1      ASP 124  -2.295   1.302   3.085
  123    H    LEU 125           HN       LEU 125  -0.854   3.188   2.063
  124    HA   LEU 125           HA       LEU 125   1.424   1.729   2.709
  125    HB2  LEU 125           HB2      LEU 125   1.033   3.818   0.561
  126    HB3  LEU 125           HB1      LEU 125   2.389   2.742   0.654
  127    HG   LEU 125           HG       LEU 125   0.043   1.154   0.769
  128   HD11  LEU 125          HD11      LEU 125  -1.439   2.295  -0.439
  129   HD12  LEU 125          HD12      LEU 125  -0.352   2.059  -1.812
  130   HD13  LEU 125          HD13      LEU 125  -0.254   3.537  -0.852
  131   HD21  LEU 125          HD21      LEU 125   2.406   0.767  -0.163
  132   HD22  LEU 125          HD22      LEU 125   1.777   1.539  -1.626
  133   HD23  LEU 125          HD23      LEU 125   1.037   0.055  -1.014
  134    H    LEU 126           HN       LEU 126   0.685   5.145   3.185
  135    HA   LEU 126           HA       LEU 126   3.319   6.016   3.710
  136    HB2  LEU 126           HB2      LEU 126   0.597   7.046   4.158
  137    HB3  LEU 126           HB1      LEU 126   1.784   7.622   5.306
  138    HG   LEU 126           HG       LEU 126   1.942   7.905   2.307
  139   HD11  LEU 126          HD11      LEU 126   0.261   9.355   3.269
  140   HD12  LEU 126          HD12      LEU 126   1.663  10.304   2.775
  141   HD13  LEU 126          HD13      LEU 126   1.409   9.927   4.479
  142   HD21  LEU 126          HD21      LEU 126   3.888   9.348   2.776
  143   HD22  LEU 126          HD22      LEU 126   4.161   7.671   3.248
  144   HD23  LEU 126          HD23      LEU 126   3.798   8.885   4.476
  145    H    THR 127           HN       THR 127   0.983   4.271   5.584
  146    HA   THR 127           HA       THR 127   2.576   4.582   8.018
  147    HB   THR 127           HB       THR 127   0.745   4.061   9.252
  148    HG1  THR 127           HG1      THR 127  -0.077   2.315   7.152
  149   HG21  THR 127          HG21      THR 127   0.058   5.788   7.449
  150   HG22  THR 127          HG22      THR 127  -1.198   5.036   8.428
  151   HG23  THR 127          HG23      THR 127  -0.903   4.469   6.786
  152    H    LEU 128           HN       LEU 128   2.451   2.518   5.369
  153    HA   LEU 128           HA       LEU 128   3.073   0.136   6.937
  154    HB2  LEU 128           HB2      LEU 128   2.709   0.485   3.967
  155    HB3  LEU 128           HB1      LEU 128   2.975  -1.031   4.785
  156    HG   LEU 128           HG       LEU 128   0.614   0.721   5.400
  157   HD11  LEU 128          HD11      LEU 128   0.597  -1.640   3.546
  158   HD12  LEU 128          HD12      LEU 128   0.707   0.026   2.976
  159   HD13  LEU 128          HD13      LEU 128  -0.714  -0.506   3.879
  160   HD21  LEU 128          HD21      LEU 128   0.951  -0.820   7.116
  161   HD22  LEU 128          HD22      LEU 128   1.416  -2.084   5.985
  162   HD23  LEU 128          HD23      LEU 128  -0.266  -1.574   6.082
  163    H    CYS 129           HN       CYS 129   4.631   2.693   5.303
  164    HA   CYS 129           HA       CYS 129   7.027   1.303   4.597
  165    HB2  CYS 129           HB2      CYS 129   7.982   3.494   4.182
  166    HB3  CYS 129           HB1      CYS 129   6.357   3.423   3.518
  167    HA   PRO 130           HA       PRO 130   9.080   1.332   8.511
  168    HB2  PRO 130           HB2      PRO 130  11.688   1.384   7.297
  169    HB3  PRO 130           HB1      PRO 130  10.804  -0.007   7.925
  170    HG2  PRO 130           HG2      PRO 130  11.367   0.381   5.265
  171    HG3  PRO 130           HG1      PRO 130  10.007  -0.588   5.863
  172    HD2  PRO 130           HD2      PRO 130  10.028   2.239   4.864
  173    HD3  PRO 130           HD1      PRO 130   8.847   0.946   4.552
  174    H    TYR 131           HN       TYR 131   8.737   4.026   6.920
  175    HA   TYR 131           HA       TYR 131  10.629   5.521   8.606
  176    HB2  TYR 131           HB2      TYR 131  10.011   5.892   5.691
  177    HB3  TYR 131           HB1      TYR 131  10.537   7.258   6.669
  178    HD1  TYR 131           HD2      TYR 131  11.530   3.970   5.325
  179    HD2  TYR 131           HD1      TYR 131  12.811   7.473   7.372
  180    HE1  TYR 131           HE2      TYR 131  13.873   3.298   4.998
  181    HE2  TYR 131           HE1      TYR 131  15.157   6.811   7.049
  182    HH   TYR 131           HH       TYR 131  16.109   4.403   4.901
  183    H2   PRO  25           HT1      PRO  25  -2.545  12.689 -11.305
  184    H3   PRO  25           HT2      PRO  25  -1.236  13.573 -10.895
  185    HA   PRO  25           HA       PRO  25  -2.198  14.109  -9.114
  186    HB2  PRO  25           HB2      PRO  25  -4.523  15.518 -10.132
  187    HB3  PRO  25           HB1      PRO  25  -3.089  16.164  -9.321
  188    HG2  PRO  25           HG2      PRO  25  -3.582  16.548 -11.964
  189    HG3  PRO  25           HG1      PRO  25  -1.947  16.461 -11.284
  190    HD2  PRO  25           HD2      PRO  25  -3.526  14.332 -12.705
  191    HD3  PRO  25           HD1      PRO  25  -1.823  14.783 -12.905
  192    H    THR  26           HN       THR  26  -3.490  13.170  -7.635
  193    HA   THR  26           HA       THR  26  -6.139  12.275  -8.208
  194    HB   THR  26           HB       THR  26  -5.069  10.438  -9.317
  195    HG1  THR  26           HG1      THR  26  -5.902   8.754  -8.067
  196   HG21  THR  26          HG21      THR  26  -3.432   8.993  -8.187
  197   HG22  THR  26          HG22      THR  26  -3.443  10.078  -6.796
  198   HG23  THR  26          HG23      THR  26  -2.836  10.646  -8.351
  199    HA   PRO  27           HA       PRO  27  -6.002  12.490  -3.761
  200    HB2  PRO  27           HB2      PRO  27  -8.633  12.273  -3.312
  201    HB3  PRO  27           HB1      PRO  27  -7.948  13.688  -4.118
  202    HG2  PRO  27           HG2      PRO  27  -9.539  11.471  -5.244
  203    HG3  PRO  27           HG1      PRO  27  -9.339  13.127  -5.837
  204    HD2  PRO  27           HD2      PRO  27  -7.986  10.745  -6.716
  205    HD3  PRO  27           HD1      PRO  27  -7.794  12.401  -7.324
  206    H    GLU  28           HN       GLU  28  -4.869  10.265  -3.919
  207    HA   GLU  28           HA       GLU  28  -4.719   8.031  -3.549
  208    HB2  GLU  28           HB2      GLU  28  -6.398   8.345  -1.162
  209    HB3  GLU  28           HB1      GLU  28  -4.757   7.764  -1.347
  210    HG2  GLU  28           HG2      GLU  28  -3.972  10.062  -1.598
  211    HG3  GLU  28           HG1      GLU  28  -5.618  10.635  -1.346
  212    H    MET  29           HN       MET  29  -6.173   7.666  -5.410
  213    HA   MET  29           HA       MET  29  -8.883   6.851  -4.844
  214    HB2  MET  29           HB2      MET  29  -8.112   7.982  -6.980
  215    HB3  MET  29           HB1      MET  29  -7.336   6.458  -7.391
  216    HG2  MET  29           HG2      MET  29  -9.454   5.328  -7.440
  217    HG3  MET  29           HG1      MET  29 -10.279   6.774  -6.860
  218    HE1  MET  29           HE1      MET  29  -7.347   6.697  -9.488
  219    HE2  MET  29           HE2      MET  29  -8.243   6.512 -10.995
  220    HE3  MET  29           HE3      MET  29  -8.222   5.200  -9.815
  221    H    ARG  30           HN       ARG  30  -6.382   5.476  -3.813
  222    HA   ARG  30           HA       ARG  30  -5.665   3.403  -3.300
  223    HB2  ARG  30           HB2      ARG  30  -8.563   3.315  -3.556
  224    HB3  ARG  30           HB1      ARG  30  -7.775   1.767  -3.705
  225    HG2  ARG  30           HG2      ARG  30  -6.489   2.765  -1.562
  226    HG3  ARG  30           HG1      ARG  30  -8.079   3.509  -1.384
  227    HD2  ARG  30           HD2      ARG  30  -9.105   1.310  -1.573
  228    HD3  ARG  30           HD1      ARG  30  -7.503   0.584  -1.707
  229    HE   ARG  30           HE       ARG  30  -7.516   2.066   0.624
  230   HH11  ARG  30          HH11      ARG  30  -9.248  -0.667  -0.671
  231   HH12  ARG  30          HH12      ARG  30  -9.542  -1.381   0.879
  232   HH21  ARG  30          HH21      ARG  30  -7.900   1.132   2.671
  233   HH22  ARG  30          HH22      ARG  30  -8.775  -0.358   2.779
  234    H    GLU  31           HN       GLU  31  -5.611   1.047  -4.111
  235    HA   GLU  31           HA       GLU  31  -6.041   0.363  -6.790
  236    HB2  GLU  31           HB2      GLU  31  -4.388   2.048  -7.358
  237    HB3  GLU  31           HB1      GLU  31  -3.261   1.388  -6.181
  238    HG2  GLU  31           HG2      GLU  31  -2.548   0.674  -8.313
  239    HG3  GLU  31           HG1      GLU  31  -3.242  -0.727  -7.508
  240    H    LYS  32           HN       LYS  32  -5.764  -1.730  -7.070
  241    HA   LYS  32           HA       LYS  32  -5.268  -3.355  -4.845
  242    HB2  LYS  32           HB2      LYS  32  -5.308  -4.202  -7.726
  243    HB3  LYS  32           HB1      LYS  32  -5.696  -5.167  -6.315
  244    HG2  LYS  32           HG2      LYS  32  -7.554  -3.505  -5.871
  245    HG3  LYS  32           HG1      LYS  32  -7.265  -2.919  -7.501
  246    HD2  LYS  32           HD2      LYS  32  -7.844  -5.002  -8.464
  247    HD3  LYS  32           HD1      LYS  32  -7.795  -5.821  -6.905
  248    HE2  LYS  32           HE2      LYS  32  -9.712  -4.492  -6.176
  249    HE3  LYS  32           HE1      LYS  32  -9.776  -3.715  -7.754
  250    HZ1  LYS  32           HZ1      LYS  32 -10.151  -6.615  -7.229
  251    HZ2  LYS  32           HZ2      LYS  32 -10.192  -5.882  -8.752
  252    HZ3  LYS  32           HZ3      LYS  32 -11.376  -5.511  -7.604
  253    H    LEU  33           HN       LEU  33  -3.362  -3.334  -3.972
  254    HA   LEU  33           HA       LEU  33  -0.915  -3.601  -5.533
  255    HB2  LEU  33           HB2      LEU  33  -1.192  -3.187  -2.603
  256    HB3  LEU  33           HB1      LEU  33   0.184  -2.939  -3.635
  257    HG   LEU  33           HG       LEU  33  -2.321  -1.321  -3.718
  258   HD11  LEU  33          HD11      LEU  33  -1.367  -0.545  -1.808
  259   HD12  LEU  33          HD12      LEU  33  -0.493   0.442  -2.981
  260   HD13  LEU  33          HD13      LEU  33   0.260  -1.002  -2.308
  261   HD21  LEU  33          HD21      LEU  33  -1.376  -0.048  -5.412
  262   HD22  LEU  33          HD22      LEU  33  -0.891  -1.691  -5.854
  263   HD23  LEU  33          HD23      LEU  33   0.257  -0.612  -5.056
  264    H    CYS  34           HN       CYS  34  -0.537  -5.721  -6.021
  265    HA   CYS  34           HA       CYS  34  -0.829  -7.682  -3.861
  266    HB2  CYS  34           HB2      CYS  34  -1.752  -7.871  -6.345
  267    HB3  CYS  34           HB1      CYS  34  -0.164  -8.573  -6.607
  268    H    GLY  35           HN       GLY  35   0.953  -7.436  -2.704
  269    HA2  GLY  35           HA2      GLY  35   3.139  -7.675  -2.057
  270    HA3  GLY  35           HA1      GLY  35   3.302  -8.762  -3.415
  271    H    HIS  36           HN       HIS  36   4.086  -7.913  -5.445
  272    HA   HIS  36           HA       HIS  36   6.072  -6.014  -5.201
  273    HB2  HIS  36           HB2      HIS  36   5.933  -7.763  -6.969
  274    HB3  HIS  36           HB1      HIS  36   4.726  -6.768  -7.783
  275    HD1  HIS  36           HD1      HIS  36   6.469  -6.523  -9.803
  276    HD2  HIS  36           HD2      HIS  36   7.605  -4.873  -6.159
  277    HE1  HIS  36           HE1      HIS  36   8.404  -4.977 -10.309
  278    H    HIS  37           HN       HIS  37   2.910  -5.588  -6.932
  279    HA   HIS  37           HA       HIS  37   3.155  -2.880  -7.497
  280    HB2  HIS  37           HB2      HIS  37   0.749  -4.449  -6.534
  281    HB3  HIS  37           HB1      HIS  37   0.645  -2.730  -6.901
  282    HD1  HIS  37           HD1      HIS  37  -0.340  -2.404  -9.138
  283    HD2  HIS  37           HD2      HIS  37   2.025  -5.796  -8.928
  284    HE1  HIS  37           HE1      HIS  37  -0.437  -3.454 -11.421
  285    H    PHE  38           HN       PHE  38   2.008  -4.498  -4.645
  286    HA   PHE  38           HA       PHE  38   1.516  -2.336  -3.001
  287    HB2  PHE  38           HB2      PHE  38   0.705  -4.474  -2.391
  288    HB3  PHE  38           HB1      PHE  38   2.303  -5.194  -2.485
  289    HD1  PHE  38           HD2      PHE  38   0.729  -2.314  -0.806
  290    HD2  PHE  38           HD1      PHE  38   3.175  -5.783  -0.458
  291    HE1  PHE  38           HE2      PHE  38   1.049  -1.848   1.602
  292    HE2  PHE  38           HE1      PHE  38   3.492  -5.338   1.946
  293    HZ   PHE  38           HZ       PHE  38   2.432  -3.361   2.980
  294    H    VAL  39           HN       VAL  39   4.462  -3.923  -3.852
  295    HA   VAL  39           HA       VAL  39   6.041  -2.656  -1.856
  296    HB   VAL  39           HB       VAL  39   6.431  -4.698  -3.792
  297   HG11  VAL  39          HG11      VAL  39   8.459  -4.146  -4.914
  298   HG12  VAL  39          HG12      VAL  39   8.535  -2.581  -4.135
  299   HG13  VAL  39          HG13      VAL  39   7.268  -2.909  -5.301
  300   HG21  VAL  39          HG21      VAL  39   7.535  -3.802  -1.334
  301   HG22  VAL  39          HG22      VAL  39   8.866  -4.146  -2.438
  302   HG23  VAL  39          HG23      VAL  39   7.667  -5.391  -2.089
  303    H    ARG  40           HN       ARG  40   5.339  -2.079  -5.254
  304    HA   ARG  40           HA       ARG  40   6.962   0.171  -5.698
  305    HB2  ARG  40           HB2      ARG  40   4.296  -0.256  -7.003
  306    HB3  ARG  40           HB1      ARG  40   5.759   0.444  -7.684
  307    HG2  ARG  40           HG2      ARG  40   6.770  -1.905  -7.318
  308    HG3  ARG  40           HG1      ARG  40   5.085  -2.424  -7.209
  309    HD2  ARG  40           HD2      ARG  40   5.271  -0.690  -9.383
  310    HD3  ARG  40           HD1      ARG  40   6.634  -1.793  -9.517
  311    HE   ARG  40           HE       ARG  40   4.248  -3.216  -8.962
  312   HH11  ARG  40          HH11      ARG  40   5.917  -1.543 -11.521
  313   HH12  ARG  40          HH12      ARG  40   5.193  -2.478 -12.785
  314   HH21  ARG  40          HH21      ARG  40   3.292  -4.462 -10.621
  315   HH22  ARG  40          HH22      ARG  40   3.700  -4.139 -12.273
  316    H    ALA  41           HN       ALA  41   3.401   0.111  -5.135
  317    HA   ALA  41           HA       ALA  41   3.135   2.847  -4.857
  318    HB1  ALA  41           HB1      ALA  41   1.046   2.400  -3.711
  319    HB2  ALA  41           HB2      ALA  41   1.529   0.738  -3.357
  320    HB3  ALA  41           HB3      ALA  41   1.237   1.243  -5.026
  321    H    LEU  42           HN       LEU  42   3.925   0.366  -2.366
  322    HA   LEU  42           HA       LEU  42   3.929   1.924  -0.105
  323    HB2  LEU  42           HB2      LEU  42   4.919  -0.567  -0.798
  324    HB3  LEU  42           HB1      LEU  42   6.362   0.304  -0.339
  325    HG   LEU  42           HG       LEU  42   3.928  -0.154   1.384
  326   HD11  LEU  42          HD11      LEU  42   5.168  -2.151   1.301
  327   HD12  LEU  42          HD12      LEU  42   5.678  -1.350   2.787
  328   HD13  LEU  42          HD13      LEU  42   6.708  -1.294   1.357
  329   HD21  LEU  42          HD21      LEU  42   4.557   1.645   2.524
  330   HD22  LEU  42          HD22      LEU  42   5.974   1.851   1.500
  331   HD23  LEU  42          HD23      LEU  42   6.059   0.805   2.917
  332    H    VAL  43           HN       VAL  43   6.323   1.778  -2.654
  333    HA   VAL  43           HA       VAL  43   8.154   3.640  -1.473
  334    HB   VAL  43           HB       VAL  43   8.185   3.203  -4.431
  335   HG11  VAL  43          HG11      VAL  43  10.514   3.179  -4.129
  336   HG12  VAL  43          HG12      VAL  43  10.357   2.715  -2.431
  337   HG13  VAL  43          HG13      VAL  43   9.956   4.362  -2.940
  338   HG21  VAL  43          HG21      VAL  43   7.549   1.045  -3.872
  339   HG22  VAL  43          HG22      VAL  43   8.522   1.058  -2.396
  340   HG23  VAL  43          HG23      VAL  43   9.310   0.985  -3.977
  341    H    ARG  44           HN       ARG  44   6.253   3.811  -4.446
  342    HA   ARG  44           HA       ARG  44   6.340   6.363  -5.229
  343    HB2  ARG  44           HB2      ARG  44   3.770   4.816  -4.850
  344    HB3  ARG  44           HB1      ARG  44   4.024   6.112  -5.992
  345    HG2  ARG  44           HG2      ARG  44   6.020   4.188  -6.458
  346    HG3  ARG  44           HG1      ARG  44   4.480   3.336  -6.293
  347    HD2  ARG  44           HD2      ARG  44   4.479   5.798  -7.918
  348    HD3  ARG  44           HD1      ARG  44   5.324   4.404  -8.566
  349    HE   ARG  44           HE       ARG  44   2.956   3.358  -7.836
  350   HH11  ARG  44          HH11      ARG  44   3.817   6.143  -9.746
  351   HH12  ARG  44          HH12      ARG  44   2.398   6.061 -10.737
  352   HH21  ARG  44          HH21      ARG  44   1.088   3.241  -9.138
  353   HH22  ARG  44          HH22      ARG  44   0.848   4.412 -10.392
  354    H    VAL  45           HN       VAL  45   4.548   5.094  -2.578
  355    HA   VAL  45           HA       VAL  45   3.193   7.442  -1.746
  356    HB   VAL  45           HB       VAL  45   3.717   4.831  -0.337
  357   HG11  VAL  45          HG11      VAL  45   2.072   7.198   0.358
  358   HG12  VAL  45          HG12      VAL  45   3.069   6.159   1.375
  359   HG13  VAL  45          HG13      VAL  45   1.507   5.589   0.805
  360   HG21  VAL  45          HG21      VAL  45   1.026   5.174  -1.239
  361   HG22  VAL  45          HG22      VAL  45   2.177   3.896  -1.600
  362   HG23  VAL  45          HG23      VAL  45   2.142   5.353  -2.591
  363    H    CYS  46           HN       CYS  46   5.596   5.440  -0.054
  364    HA   CYS  46           HA       CYS  46   6.348   7.787   1.573
  365    HB2  CYS  46           HB2      CYS  46   5.297   5.655   2.580
  366    HB3  CYS  46           HB1      CYS  46   6.848   4.903   2.260
  367    H    GLY  47           HN       GLY  47   7.525   5.030  -0.217
  368    HA2  GLY  47           HA2      GLY  47   9.547   5.092  -1.496
  369    HA3  GLY  47           HA1      GLY  47  10.188   6.301  -0.400
  370    H    GLY  48           HN       GLY  48   8.597   3.938   1.306
  371    HA2  GLY  48           HA2      GLY  48   9.518   2.598   2.980
  372    HA3  GLY  48           HA1      GLY  48   9.880   1.668   1.542
  373    HA   PRO  49           HA       PRO  49  13.977   2.029   3.418
  374    HB2  PRO  49           HB2      PRO  49  15.090   0.008   1.997
  375    HB3  PRO  49           HB1      PRO  49  14.035  -0.267   3.382
  376    HG2  PRO  49           HG2      PRO  49  13.355  -0.340   0.475
  377    HG3  PRO  49           HG1      PRO  49  12.936  -1.501   1.751
  378    HD2  PRO  49           HD2      PRO  49  11.218   0.379   0.915
  379    HD3  PRO  49           HD1      PRO  49  11.246  -0.152   2.583
  380    H    ARG  50           HN       ARG  50  15.908   1.000   1.259
  381    HA   ARG  50           HA       ARG  50  16.525   3.588   0.163
  382    HB2  ARG  50           HB2      ARG  50  17.890   1.029  -0.500
  383    HB3  ARG  50           HB1      ARG  50  18.578   2.647  -0.470
  384    HG2  ARG  50           HG2      ARG  50  18.385   2.687   1.965
  385    HG3  ARG  50           HG1      ARG  50  17.689   1.067   1.939
  386    HD2  ARG  50           HD2      ARG  50  19.782   0.260   0.854
  387    HD3  ARG  50           HD1      ARG  50  20.468   1.869   1.087
  388    HE   ARG  50           HE       ARG  50  19.486   0.405   3.423
  389   HH11  ARG  50          HH11      ARG  50  22.156   1.679   1.579
  390   HH12  ARG  50          HH12      ARG  50  23.297   1.507   2.871
  391   HH21  ARG  50          HH21      ARG  50  20.982   0.174   5.128
  392   HH22  ARG  50          HH22      ARG  50  22.630   0.650   4.886
  393    H    TRP  51           HN       TRP  51  15.901   0.385  -1.268
  394    HA   TRP  51           HA       TRP  51  15.099  -0.287  -3.240
  395    HB2  TRP  51           HB2      TRP  51  14.374   2.580  -3.729
  396    HB3  TRP  51           HB1      TRP  51  13.740   1.157  -4.518
  397    HD1  TRP  51           HD1      TRP  51  13.559   2.992  -1.173
  398    HE1  TRP  51           HE1      TRP  51  11.468   2.134   0.068
  399    HE3  TRP  51           HE3      TRP  51  12.322  -0.737  -4.309
  400    HZ2  TRP  51           HZ2      TRP  51   9.535   0.089  -0.282
  401    HZ3  TRP  51           HZ3      TRP  51  10.341  -2.126  -3.813
  402    HH2  TRP  51           HH2      TRP  51   8.973  -1.677  -1.825
  403    H    SER  52           HN       SER  52  17.743   1.579  -2.865
  404    HA   SER  52           HA       SER  52  18.639   1.019  -5.581
  405    HB2  SER  52           HB2      SER  52  19.141   3.753  -4.438
  406    HB3  SER  52           HB1      SER  52  19.341   3.207  -6.099
  407    HG   SER  52           HG       SER  52  16.874   2.789  -5.725
  408    H    THR  53           HN       THR  53  20.254  -0.293  -5.120
  409    HA   THR  53           HA       THR  53  22.567   0.737  -3.748
  410    HB   THR  53           HB       THR  53  22.767  -1.366  -2.345
  411    HG1  THR  53           HG1      THR  53  19.989  -1.488  -2.207
  412   HG21  THR  53          HG21      THR  53  20.608   0.602  -1.586
  413   HG22  THR  53          HG22      THR  53  22.342   0.857  -1.386
  414   HG23  THR  53          HG23      THR  53  21.527  -0.416  -0.476
  415    H    GLU  54           HN       GLU  54  23.365   0.486  -5.856
  416    HA   GLU  54           HA       GLU  54  23.576  -2.158  -6.998
  417    HB2  GLU  54           HB2      GLU  54  24.658  -1.096  -8.876
  418    HB3  GLU  54           HB1      GLU  54  23.214  -0.191  -8.443
  419    HG2  GLU  54           HG2      GLU  54  25.882   0.578  -7.375
  420    HG3  GLU  54           HG1      GLU  54  25.374   1.090  -8.983
  421    H    ALA  55           HN       ALA  55  25.222  -0.434  -4.708
  422    HA   ALA  55           HA       ALA  55  27.290  -0.553  -3.746
  423    HB1  ALA  55           HB1      ALA  55  27.102  -3.401  -4.719
  424    HB2  ALA  55           HB2      ALA  55  26.406  -2.774  -3.224
  425    HB3  ALA  55           HB3      ALA  55  28.157  -2.806  -3.437
  Start of MODEL   12
    1    H1   ALA 106           HT1      ALA 106  -2.233   2.066  13.752
    2    H2   ALA 106           HT2      ALA 106  -1.487   1.009  14.841
    3    H3   ALA 106           HT3      ALA 106  -2.726   2.033  15.370
    4    HA   ALA 106           HA       ALA 106  -3.535  -0.215  15.123
    5    HB1  ALA 106           HB1      ALA 106  -5.062   1.654  14.730
    6    HB2  ALA 106           HB2      ALA 106  -5.459   0.270  13.710
    7    HB3  ALA 106           HB3      ALA 106  -4.616   1.658  13.024
    8    H    ALA 107           HN       ALA 107  -3.625  -2.105  14.008
    9    HA   ALA 107           HA       ALA 107  -2.476  -2.164  11.301
   10    HB1  ALA 107           HB1      ALA 107  -0.734  -2.827  12.884
   11    HB2  ALA 107           HB2      ALA 107  -1.214  -4.175  11.855
   12    HB3  ALA 107           HB3      ALA 107  -1.789  -4.088  13.520
   13    H    ALA 108           HN       ALA 108  -2.918  -4.256  10.182
   14    HA   ALA 108           HA       ALA 108  -5.438  -5.493  11.058
   15    HB1  ALA 108           HB1      ALA 108  -6.528  -5.109   9.082
   16    HB2  ALA 108           HB2      ALA 108  -5.033  -4.988   8.154
   17    HB3  ALA 108           HB3      ALA 108  -5.547  -3.645   9.178
   18    H    THR 109           HN       THR 109  -5.452  -6.867   8.373
   19    HA   THR 109           HA       THR 109  -3.950  -9.171   9.158
   20    HB   THR 109           HB       THR 109  -6.114  -9.363   8.007
   21    HG1  THR 109           HG1      THR 109  -4.702 -11.107   7.760
   22   HG21  THR 109          HG21      THR 109  -4.777  -7.648   6.049
   23   HG22  THR 109          HG22      THR 109  -6.496  -7.874   6.375
   24   HG23  THR 109          HG23      THR 109  -5.639  -9.013   5.336
   25    H    ASN 110           HN       ASN 110  -3.380  -9.667   6.143
   26    HA   ASN 110           HA       ASN 110  -0.653  -8.754   6.255
   27    HB2  ASN 110           HB2      ASN 110  -2.176 -10.322   4.162
   28    HB3  ASN 110           HB1      ASN 110  -0.459  -9.941   4.052
   29   HD21  ASN 110          HD21      ASN 110   0.236 -12.031   4.112
   30   HD22  ASN 110          HD22      ASN 110   0.110 -13.034   5.514
   31    HA   PRO 111           HA       PRO 111  -1.834  -4.920   4.218
   32    HB2  PRO 111           HB2      PRO 111   0.646  -3.867   4.122
   33    HB3  PRO 111           HB1      PRO 111  -0.364  -3.834   5.566
   34    HG2  PRO 111           HG2      PRO 111   1.847  -5.731   4.855
   35    HG3  PRO 111           HG1      PRO 111   1.529  -4.916   6.400
   36    HD2  PRO 111           HD2      PRO 111   0.820  -7.470   5.993
   37    HD3  PRO 111           HD1      PRO 111  -0.189  -6.371   6.956
   38    H    ALA 112           HN       ALA 112   0.159  -7.432   3.094
   39    HA   ALA 112           HA       ALA 112   0.609  -6.147   0.504
   40    HB1  ALA 112           HB1      ALA 112   1.535  -8.910   1.130
   41    HB2  ALA 112           HB2      ALA 112   2.338  -7.533   1.881
   42    HB3  ALA 112           HB3      ALA 112   2.286  -7.670   0.123
   43    H    ARG 113           HN       ARG 113  -0.844  -9.069   1.866
   44    HA   ARG 113           HA       ARG 113  -1.908  -9.925  -0.656
   45    HB2  ARG 113           HB2      ARG 113  -1.670 -10.998   2.005
   46    HB3  ARG 113           HB1      ARG 113  -3.311 -11.221   1.412
   47    HG2  ARG 113           HG2      ARG 113  -0.805 -12.096  -0.013
   48    HG3  ARG 113           HG1      ARG 113  -1.882 -13.140   0.917
   49    HD2  ARG 113           HD2      ARG 113  -3.721 -12.565  -0.620
   50    HD3  ARG 113           HD1      ARG 113  -2.600 -11.589  -1.568
   51    HE   ARG 113           HE       ARG 113  -2.293 -14.502  -1.216
   52   HH11  ARG 113          HH11      ARG 113  -2.218 -11.626  -3.185
   53   HH12  ARG 113          HH12      ARG 113  -1.717 -12.464  -4.616
   54   HH21  ARG 113          HH21      ARG 113  -1.638 -15.612  -3.097
   55   HH22  ARG 113          HH22      ARG 113  -1.391 -14.730  -4.567
   56    H    TYR 114           HN       TYR 114  -3.240  -8.282   2.196
   57    HA   TYR 114           HA       TYR 114  -5.926  -8.412   1.421
   58    HB2  TYR 114           HB2      TYR 114  -6.336  -7.275   3.311
   59    HB3  TYR 114           HB1      TYR 114  -4.620  -7.453   3.623
   60    HD1  TYR 114           HD1      TYR 114  -6.953  -5.112   1.850
   61    HD2  TYR 114           HD2      TYR 114  -3.441  -5.562   4.213
   62    HE1  TYR 114           HE1      TYR 114  -6.741  -2.672   1.983
   63    HE2  TYR 114           HE2      TYR 114  -3.218  -3.124   4.363
   64    HH   TYR 114           HH       TYR 114  -5.697  -0.991   3.483
   65    H    CYS 115           HN       CYS 115  -3.362  -6.181   0.471
   66    HA   CYS 115           HA       CYS 115  -5.216  -4.448  -0.856
   67    HB2  CYS 115           HB2      CYS 115  -2.183  -4.515  -1.050
   68    HB3  CYS 115           HB1      CYS 115  -3.238  -3.319  -1.797
   69    H    CYS 116           HN       CYS 116  -3.586  -7.343  -1.665
   70    HA   CYS 116           HA       CYS 116  -3.561  -7.052  -4.479
   71    HB2  CYS 116           HB2      CYS 116  -2.296  -8.824  -3.309
   72    HB3  CYS 116           HB1      CYS 116  -3.801  -9.569  -2.807
   73    H    LEU 117           HN       LEU 117  -5.906  -8.340  -2.178
   74    HA   LEU 117           HA       LEU 117  -7.874  -8.841  -4.220
   75    HB2  LEU 117           HB2      LEU 117  -7.708  -9.180  -1.272
   76    HB3  LEU 117           HB1      LEU 117  -9.271  -9.216  -2.044
   77    HG   LEU 117           HG       LEU 117  -6.980 -11.043  -2.754
   78   HD11  LEU 117          HD11      LEU 117  -9.414 -11.555  -1.050
   79   HD12  LEU 117          HD12      LEU 117  -7.740 -11.501  -0.499
   80   HD13  LEU 117          HD13      LEU 117  -8.267 -12.781  -1.592
   81   HD21  LEU 117          HD21      LEU 117  -8.525 -10.688  -4.595
   82   HD22  LEU 117          HD22      LEU 117  -9.891 -11.071  -3.546
   83   HD23  LEU 117          HD23      LEU 117  -8.708 -12.317  -3.945
   84    H    SER 118           HN       SER 118  -6.973  -6.234  -2.167
   85    HA   SER 118           HA       SER 118  -9.420  -4.783  -2.939
   86    HB2  SER 118           HB2      SER 118  -9.519  -5.324  -0.544
   87    HB3  SER 118           HB1      SER 118  -7.951  -4.558  -0.301
   88    HG   SER 118           HG       SER 118  -8.835  -2.596  -0.703
   89    H    GLY 119           HN       GLY 119  -6.476  -3.804  -1.221
   90    HA2  GLY 119           HA2      GLY 119  -4.725  -2.729  -2.722
   91    HA3  GLY 119           HA1      GLY 119  -6.062  -1.733  -3.288
   92    H    CYS 120           HN       CYS 120  -3.616  -0.767  -2.036
   93    HA   CYS 120           HA       CYS 120  -4.738   0.270   0.480
   94    HB2  CYS 120           HB2      CYS 120  -1.916   0.783   0.294
   95    HB3  CYS 120           HB1      CYS 120  -2.815  -0.014   1.572
   96    H    THR 121           HN       THR 121  -4.504   2.376   1.044
   97    HA   THR 121           HA       THR 121  -4.329   4.224  -1.188
   98    HB   THR 121           HB       THR 121  -4.944   5.941   0.517
   99    HG1  THR 121           HG1      THR 121  -5.813   4.327   2.451
  100   HG21  THR 121          HG21      THR 121  -6.509   4.146  -0.715
  101   HG22  THR 121          HG22      THR 121  -7.118   5.502   0.231
  102   HG23  THR 121          HG23      THR 121  -6.990   3.898   0.961
  103    H    GLN 122           HN       GLN 122  -2.862   5.991  -1.215
  104    HA   GLN 122           HA       GLN 122  -0.249   5.417  -0.455
  105    HB2  GLN 122           HB2      GLN 122  -1.704   7.926  -1.225
  106    HB3  GLN 122           HB1      GLN 122  -0.072   8.050  -0.599
  107    HG2  GLN 122           HG2      GLN 122   0.841   6.885  -2.391
  108    HG3  GLN 122           HG1      GLN 122  -0.704   6.188  -2.842
  109   HE21  GLN 122          HE21      GLN 122   1.316   9.013  -2.950
  110   HE22  GLN 122          HE22      GLN 122   0.434   9.847  -4.179
  111    H    GLN 123           HN       GLN 123  -2.924   6.497   1.397
  112    HA   GLN 123           HA       GLN 123  -1.416   7.688   3.524
  113    HB2  GLN 123           HB2      GLN 123  -4.159   7.363   2.913
  114    HB3  GLN 123           HB1      GLN 123  -3.872   6.547   4.448
  115    HG2  GLN 123           HG2      GLN 123  -2.711   9.241   4.150
  116    HG3  GLN 123           HG1      GLN 123  -4.467   9.136   4.270
  117   HE21  GLN 123          HE21      GLN 123  -2.499   6.731   5.790
  118   HE22  GLN 123          HE22      GLN 123  -2.740   7.261   7.418
  119    H    ASP 124           HN       ASP 124  -3.070   4.557   3.111
  120    HA   ASP 124           HA       ASP 124  -2.176   3.345   5.455
  121    HB2  ASP 124           HB2      ASP 124  -3.824   2.483   3.619
  122    HB3  ASP 124           HB1      ASP 124  -2.382   1.806   2.877
  123    H    LEU 125           HN       LEU 125  -0.765   3.265   2.205
  124    HA   LEU 125           HA       LEU 125   1.554   1.861   2.856
  125    HB2  LEU 125           HB2      LEU 125   1.108   3.888   0.651
  126    HB3  LEU 125           HB1      LEU 125   2.446   2.785   0.733
  127    HG   LEU 125           HG       LEU 125   0.012   1.296   0.939
  128   HD11  LEU 125          HD11      LEU 125  -1.287   2.009  -0.766
  129   HD12  LEU 125          HD12      LEU 125   0.092   2.574  -1.703
  130   HD13  LEU 125          HD13      LEU 125  -0.545   3.568  -0.396
  131   HD21  LEU 125          HD21      LEU 125   2.366   0.708   0.074
  132   HD22  LEU 125          HD22      LEU 125   1.804   1.422  -1.445
  133   HD23  LEU 125          HD23      LEU 125   0.963   0.028  -0.754
  134    H    LEU 126           HN       LEU 126   0.717   5.253   3.173
  135    HA   LEU 126           HA       LEU 126   3.295   6.275   3.678
  136    HB2  LEU 126           HB2      LEU 126   0.513   7.166   4.149
  137    HB3  LEU 126           HB1      LEU 126   1.709   7.862   5.219
  138    HG   LEU 126           HG       LEU 126   1.712   8.033   2.203
  139   HD11  LEU 126          HD11      LEU 126   1.198  10.130   4.308
  140   HD12  LEU 126          HD12      LEU 126  -0.013   9.401   3.252
  141   HD13  LEU 126          HD13      LEU 126   1.269  10.401   2.567
  142   HD21  LEU 126          HD21      LEU 126   3.588   9.596   2.519
  143   HD22  LEU 126          HD22      LEU 126   3.982   7.965   3.065
  144   HD23  LEU 126          HD23      LEU 126   3.596   9.220   4.242
  145    H    THR 127           HN       THR 127   1.018   4.496   5.601
  146    HA   THR 127           HA       THR 127   2.595   4.919   8.023
  147    HB   THR 127           HB       THR 127   0.745   4.575   9.228
  148    HG1  THR 127           HG1      THR 127  -0.628   2.645   7.945
  149   HG21  THR 127          HG21      THR 127  -0.094   5.843   7.144
  150   HG22  THR 127          HG22      THR 127  -1.285   5.137   8.235
  151   HG23  THR 127          HG23      THR 127  -0.881   4.323   6.724
  152    H    LEU 128           HN       LEU 128   2.609   2.811   5.441
  153    HA   LEU 128           HA       LEU 128   3.172   0.441   7.037
  154    HB2  LEU 128           HB2      LEU 128   2.994   0.878   4.067
  155    HB3  LEU 128           HB1      LEU 128   3.380  -0.654   4.814
  156    HG   LEU 128           HG       LEU 128   0.852   0.798   5.512
  157   HD11  LEU 128          HD11      LEU 128   0.068  -1.139   3.769
  158   HD12  LEU 128          HD12      LEU 128   1.527  -0.514   2.998
  159   HD13  LEU 128          HD13      LEU 128   0.200   0.577   3.390
  160   HD21  LEU 128          HD21      LEU 128   1.187  -0.920   7.004
  161   HD22  LEU 128          HD22      LEU 128   1.949  -1.943   5.794
  162   HD23  LEU 128          HD23      LEU 128   0.205  -1.701   5.762
  163    H    CYS 129           HN       CYS 129   4.803   3.003   5.408
  164    HA   CYS 129           HA       CYS 129   7.332   1.636   5.190
  165    HB2  CYS 129           HB2      CYS 129   8.182   3.609   4.286
  166    HB3  CYS 129           HB1      CYS 129   6.490   3.681   3.825
  167    HA   PRO 130           HA       PRO 130   8.906   2.556   9.224
  168    HB2  PRO 130           HB2      PRO 130  11.581   3.133   8.323
  169    HB3  PRO 130           HB1      PRO 130  10.957   1.629   8.999
  170    HG2  PRO 130           HG2      PRO 130  11.779   1.910   6.398
  171    HG3  PRO 130           HG1      PRO 130  10.591   0.710   6.935
  172    HD2  PRO 130           HD2      PRO 130  10.138   3.379   5.644
  173    HD3  PRO 130           HD1      PRO 130   9.325   1.829   5.329
  174    H    TYR 131           HN       TYR 131  10.801   4.147  10.220
  175    HA   TYR 131           HA       TYR 131  11.141   6.246  11.013
  176    HB2  TYR 131           HB2      TYR 131  10.857   6.944   8.083
  177    HB3  TYR 131           HB1      TYR 131  11.558   7.981   9.319
  178    HD1  TYR 131           HD1      TYR 131  13.752   7.492  10.264
  179    HD2  TYR 131           HD2      TYR 131  12.074   5.035   7.224
  180    HE1  TYR 131           HE1      TYR 131  15.958   6.478   9.873
  181    HE2  TYR 131           HE2      TYR 131  14.274   4.012   6.827
  182    HH   TYR 131           HH       TYR 131  16.876   4.368   8.947
  183    H2   PRO  25           HT1      PRO  25  -0.137  12.317 -10.455
  184    H3   PRO  25           HT2      PRO  25   0.905  13.568 -10.358
  185    HA   PRO  25           HA       PRO  25  -0.429  14.491  -9.029
  186    HB2  PRO  25           HB2      PRO  25  -2.709  14.956 -10.739
  187    HB3  PRO  25           HB1      PRO  25  -1.492  16.106 -10.170
  188    HG2  PRO  25           HG2      PRO  25  -1.675  15.279 -12.763
  189    HG3  PRO  25           HG1      PRO  25  -0.162  15.807 -12.004
  190    HD2  PRO  25           HD2      PRO  25  -1.170  13.015 -12.480
  191    HD3  PRO  25           HD1      PRO  25   0.455  13.676 -12.737
  192    H    THR  26           HN       THR  26  -0.994  11.508  -9.801
  193    HA   THR  26           HA       THR  26  -3.746  11.115  -9.155
  194    HB   THR  26           HB       THR  26  -3.167   8.722  -8.988
  195    HG1  THR  26           HG1      THR  26  -0.838   8.330  -9.664
  196   HG21  THR  26          HG21      THR  26  -1.927  10.112 -11.368
  197   HG22  THR  26          HG22      THR  26  -3.628   9.682 -11.188
  198   HG23  THR  26          HG23      THR  26  -2.405   8.416 -11.302
  199    HA   PRO  27           HA       PRO  27  -3.096  11.124  -4.725
  200    HB2  PRO  27           HB2      PRO  27  -5.663  11.108  -4.003
  201    HB3  PRO  27           HB1      PRO  27  -4.969  12.500  -4.842
  202    HG2  PRO  27           HG2      PRO  27  -6.823  10.428  -5.850
  203    HG3  PRO  27           HG1      PRO  27  -6.603  12.099  -6.388
  204    HD2  PRO  27           HD2      PRO  27  -5.499   9.703  -7.532
  205    HD3  PRO  27           HD1      PRO  27  -5.275  11.379  -8.074
  206    H    GLU  28           HN       GLU  28  -4.825   9.860  -2.962
  207    HA   GLU  28           HA       GLU  28  -3.954   7.127  -3.243
  208    HB2  GLU  28           HB2      GLU  28  -5.220   6.877  -1.025
  209    HB3  GLU  28           HB1      GLU  28  -3.761   7.843  -1.065
  210    HG2  GLU  28           HG2      GLU  28  -5.012   9.871  -1.028
  211    HG3  GLU  28           HG1      GLU  28  -6.526   9.000  -1.258
  212    H    MET  29           HN       MET  29  -5.132   6.701  -5.113
  213    HA   MET  29           HA       MET  29  -8.014   6.570  -4.997
  214    HB2  MET  29           HB2      MET  29  -6.619   7.155  -7.065
  215    HB3  MET  29           HB1      MET  29  -6.255   5.435  -7.158
  216    HG2  MET  29           HG2      MET  29  -8.624   4.930  -7.390
  217    HG3  MET  29           HG1      MET  29  -9.011   6.645  -7.257
  218    HE1  MET  29           HE1      MET  29  -7.375   3.838  -9.460
  219    HE2  MET  29           HE2      MET  29  -6.021   4.922  -9.146
  220    HE3  MET  29           HE3      MET  29  -6.678   4.780 -10.777
  221    H    ARG  30           HN       ARG  30  -6.065   4.893  -3.368
  222    HA   ARG  30           HA       ARG  30  -5.762   2.706  -2.699
  223    HB2  ARG  30           HB2      ARG  30  -8.190   3.721  -2.099
  224    HB3  ARG  30           HB1      ARG  30  -8.635   2.251  -2.959
  225    HG2  ARG  30           HG2      ARG  30  -6.559   1.598  -1.170
  226    HG3  ARG  30           HG1      ARG  30  -7.748   2.557  -0.286
  227    HD2  ARG  30           HD2      ARG  30  -9.490   1.076  -1.322
  228    HD3  ARG  30           HD1      ARG  30  -8.161   0.017  -1.798
  229    HE   ARG  30           HE       ARG  30  -7.723   0.334   0.824
  230   HH11  ARG  30          HH11      ARG  30 -10.607  -0.484  -0.948
  231   HH12  ARG  30          HH12      ARG  30 -11.283  -1.431   0.334
  232   HH21  ARG  30          HH21      ARG  30  -8.605  -0.908   2.521
  233   HH22  ARG  30          HH22      ARG  30 -10.145  -1.671   2.307
  234    H    GLU  31           HN       GLU  31  -4.733   1.848  -4.607
  235    HA   GLU  31           HA       GLU  31  -6.557   0.283  -6.285
  236    HB2  GLU  31           HB2      GLU  31  -4.716   0.183  -7.929
  237    HB3  GLU  31           HB1      GLU  31  -5.207   1.834  -7.576
  238    HG2  GLU  31           HG2      GLU  31  -3.305   2.176  -6.182
  239    HG3  GLU  31           HG1      GLU  31  -2.871   0.471  -6.283
  240    H    LYS  32           HN       LYS  32  -5.980  -1.774  -6.930
  241    HA   LYS  32           HA       LYS  32  -5.383  -3.443  -4.793
  242    HB2  LYS  32           HB2      LYS  32  -5.323  -4.164  -7.708
  243    HB3  LYS  32           HB1      LYS  32  -5.644  -5.220  -6.348
  244    HG2  LYS  32           HG2      LYS  32  -7.646  -3.832  -5.839
  245    HG3  LYS  32           HG1      LYS  32  -7.371  -2.990  -7.351
  246    HD2  LYS  32           HD2      LYS  32  -7.663  -5.022  -8.606
  247    HD3  LYS  32           HD1      LYS  32  -7.759  -5.971  -7.123
  248    HE2  LYS  32           HE2      LYS  32  -9.796  -4.790  -6.513
  249    HE3  LYS  32           HE1      LYS  32  -9.703  -3.839  -7.992
  250    HZ1  LYS  32           HZ1      LYS  32 -10.045  -6.785  -7.828
  251    HZ2  LYS  32           HZ2      LYS  32  -9.913  -5.898  -9.263
  252    HZ3  LYS  32           HZ3      LYS  32 -11.244  -5.666  -8.244
  253    H    LEU  33           HN       LEU  33  -3.513  -3.424  -3.867
  254    HA   LEU  33           HA       LEU  33  -1.037  -3.547  -5.393
  255    HB2  LEU  33           HB2      LEU  33  -1.438  -3.142  -2.464
  256    HB3  LEU  33           HB1      LEU  33   0.021  -2.982  -3.383
  257    HG   LEU  33           HG       LEU  33  -2.387  -1.219  -3.645
  258   HD11  LEU  33          HD11      LEU  33  -1.479  -0.290  -1.827
  259   HD12  LEU  33          HD12      LEU  33  -0.350   0.412  -2.971
  260   HD13  LEU  33          HD13      LEU  33   0.089  -1.046  -2.086
  261   HD21  LEU  33          HD21      LEU  33  -1.298  -0.039  -5.333
  262   HD22  LEU  33          HD22      LEU  33  -0.993  -1.732  -5.740
  263   HD23  LEU  33          HD23      LEU  33   0.263  -0.768  -4.960
  264    H    CYS  34           HN       CYS  34  -0.787  -5.658  -5.998
  265    HA   CYS  34           HA       CYS  34  -1.117  -7.755  -3.993
  266    HB2  CYS  34           HB2      CYS  34  -1.961  -7.823  -6.426
  267    HB3  CYS  34           HB1      CYS  34  -0.303  -8.224  -6.839
  268    H    GLY  35           HN       GLY  35   0.686  -7.022  -2.781
  269    HA2  GLY  35           HA2      GLY  35   2.821  -7.339  -1.990
  270    HA3  GLY  35           HA1      GLY  35   3.045  -8.518  -3.262
  271    H    HIS  36           HN       HIS  36   3.564  -7.612  -5.473
  272    HA   HIS  36           HA       HIS  36   5.688  -5.797  -5.271
  273    HB2  HIS  36           HB2      HIS  36   5.172  -7.621  -7.083
  274    HB3  HIS  36           HB1      HIS  36   4.368  -6.283  -7.904
  275    HD1  HIS  36           HD1      HIS  36   6.307  -6.497  -9.745
  276    HD2  HIS  36           HD2      HIS  36   7.494  -5.278  -5.943
  277    HE1  HIS  36           HE1      HIS  36   8.614  -5.512 -10.011
  278    H    HIS  37           HN       HIS  37   2.436  -5.359  -6.767
  279    HA   HIS  37           HA       HIS  37   2.726  -2.636  -7.353
  280    HB2  HIS  37           HB2      HIS  37   0.308  -4.211  -6.465
  281    HB3  HIS  37           HB1      HIS  37   0.218  -2.498  -6.863
  282    HD1  HIS  37           HD1      HIS  37  -1.055  -2.557  -9.025
  283    HD2  HIS  37           HD2      HIS  37   2.102  -5.237  -8.902
  284    HE1  HIS  37           HE1      HIS  37  -0.884  -3.528 -11.338
  285    H    PHE  38           HN       PHE  38   1.961  -4.407  -4.513
  286    HA   PHE  38           HA       PHE  38   1.383  -2.241  -2.817
  287    HB2  PHE  38           HB2      PHE  38   0.590  -4.418  -2.240
  288    HB3  PHE  38           HB1      PHE  38   2.203  -5.097  -2.318
  289    HD1  PHE  38           HD2      PHE  38   0.445  -2.327  -0.677
  290    HD2  PHE  38           HD1      PHE  38   3.192  -5.550  -0.284
  291    HE1  PHE  38           HE2      PHE  38   0.733  -1.779   1.709
  292    HE2  PHE  38           HE1      PHE  38   3.485  -5.025   2.113
  293    HZ   PHE  38           HZ       PHE  38   2.256  -3.126   3.113
  294    H    VAL  39           HN       VAL  39   4.253  -3.760  -3.924
  295    HA   VAL  39           HA       VAL  39   6.003  -2.626  -1.986
  296    HB   VAL  39           HB       VAL  39   6.295  -4.173  -4.504
  297   HG11  VAL  39          HG11      VAL  39   7.985  -2.988  -5.330
  298   HG12  VAL  39          HG12      VAL  39   8.914  -3.534  -3.936
  299   HG13  VAL  39          HG13      VAL  39   8.091  -1.983  -3.886
  300   HG21  VAL  39          HG21      VAL  39   6.354  -4.981  -2.052
  301   HG22  VAL  39          HG22      VAL  39   8.009  -4.371  -2.069
  302   HG23  VAL  39          HG23      VAL  39   7.523  -5.631  -3.199
  303    H    ARG  40           HN       ARG  40   5.749  -1.961  -5.502
  304    HA   ARG  40           HA       ARG  40   7.073   0.431  -5.542
  305    HB2  ARG  40           HB2      ARG  40   4.658  -0.394  -7.165
  306    HB3  ARG  40           HB1      ARG  40   5.683   0.987  -7.537
  307    HG2  ARG  40           HG2      ARG  40   6.880  -0.402  -8.773
  308    HG3  ARG  40           HG1      ARG  40   7.466  -1.102  -7.275
  309    HD2  ARG  40           HD2      ARG  40   5.951  -2.847  -7.372
  310    HD3  ARG  40           HD1      ARG  40   4.906  -2.018  -8.522
  311    HE   ARG  40           HE       ARG  40   7.495  -3.270  -9.149
  312   HH11  ARG  40          HH11      ARG  40   4.414  -1.980 -10.143
  313   HH12  ARG  40          HH12      ARG  40   4.566  -2.532 -11.778
  314   HH21  ARG  40          HH21      ARG  40   7.705  -3.995 -11.298
  315   HH22  ARG  40          HH22      ARG  40   6.437  -3.676 -12.434
  316    H    ALA  41           HN       ALA  41   3.461   0.140  -5.243
  317    HA   ALA  41           HA       ALA  41   2.986   2.826  -4.855
  318    HB1  ALA  41           HB1      ALA  41   0.902   2.244  -3.945
  319    HB2  ALA  41           HB2      ALA  41   1.502   0.740  -3.234
  320    HB3  ALA  41           HB3      ALA  41   1.301   0.879  -4.988
  321    H    LEU  42           HN       LEU  42   4.002   0.391  -2.445
  322    HA   LEU  42           HA       LEU  42   3.823   1.942  -0.154
  323    HB2  LEU  42           HB2      LEU  42   4.832  -0.544  -0.782
  324    HB3  LEU  42           HB1      LEU  42   6.267   0.323  -0.298
  325    HG   LEU  42           HG       LEU  42   3.790  -0.107   1.371
  326   HD11  LEU  42          HD11      LEU  42   4.963  -2.107   1.430
  327   HD12  LEU  42          HD12      LEU  42   5.613  -1.236   2.820
  328   HD13  LEU  42          HD13      LEU  42   6.529  -1.308   1.318
  329   HD21  LEU  42          HD21      LEU  42   4.461   1.906   2.192
  330   HD22  LEU  42          HD22      LEU  42   6.123   1.687   1.647
  331   HD23  LEU  42          HD23      LEU  42   5.559   0.863   3.101
  332    H    VAL  43           HN       VAL  43   6.410   1.732  -2.517
  333    HA   VAL  43           HA       VAL  43   8.129   3.619  -1.227
  334    HB   VAL  43           HB       VAL  43   8.486   3.238  -4.147
  335   HG11  VAL  43          HG11      VAL  43  10.696   3.329  -3.617
  336   HG12  VAL  43          HG12      VAL  43  10.481   2.344  -2.164
  337   HG13  VAL  43          HG13      VAL  43  10.075   4.066  -2.135
  338   HG21  VAL  43          HG21      VAL  43   7.571   1.071  -3.652
  339   HG22  VAL  43          HG22      VAL  43   8.660   0.906  -2.269
  340   HG23  VAL  43          HG23      VAL  43   9.310   0.941  -3.909
  341    H    ARG  44           HN       ARG  44   6.387   3.748  -4.292
  342    HA   ARG  44           HA       ARG  44   6.482   6.263  -5.134
  343    HB2  ARG  44           HB2      ARG  44   3.886   4.782  -4.652
  344    HB3  ARG  44           HB1      ARG  44   4.112   6.071  -5.806
  345    HG2  ARG  44           HG2      ARG  44   6.025   3.996  -6.249
  346    HG3  ARG  44           HG1      ARG  44   4.386   3.338  -6.205
  347    HD2  ARG  44           HD2      ARG  44   4.896   5.823  -7.752
  348    HD3  ARG  44           HD1      ARG  44   5.421   4.281  -8.404
  349    HE   ARG  44           HE       ARG  44   2.728   4.139  -7.544
  350   HH11  ARG  44          HH11      ARG  44   4.740   5.366 -10.113
  351   HH12  ARG  44          HH12      ARG  44   3.484   5.299 -11.303
  352   HH21  ARG  44          HH21      ARG  44   1.069   4.045  -9.107
  353   HH22  ARG  44          HH22      ARG  44   1.397   4.547 -10.732
  354    H    VAL  45           HN       VAL  45   4.731   5.078  -2.403
  355    HA   VAL  45           HA       VAL  45   3.594   7.533  -1.511
  356    HB   VAL  45           HB       VAL  45   4.008   4.860  -0.164
  357   HG11  VAL  45          HG11      VAL  45   3.718   6.931   1.329
  358   HG12  VAL  45          HG12      VAL  45   2.701   5.522   1.602
  359   HG13  VAL  45          HG13      VAL  45   2.052   6.919   0.748
  360   HG21  VAL  45          HG21      VAL  45   1.313   5.694  -0.829
  361   HG22  VAL  45          HG22      VAL  45   2.132   4.159  -1.090
  362   HG23  VAL  45          HG23      VAL  45   2.354   5.480  -2.235
  363    H    CYS  46           HN       CYS  46   5.887   5.338   0.004
  364    HA   CYS  46           HA       CYS  46   7.352   7.583   1.203
  365    HB2  CYS  46           HB2      CYS  46   5.619   6.582   2.709
  366    HB3  CYS  46           HB1      CYS  46   6.484   5.069   2.619
  367    H    GLY  47           HN       GLY  47   7.304   4.031   1.162
  368    HA2  GLY  47           HA2      GLY  47   9.106   2.893  -0.117
  369    HA3  GLY  47           HA1      GLY  47  10.201   4.102   0.528
  370    H    GLY  48           HN       GLY  48   8.979   1.015   0.888
  371    HA2  GLY  48           HA2      GLY  48   9.024   0.559   3.633
  372    HA3  GLY  48           HA1      GLY  48   9.368  -0.635   2.424
  373    HA   PRO  49           HA       PRO  49  13.501  -0.671   3.968
  374    HB2  PRO  49           HB2      PRO  49  14.611  -2.140   2.007
  375    HB3  PRO  49           HB1      PRO  49  13.445  -2.833   3.137
  376    HG2  PRO  49           HG2      PRO  49  12.999  -1.865   0.347
  377    HG3  PRO  49           HG1      PRO  49  12.414  -3.349   1.126
  378    HD2  PRO  49           HD2      PRO  49  10.905  -1.093   0.880
  379    HD3  PRO  49           HD1      PRO  49  10.671  -2.243   2.172
  380    H    ARG  50           HN       ARG  50  15.778  -0.666   2.352
  381    HA   ARG  50           HA       ARG  50  15.812   2.088   1.498
  382    HB2  ARG  50           HB2      ARG  50  18.235   1.627   1.133
  383    HB3  ARG  50           HB1      ARG  50  17.678   1.468   2.791
  384    HG2  ARG  50           HG2      ARG  50  17.408  -1.035   1.501
  385    HG3  ARG  50           HG1      ARG  50  19.037  -0.429   1.188
  386    HD2  ARG  50           HD2      ARG  50  19.045  -1.738   3.216
  387    HD3  ARG  50           HD1      ARG  50  19.315  -0.041   3.614
  388    HE   ARG  50           HE       ARG  50  16.617  -1.172   3.831
  389   HH11  ARG  50          HH11      ARG  50  19.433   0.242   5.318
  390   HH12  ARG  50          HH12      ARG  50  18.649   0.525   6.835
  391   HH21  ARG  50          HH21      ARG  50  15.575  -0.802   5.824
  392   HH22  ARG  50          HH22      ARG  50  16.456  -0.069   7.123
  393    H    TRP  51           HN       TRP  51  15.491  -0.975   0.045
  394    HA   TRP  51           HA       TRP  51  15.323  -1.694  -2.070
  395    HB2  TRP  51           HB2      TRP  51  15.216   1.179  -2.911
  396    HB3  TRP  51           HB1      TRP  51  14.521  -0.222  -3.691
  397    HD1  TRP  51           HD1      TRP  51  13.940   2.072  -0.704
  398    HE1  TRP  51           HE1      TRP  51  11.515   1.729   0.105
  399    HE3  TRP  51           HE3      TRP  51  12.745  -1.819  -3.658
  400    HZ2  TRP  51           HZ2      TRP  51   9.366  -0.044  -0.486
  401    HZ3  TRP  51           HZ3      TRP  51  10.501  -2.809  -3.487
  402    HH2  TRP  51           HH2      TRP  51   8.839  -1.893  -1.917
  403    H    SER  52           HN       SER  52  17.970  -0.315  -0.913
  404    HA   SER  52           HA       SER  52  19.456  -0.445  -3.456
  405    HB2  SER  52           HB2      SER  52  20.419   0.907  -0.941
  406    HB3  SER  52           HB1      SER  52  21.039   1.091  -2.580
  407    HG   SER  52           HG       SER  52  19.770   2.855  -2.176
  408    H    THR  53           HN       THR  53  20.431  -2.310  -3.683
  409    HA   THR  53           HA       THR  53  22.195  -3.295  -1.621
  410    HB   THR  53           HB       THR  53  21.272  -5.634  -1.838
  411    HG1  THR  53           HG1      THR  53  19.809  -4.939  -3.625
  412   HG21  THR  53          HG21      THR  53  19.568  -3.581  -0.423
  413   HG22  THR  53          HG22      THR  53  21.024  -4.343   0.217
  414   HG23  THR  53          HG23      THR  53  19.581  -5.310  -0.082
  415    H    GLU  54           HN       GLU  54  23.667  -2.737  -3.269
  416    HA   GLU  54           HA       GLU  54  24.957  -2.975  -5.096
  417    HB2  GLU  54           HB2      GLU  54  24.551  -5.921  -4.886
  418    HB3  GLU  54           HB1      GLU  54  26.026  -4.999  -5.121
  419    HG2  GLU  54           HG2      GLU  54  24.486  -5.225  -2.552
  420    HG3  GLU  54           HG1      GLU  54  25.991  -6.054  -2.938
  421    H    ALA  55           HN       ALA  55  25.052  -5.018  -6.960
  422    HA   ALA  55           HA       ALA  55  23.035  -4.146  -8.802
  423    HB1  ALA  55           HB1      ALA  55  24.173  -5.525 -10.430
  424    HB2  ALA  55           HB2      ALA  55  25.097  -6.319  -9.155
  425    HB3  ALA  55           HB3      ALA  55  25.356  -4.608  -9.499
  Start of MODEL   13
    1    H1   ALA 106           HT1      ALA 106   0.813  -2.392   8.468
    2    H2   ALA 106           HT2      ALA 106  -0.454  -2.211   9.573
    3    H3   ALA 106           HT3      ALA 106  -0.217  -3.694   8.795
    4    HA   ALA 106           HA       ALA 106   1.887  -3.996   9.905
    5    HB1  ALA 106           HB1      ALA 106   1.205  -1.383  11.249
    6    HB2  ALA 106           HB2      ALA 106   2.517  -1.664  10.104
    7    HB3  ALA 106           HB3      ALA 106   2.549  -2.438  11.688
    8    H    ALA 107           HN       ALA 107  -1.351  -3.379  10.624
    9    HA   ALA 107           HA       ALA 107  -1.336  -5.433  12.676
   10    HB1  ALA 107           HB1      ALA 107  -1.002  -3.417  13.992
   11    HB2  ALA 107           HB2      ALA 107  -2.608  -4.086  14.284
   12    HB3  ALA 107           HB3      ALA 107  -2.416  -2.675  13.244
   13    H    ALA 108           HN       ALA 108  -2.611  -4.173   9.964
   14    HA   ALA 108           HA       ALA 108  -5.343  -5.104  10.539
   15    HB1  ALA 108           HB1      ALA 108  -6.164  -3.670   8.927
   16    HB2  ALA 108           HB2      ALA 108  -4.629  -3.592   8.067
   17    HB3  ALA 108           HB3      ALA 108  -4.826  -2.736   9.596
   18    H    THR 109           HN       THR 109  -6.065  -6.901   9.651
   19    HA   THR 109           HA       THR 109  -5.828  -8.991   8.711
   20    HB   THR 109           HB       THR 109  -7.297  -8.183   7.148
   21    HG1  THR 109           HG1      THR 109  -6.276  -9.839   6.100
   22   HG21  THR 109          HG21      THR 109  -5.167  -6.232   6.465
   23   HG22  THR 109          HG22      THR 109  -6.880  -5.969   6.775
   24   HG23  THR 109          HG23      THR 109  -6.353  -6.639   5.230
   25    H    ASN 110           HN       ASN 110  -4.160  -7.789   5.940
   26    HA   ASN 110           HA       ASN 110  -1.546  -8.609   6.855
   27    HB2  ASN 110           HB2      ASN 110  -3.224 -10.301   5.077
   28    HB3  ASN 110           HB1      ASN 110  -1.532 -10.120   4.636
   29   HD21  ASN 110          HD21      ASN 110   0.036 -11.009   5.894
   30   HD22  ASN 110          HD22      ASN 110  -0.308 -12.128   7.166
   31    HA   PRO 111           HA       PRO 111  -1.322  -5.097   3.934
   32    HB2  PRO 111           HB2      PRO 111   1.251  -4.445   4.638
   33    HB3  PRO 111           HB1      PRO 111  -0.186  -3.848   5.468
   34    HG2  PRO 111           HG2      PRO 111   1.601  -6.134   6.209
   35    HG3  PRO 111           HG1      PRO 111   0.910  -4.872   7.247
   36    HD2  PRO 111           HD2      PRO 111  -0.164  -7.320   7.155
   37    HD3  PRO 111           HD1      PRO 111  -1.191  -5.875   7.277
   38    H    ALA 112           HN       ALA 112  -1.401  -6.499   2.211
   39    HA   ALA 112           HA       ALA 112   0.541  -6.605   0.355
   40    HB1  ALA 112           HB1      ALA 112   0.729  -9.113   2.037
   41    HB2  ALA 112           HB2      ALA 112   1.981  -7.888   1.844
   42    HB3  ALA 112           HB3      ALA 112   1.502  -8.877   0.468
   43    H    ARG 113           HN       ARG 113  -1.294  -9.226   1.846
   44    HA   ARG 113           HA       ARG 113  -2.680  -9.882  -0.588
   45    HB2  ARG 113           HB2      ARG 113  -2.536 -10.908   2.185
   46    HB3  ARG 113           HB1      ARG 113  -4.077 -11.150   1.381
   47    HG2  ARG 113           HG2      ARG 113  -2.703 -13.096   1.080
   48    HG3  ARG 113           HG1      ARG 113  -2.897 -12.279  -0.472
   49    HD2  ARG 113           HD2      ARG 113  -0.697 -11.251  -0.210
   50    HD3  ARG 113           HD1      ARG 113  -0.505 -12.045   1.352
   51    HE   ARG 113           HE       ARG 113  -1.022 -13.916  -0.736
   52   HH11  ARG 113          HH11      ARG 113   1.476 -11.966   0.719
   53   HH12  ARG 113          HH12      ARG 113   2.764 -13.003   0.201
   54   HH21  ARG 113          HH21      ARG 113   0.667 -15.284  -1.419
   55   HH22  ARG 113          HH22      ARG 113   2.304 -14.887  -1.015
   56    H    TYR 114           HN       TYR 114  -2.955  -7.711   1.935
   57    HA   TYR 114           HA       TYR 114  -5.774  -7.298   2.025
   58    HB2  TYR 114           HB2      TYR 114  -4.758  -6.660   3.976
   59    HB3  TYR 114           HB1      TYR 114  -3.315  -6.080   3.167
   60    HD1  TYR 114           HD1      TYR 114  -6.772  -4.947   2.424
   61    HD2  TYR 114           HD2      TYR 114  -3.058  -4.058   4.300
   62    HE1  TYR 114           HE1      TYR 114  -7.509  -2.642   2.765
   63    HE2  TYR 114           HE2      TYR 114  -3.780  -1.742   4.660
   64    HH   TYR 114           HH       TYR 114  -7.010  -0.741   4.261
   65    H    CYS 115           HN       CYS 115  -3.065  -5.593   0.440
   66    HA   CYS 115           HA       CYS 115  -4.902  -3.764  -0.842
   67    HB2  CYS 115           HB2      CYS 115  -2.021  -4.044  -1.641
   68    HB3  CYS 115           HB1      CYS 115  -3.046  -2.614  -1.645
   69    H    CYS 116           HN       CYS 116  -3.507  -6.826  -1.527
   70    HA   CYS 116           HA       CYS 116  -3.574  -6.662  -4.362
   71    HB2  CYS 116           HB2      CYS 116  -2.226  -8.358  -3.209
   72    HB3  CYS 116           HB1      CYS 116  -3.675  -9.085  -2.545
   73    H    LEU 117           HN       LEU 117  -5.794  -8.095  -1.979
   74    HA   LEU 117           HA       LEU 117  -7.756  -8.710  -3.983
   75    HB2  LEU 117           HB2      LEU 117  -7.446  -9.094  -1.073
   76    HB3  LEU 117           HB1      LEU 117  -9.076  -9.082  -1.701
   77    HG   LEU 117           HG       LEU 117  -6.873 -10.937  -2.611
   78   HD11  LEU 117          HD11      LEU 117  -8.149 -12.676  -1.465
   79   HD12  LEU 117          HD12      LEU 117  -9.283 -11.461  -0.878
   80   HD13  LEU 117          HD13      LEU 117  -7.604 -11.432  -0.341
   81   HD21  LEU 117          HD21      LEU 117  -8.456 -10.469  -4.394
   82   HD22  LEU 117          HD22      LEU 117  -9.805 -10.841  -3.320
   83   HD23  LEU 117          HD23      LEU 117  -8.678 -12.113  -3.793
   84    H    SER 118           HN       SER 118  -6.993  -5.950  -2.141
   85    HA   SER 118           HA       SER 118  -9.609  -4.789  -2.829
   86    HB2  SER 118           HB2      SER 118  -9.529  -5.297  -0.401
   87    HB3  SER 118           HB1      SER 118  -8.111  -4.261  -0.254
   88    HG   SER 118           HG       SER 118 -10.333  -3.140  -1.477
   89    H    GLY 119           HN       GLY 119  -6.401  -3.811  -1.583
   90    HA2  GLY 119           HA2      GLY 119  -5.012  -2.432  -3.092
   91    HA3  GLY 119           HA1      GLY 119  -6.485  -1.549  -3.491
   92    H    CYS 120           HN       CYS 120  -3.915  -0.579  -2.280
   93    HA   CYS 120           HA       CYS 120  -5.090   0.449   0.199
   94    HB2  CYS 120           HB2      CYS 120  -2.216  -0.299  -0.249
   95    HB3  CYS 120           HB1      CYS 120  -2.795   0.593   1.148
   96    H    THR 121           HN       THR 121  -4.804   2.502   0.806
   97    HA   THR 121           HA       THR 121  -4.306   4.388  -1.319
   98    HB   THR 121           HB       THR 121  -5.023   6.090   0.216
   99    HG1  THR 121           HG1      THR 121  -4.823   4.058   2.206
  100   HG21  THR 121          HG21      THR 121  -6.668   4.445  -0.744
  101   HG22  THR 121          HG22      THR 121  -7.225   5.419   0.610
  102   HG23  THR 121          HG23      THR 121  -6.756   3.734   0.861
  103    H    GLN 122           HN       GLN 122  -2.884   6.185  -1.091
  104    HA   GLN 122           HA       GLN 122  -0.264   5.502  -0.353
  105    HB2  GLN 122           HB2      GLN 122  -1.693   8.053  -1.020
  106    HB3  GLN 122           HB1      GLN 122  -0.092   8.152  -0.308
  107    HG2  GLN 122           HG2      GLN 122   0.908   7.055  -2.111
  108    HG3  GLN 122           HG1      GLN 122  -0.631   6.446  -2.705
  109   HE21  GLN 122          HE21      GLN 122  -1.936   9.053  -2.280
  110   HE22  GLN 122          HE22      GLN 122  -1.394  10.062  -3.572
  111    H    GLN 123           HN       GLN 123  -2.985   6.488   1.526
  112    HA   GLN 123           HA       GLN 123  -1.477   7.518   3.716
  113    HB2  GLN 123           HB2      GLN 123  -4.275   6.419   3.521
  114    HB3  GLN 123           HB1      GLN 123  -3.594   7.074   4.992
  115    HG2  GLN 123           HG2      GLN 123  -3.267   9.232   3.843
  116    HG3  GLN 123           HG1      GLN 123  -4.056   8.554   2.418
  117   HE21  GLN 123          HE21      GLN 123  -6.267   8.128   2.476
  118   HE22  GLN 123          HE22      GLN 123  -7.303   8.825   3.671
  119    H    ASP 124           HN       ASP 124  -3.101   4.436   3.018
  120    HA   ASP 124           HA       ASP 124  -2.264   3.019   5.263
  121    HB2  ASP 124           HB2      ASP 124  -3.365   2.405   2.640
  122    HB3  ASP 124           HB1      ASP 124  -2.206   1.175   3.139
  123    H    LEU 125           HN       LEU 125  -0.815   3.108   2.038
  124    HA   LEU 125           HA       LEU 125   1.505   1.711   2.669
  125    HB2  LEU 125           HB2      LEU 125   1.001   3.735   0.484
  126    HB3  LEU 125           HB1      LEU 125   2.375   2.682   0.553
  127    HG   LEU 125           HG       LEU 125   0.104   1.031   0.817
  128   HD11  LEU 125          HD11      LEU 125  -1.513   1.926  -0.410
  129   HD12  LEU 125          HD12      LEU 125  -0.403   2.085  -1.773
  130   HD13  LEU 125          HD13      LEU 125  -0.551   3.394  -0.598
  131   HD21  LEU 125          HD21      LEU 125   2.294   0.528  -0.240
  132   HD22  LEU 125          HD22      LEU 125   1.801   1.533  -1.609
  133   HD23  LEU 125          HD23      LEU 125   0.902   0.063  -1.220
  134    H    LEU 126           HN       LEU 126   0.680   5.092   3.156
  135    HA   LEU 126           HA       LEU 126   3.314   6.045   3.579
  136    HB2  LEU 126           HB2      LEU 126   0.579   7.016   4.097
  137    HB3  LEU 126           HB1      LEU 126   1.799   7.651   5.177
  138    HG   LEU 126           HG       LEU 126   1.849   7.848   2.167
  139   HD11  LEU 126          HD11      LEU 126   1.267   9.923   4.274
  140   HD12  LEU 126          HD12      LEU 126   0.115   9.241   3.127
  141   HD13  LEU 126          HD13      LEU 126   1.449  10.238   2.549
  142   HD21  LEU 126          HD21      LEU 126   3.750   9.331   2.479
  143   HD22  LEU 126          HD22      LEU 126   4.094   7.743   3.164
  144   HD23  LEU 126          HD23      LEU 126   3.678   9.088   4.224
  145    H    THR 127           HN       THR 127   1.070   4.260   5.525
  146    HA   THR 127           HA       THR 127   2.739   4.630   7.905
  147    HB   THR 127           HB       THR 127   0.953   4.174   9.223
  148    HG1  THR 127           HG1      THR 127   0.713   2.013   8.601
  149   HG21  THR 127          HG21      THR 127   0.225   5.856   7.373
  150   HG22  THR 127          HG22      THR 127  -0.982   5.195   8.473
  151   HG23  THR 127          HG23      THR 127  -0.820   4.539   6.845
  152    H    LEU 128           HN       LEU 128   2.568   2.547   5.309
  153    HA   LEU 128           HA       LEU 128   3.122   0.153   6.880
  154    HB2  LEU 128           HB2      LEU 128   2.807   0.562   3.914
  155    HB3  LEU 128           HB1      LEU 128   3.095  -0.976   4.688
  156    HG   LEU 128           HG       LEU 128   0.723   0.701   5.425
  157   HD11  LEU 128          HD11      LEU 128  -0.446  -1.021   3.840
  158   HD12  LEU 128          HD12      LEU 128   1.125  -1.015   3.041
  159   HD13  LEU 128          HD13      LEU 128   0.217   0.484   3.205
  160   HD21  LEU 128          HD21      LEU 128   1.003  -0.982   6.979
  161   HD22  LEU 128          HD22      LEU 128   1.590  -2.116   5.770
  162   HD23  LEU 128          HD23      LEU 128  -0.122  -1.705   5.825
  163    H    CYS 129           HN       CYS 129   4.725   2.657   5.144
  164    HA   CYS 129           HA       CYS 129   7.137   1.306   4.535
  165    HB2  CYS 129           HB2      CYS 129   8.123   3.554   4.332
  166    HB3  CYS 129           HB1      CYS 129   6.574   3.450   3.506
  167    HA   PRO 130           HA       PRO 130   9.095   1.084   8.495
  168    HB2  PRO 130           HB2      PRO 130  11.730   1.409   7.338
  169    HB3  PRO 130           HB1      PRO 130  10.956  -0.066   7.919
  170    HG2  PRO 130           HG2      PRO 130  11.499   0.407   5.289
  171    HG3  PRO 130           HG1      PRO 130  10.163  -0.620   5.841
  172    HD2  PRO 130           HD2      PRO 130  10.107   2.233   4.920
  173    HD3  PRO 130           HD1      PRO 130   8.978   0.911   4.548
  174    H    TYR 131           HN       TYR 131  10.423   2.219  10.034
  175    HA   TYR 131           HA       TYR 131  11.007   4.093  11.173
  176    HB2  TYR 131           HB2      TYR 131  12.070   4.902   8.460
  177    HB3  TYR 131           HB1      TYR 131  12.496   5.658   9.989
  178    HD1  TYR 131           HD1      TYR 131  13.881   4.454  11.629
  179    HD2  TYR 131           HD2      TYR 131  13.019   2.793   7.808
  180    HE1  TYR 131           HE1      TYR 131  15.708   2.836  11.927
  181    HE2  TYR 131           HE2      TYR 131  14.843   1.169   8.097
  182    HH   TYR 131           HH       TYR 131  16.947   0.975   9.401
  183    H2   PRO  25           HT1      PRO  25   0.335  15.288  -4.988
  184    H3   PRO  25           HT2      PRO  25   0.410  16.418  -3.813
  185    HA   PRO  25           HA       PRO  25  -1.402  17.388  -4.366
  186    HB2  PRO  25           HB2      PRO  25  -1.746  17.114  -7.162
  187    HB3  PRO  25           HB1      PRO  25  -1.290  18.573  -6.268
  188    HG2  PRO  25           HG2      PRO  25   0.429  16.584  -7.650
  189    HG3  PRO  25           HG1      PRO  25   0.684  18.322  -7.412
  190    HD2  PRO  25           HD2      PRO  25   2.085  16.547  -6.003
  191    HD3  PRO  25           HD1      PRO  25   1.490  18.033  -5.238
  192    H    THR  26           HN       THR  26  -0.467  14.278  -5.228
  193    HA   THR  26           HA       THR  26  -2.955  13.290  -6.213
  194    HB   THR  26           HB       THR  26  -1.020  12.038  -6.793
  195    HG1  THR  26           HG1      THR  26  -1.751  10.042  -6.240
  196   HG21  THR  26          HG21      THR  26   0.419  10.954  -5.113
  197   HG22  THR  26          HG22      THR  26  -0.494  11.752  -3.832
  198   HG23  THR  26          HG23      THR  26   0.449  12.711  -4.972
  199    HA   PRO  27           HA       PRO  27  -4.844  12.669  -2.227
  200    HB2  PRO  27           HB2      PRO  27  -7.194  11.738  -3.083
  201    HB3  PRO  27           HB1      PRO  27  -6.691  13.397  -3.426
  202    HG2  PRO  27           HG2      PRO  27  -6.827  11.056  -5.233
  203    HG3  PRO  27           HG1      PRO  27  -6.979  12.779  -5.609
  204    HD2  PRO  27           HD2      PRO  27  -4.664  11.119  -5.883
  205    HD3  PRO  27           HD1      PRO  27  -4.797  12.858  -6.199
  206    H    GLU  28           HN       GLU  28  -6.695  10.700  -1.682
  207    HA   GLU  28           HA       GLU  28  -4.973   8.419  -1.279
  208    HB2  GLU  28           HB2      GLU  28  -7.091   7.562  -0.084
  209    HB3  GLU  28           HB1      GLU  28  -6.101   8.827   0.617
  210    HG2  GLU  28           HG2      GLU  28  -8.515   9.206   0.739
  211    HG3  GLU  28           HG1      GLU  28  -7.631  10.506  -0.019
  212    H    MET  29           HN       MET  29  -5.198   8.450  -3.747
  213    HA   MET  29           HA       MET  29  -7.439   7.063  -4.861
  214    HB2  MET  29           HB2      MET  29  -5.122   8.400  -5.862
  215    HB3  MET  29           HB1      MET  29  -5.156   6.773  -6.527
  216    HG2  MET  29           HG2      MET  29  -7.401   8.769  -6.678
  217    HG3  MET  29           HG1      MET  29  -6.276   8.384  -7.979
  218    HE1  MET  29           HE1      MET  29  -8.301   7.921  -9.595
  219    HE2  MET  29           HE2      MET  29  -9.479   8.244  -8.323
  220    HE3  MET  29           HE3      MET  29  -9.588   6.761  -9.272
  221    H    ARG  30           HN       ARG  30  -7.847   5.067  -4.377
  222    HA   ARG  30           HA       ARG  30  -5.867   3.263  -3.386
  223    HB2  ARG  30           HB2      ARG  30  -8.785   3.283  -3.712
  224    HB3  ARG  30           HB1      ARG  30  -8.027   1.701  -3.801
  225    HG2  ARG  30           HG2      ARG  30  -6.787   2.776  -1.646
  226    HG3  ARG  30           HG1      ARG  30  -8.393   3.497  -1.529
  227    HD2  ARG  30           HD2      ARG  30  -9.390   1.288  -1.660
  228    HD3  ARG  30           HD1      ARG  30  -7.787   0.567  -1.797
  229    HE   ARG  30           HE       ARG  30  -7.828   2.098   0.518
  230   HH11  ARG  30          HH11      ARG  30  -9.409  -0.738  -0.744
  231   HH12  ARG  30          HH12      ARG  30  -9.647  -1.456   0.814
  232   HH21  ARG  30          HH21      ARG  30  -8.134   1.159   2.575
  233   HH22  ARG  30          HH22      ARG  30  -8.923  -0.378   2.701
  234    H    GLU  31           HN       GLU  31  -5.558   1.111  -4.221
  235    HA   GLU  31           HA       GLU  31  -6.117   0.392  -6.906
  236    HB2  GLU  31           HB2      GLU  31  -4.456   2.057  -7.478
  237    HB3  GLU  31           HB1      GLU  31  -3.341   1.411  -6.281
  238    HG2  GLU  31           HG2      GLU  31  -2.568   0.632  -8.340
  239    HG3  GLU  31           HG1      GLU  31  -3.377  -0.741  -7.600
  240    H    LYS  32           HN       LYS  32  -5.684  -1.710  -7.271
  241    HA   LYS  32           HA       LYS  32  -5.263  -3.319  -4.993
  242    HB2  LYS  32           HB2      LYS  32  -5.267  -4.198  -7.866
  243    HB3  LYS  32           HB1      LYS  32  -5.690  -5.137  -6.446
  244    HG2  LYS  32           HG2      LYS  32  -7.554  -3.497  -6.050
  245    HG3  LYS  32           HG1      LYS  32  -7.216  -2.870  -7.646
  246    HD2  LYS  32           HD2      LYS  32  -8.964  -4.417  -7.952
  247    HD3  LYS  32           HD1      LYS  32  -7.504  -5.249  -8.496
  248    HE2  LYS  32           HE2      LYS  32  -7.445  -5.960  -5.956
  249    HE3  LYS  32           HE1      LYS  32  -9.181  -5.706  -6.094
  250    HZ1  LYS  32           HZ1      LYS  32  -7.563  -7.495  -7.830
  251    HZ2  LYS  32           HZ2      LYS  32  -9.234  -7.260  -7.937
  252    HZ3  LYS  32           HZ3      LYS  32  -8.572  -8.001  -6.569
  253    H    LEU  33           HN       LEU  33  -3.368  -3.296  -4.098
  254    HA   LEU  33           HA       LEU  33  -0.907  -3.567  -5.649
  255    HB2  LEU  33           HB2      LEU  33  -0.981  -3.128  -2.730
  256    HB3  LEU  33           HB1      LEU  33   0.161  -2.606  -3.942
  257    HG   LEU  33           HG       LEU  33  -2.606  -1.514  -3.781
  258   HD11  LEU  33          HD11      LEU  33  -1.950   0.204  -2.420
  259   HD12  LEU  33          HD12      LEU  33  -0.249   0.040  -2.842
  260   HD13  LEU  33          HD13      LEU  33  -1.002  -1.121  -1.748
  261   HD21  LEU  33          HD21      LEU  33  -2.007  -0.112  -5.465
  262   HD22  LEU  33          HD22      LEU  33  -0.953  -1.480  -5.852
  263   HD23  LEU  33          HD23      LEU  33  -0.311  -0.082  -4.979
  264    H    CYS  34           HN       CYS  34  -0.615  -5.661  -6.108
  265    HA   CYS  34           HA       CYS  34  -0.910  -7.626  -3.965
  266    HB2  CYS  34           HB2      CYS  34  -1.791  -7.809  -6.432
  267    HB3  CYS  34           HB1      CYS  34  -0.169  -8.413  -6.738
  268    H    GLY  35           HN       GLY  35   0.853  -7.252  -2.760
  269    HA2  GLY  35           HA2      GLY  35   3.021  -7.484  -2.047
  270    HA3  GLY  35           HA1      GLY  35   3.212  -8.630  -3.354
  271    H    HIS  36           HN       HIS  36   3.806  -7.751  -5.501
  272    HA   HIS  36           HA       HIS  36   5.895  -5.911  -5.310
  273    HB2  HIS  36           HB2      HIS  36   5.327  -7.751  -7.121
  274    HB3  HIS  36           HB1      HIS  36   4.605  -6.373  -7.951
  275    HD1  HIS  36           HD1      HIS  36   6.604  -6.819  -9.727
  276    HD2  HIS  36           HD2      HIS  36   7.698  -5.391  -5.970
  277    HE1  HIS  36           HE1      HIS  36   8.948  -5.922  -9.971
  278    H    HIS  37           HN       HIS  37   2.682  -5.478  -6.903
  279    HA   HIS  37           HA       HIS  37   2.981  -2.753  -7.457
  280    HB2  HIS  37           HB2      HIS  37   0.600  -4.467  -6.839
  281    HB3  HIS  37           HB1      HIS  37   0.402  -2.716  -6.890
  282    HD1  HIS  37           HD1      HIS  37  -0.731  -2.299  -9.076
  283    HD2  HIS  37           HD2      HIS  37   2.416  -4.976  -9.357
  284    HE1  HIS  37           HE1      HIS  37  -0.462  -2.788 -11.530
  285    H    PHE  38           HN       PHE  38   2.059  -4.520  -4.656
  286    HA   PHE  38           HA       PHE  38   1.409  -2.365  -2.984
  287    HB2  PHE  38           HB2      PHE  38   0.627  -4.571  -2.486
  288    HB3  PHE  38           HB1      PHE  38   2.263  -5.201  -2.440
  289    HD1  PHE  38           HD2      PHE  38   0.541  -2.295  -0.971
  290    HD2  PHE  38           HD1      PHE  38   2.859  -5.800  -0.290
  291    HE1  PHE  38           HE2      PHE  38   0.609  -1.775   1.431
  292    HE2  PHE  38           HE1      PHE  38   2.939  -5.290   2.119
  293    HZ   PHE  38           HZ       PHE  38   1.814  -3.267   2.987
  294    H    VAL  39           HN       VAL  39   4.353  -3.830  -3.972
  295    HA   VAL  39           HA       VAL  39   5.972  -2.618  -1.961
  296    HB   VAL  39           HB       VAL  39   6.445  -4.240  -4.397
  297   HG11  VAL  39          HG11      VAL  39   8.012  -2.842  -5.209
  298   HG12  VAL  39          HG12      VAL  39   9.000  -3.547  -3.931
  299   HG13  VAL  39          HG13      VAL  39   8.209  -1.998  -3.675
  300   HG21  VAL  39          HG21      VAL  39   6.616  -4.638  -1.695
  301   HG22  VAL  39          HG22      VAL  39   8.305  -4.429  -2.163
  302   HG23  VAL  39          HG23      VAL  39   7.324  -5.676  -2.933
  303    H    ARG  40           HN       ARG  40   5.823  -2.032  -5.505
  304    HA   ARG  40           HA       ARG  40   7.129   0.333  -5.653
  305    HB2  ARG  40           HB2      ARG  40   4.616  -0.498  -7.109
  306    HB3  ARG  40           HB1      ARG  40   5.582   0.903  -7.554
  307    HG2  ARG  40           HG2      ARG  40   6.681  -0.474  -8.885
  308    HG3  ARG  40           HG1      ARG  40   7.425  -1.130  -7.438
  309    HD2  ARG  40           HD2      ARG  40   6.195  -3.004  -7.499
  310    HD3  ARG  40           HD1      ARG  40   4.769  -2.187  -8.128
  311    HE   ARG  40           HE       ARG  40   5.391  -2.931 -10.176
  312   HH11  ARG  40          HH11      ARG  40   8.290  -2.546  -8.273
  313   HH12  ARG  40          HH12      ARG  40   9.341  -3.078  -9.542
  314   HH21  ARG  40          HH21      ARG  40   6.768  -3.631 -11.843
  315   HH22  ARG  40          HH22      ARG  40   8.478  -3.695 -11.570
  316    H    ALA  41           HN       ALA  41   3.527   0.171  -5.239
  317    HA   ALA  41           HA       ALA  41   3.216   2.891  -4.819
  318    HB1  ALA  41           HB1      ALA  41   1.113   2.372  -3.739
  319    HB2  ALA  41           HB2      ALA  41   1.606   0.706  -3.432
  320    HB3  ALA  41           HB3      ALA  41   1.342   1.262  -5.087
  321    H    LEU  42           HN       LEU  42   3.828   0.321  -2.357
  322    HA   LEU  42           HA       LEU  42   3.840   1.782  -0.063
  323    HB2  LEU  42           HB2      LEU  42   4.780  -0.689  -0.795
  324    HB3  LEU  42           HB1      LEU  42   6.254   0.126  -0.336
  325    HG   LEU  42           HG       LEU  42   3.827  -0.292   1.407
  326   HD11  LEU  42          HD11      LEU  42   4.916  -2.329   1.386
  327   HD12  LEU  42          HD12      LEU  42   5.689  -1.514   2.748
  328   HD13  LEU  42          HD13      LEU  42   6.508  -1.594   1.189
  329   HD21  LEU  42          HD21      LEU  42   4.583   1.646   2.306
  330   HD22  LEU  42          HD22      LEU  42   6.200   1.442   1.634
  331   HD23  LEU  42          HD23      LEU  42   5.732   0.554   3.086
  332    H    VAL  43           HN       VAL  43   6.314   1.719  -2.527
  333    HA   VAL  43           HA       VAL  43   8.099   3.519  -1.181
  334    HB   VAL  43           HB       VAL  43   8.319   3.161  -4.136
  335   HG11  VAL  43          HG11      VAL  43  10.594   3.196  -3.725
  336   HG12  VAL  43          HG12      VAL  43  10.401   2.488  -2.118
  337   HG13  VAL  43          HG13      VAL  43   9.997   4.189  -2.390
  338   HG21  VAL  43          HG21      VAL  43   7.561   0.986  -3.627
  339   HG22  VAL  43          HG22      VAL  43   8.573   0.913  -2.182
  340   HG23  VAL  43          HG23      VAL  43   9.316   0.896  -3.783
  341    H    ARG  44           HN       ARG  44   6.522   3.796  -4.331
  342    HA   ARG  44           HA       ARG  44   6.610   6.343  -5.035
  343    HB2  ARG  44           HB2      ARG  44   3.969   4.894  -4.818
  344    HB3  ARG  44           HB1      ARG  44   4.399   6.105  -6.001
  345    HG2  ARG  44           HG2      ARG  44   6.316   4.227  -6.429
  346    HG3  ARG  44           HG1      ARG  44   4.927   3.244  -5.963
  347    HD2  ARG  44           HD2      ARG  44   3.653   4.785  -7.632
  348    HD3  ARG  44           HD1      ARG  44   5.263   5.072  -8.275
  349    HE   ARG  44           HE       ARG  44   4.558   2.290  -7.954
  350   HH11  ARG  44          HH11      ARG  44   4.617   5.050 -10.080
  351   HH12  ARG  44          HH12      ARG  44   4.544   4.102 -11.527
  352   HH21  ARG  44          HH21      ARG  44   4.464   1.031  -9.855
  353   HH22  ARG  44          HH22      ARG  44   4.456   1.817 -11.399
  354    H    VAL  45           HN       VAL  45   4.587   5.059  -2.554
  355    HA   VAL  45           HA       VAL  45   3.222   7.411  -1.784
  356    HB   VAL  45           HB       VAL  45   3.650   4.793  -0.356
  357   HG11  VAL  45          HG11      VAL  45   2.003   7.173   0.264
  358   HG12  VAL  45          HG12      VAL  45   2.907   6.095   1.329
  359   HG13  VAL  45          HG13      VAL  45   1.372   5.572   0.646
  360   HG21  VAL  45          HG21      VAL  45   1.016   5.053  -1.336
  361   HG22  VAL  45          HG22      VAL  45   2.257   3.886  -1.781
  362   HG23  VAL  45          HG23      VAL  45   2.124   5.406  -2.664
  363    H    CYS  46           HN       CYS  46   5.627   5.407  -0.098
  364    HA   CYS  46           HA       CYS  46   6.365   7.754   1.540
  365    HB2  CYS  46           HB2      CYS  46   5.031   5.892   2.645
  366    HB3  CYS  46           HB1      CYS  46   6.430   4.869   2.403
  367    H    GLY  47           HN       GLY  47   7.429   4.557   0.501
  368    HA2  GLY  47           HA2      GLY  47   9.562   4.302  -0.660
  369    HA3  GLY  47           HA1      GLY  47  10.200   5.603   0.334
  370    H    GLY  48           HN       GLY  48   9.500   2.245   0.123
  371    HA2  GLY  48           HA2      GLY  48   9.713   1.442   2.784
  372    HA3  GLY  48           HA1      GLY  48  10.096   0.456   1.398
  373    HA   PRO  49           HA       PRO  49  14.132   0.783   3.398
  374    HB2  PRO  49           HB2      PRO  49  15.008  -1.625   2.757
  375    HB3  PRO  49           HB1      PRO  49  13.665  -1.443   3.892
  376    HG2  PRO  49           HG2      PRO  49  13.556  -2.052   0.959
  377    HG3  PRO  49           HG1      PRO  49  12.746  -2.896   2.298
  378    HD2  PRO  49           HD2      PRO  49  11.549  -0.965   0.796
  379    HD3  PRO  49           HD1      PRO  49  11.103  -1.289   2.465
  380    H    ARG  50           HN       ARG  50  15.233   2.295   2.208
  381    HA   ARG  50           HA       ARG  50  16.666   3.209   0.733
  382    HB2  ARG  50           HB2      ARG  50  17.539   0.383   0.353
  383    HB3  ARG  50           HB1      ARG  50  18.505   1.830   0.138
  384    HG2  ARG  50           HG2      ARG  50  18.412   2.294   2.506
  385    HG3  ARG  50           HG1      ARG  50  17.346   0.909   2.755
  386    HD2  ARG  50           HD2      ARG  50  19.152  -0.562   1.887
  387    HD3  ARG  50           HD1      ARG  50  20.210   0.847   1.815
  388    HE   ARG  50           HE       ARG  50  19.114   0.577   4.407
  389   HH11  ARG  50          HH11      ARG  50  21.477  -0.848   2.276
  390   HH12  ARG  50          HH12      ARG  50  22.475  -1.434   3.565
  391   HH21  ARG  50          HH21      ARG  50  20.420  -0.193   6.108
  392   HH22  ARG  50          HH22      ARG  50  21.872  -1.063   5.743
  393    H    TRP  51           HN       TRP  51  16.111   0.102  -0.946
  394    HA   TRP  51           HA       TRP  51  15.434  -0.422  -3.010
  395    HB2  TRP  51           HB2      TRP  51  14.622   2.437  -3.378
  396    HB3  TRP  51           HB1      TRP  51  14.075   1.022  -4.242
  397    HD1  TRP  51           HD1      TRP  51  13.665   2.731  -0.860
  398    HE1  TRP  51           HE1      TRP  51  11.521   1.837   0.209
  399    HE3  TRP  51           HE3      TRP  51  12.675  -0.897  -4.177
  400    HZ2  TRP  51           HZ2      TRP  51   9.627  -0.228  -0.318
  401    HZ3  TRP  51           HZ3      TRP  51  10.691  -2.315  -3.848
  402    HH2  TRP  51           HH2      TRP  51   9.189  -1.943  -1.935
  403    H    SER  52           HN       SER  52  17.962   1.408  -2.236
  404    HA   SER  52           HA       SER  52  18.790   2.003  -4.988
  405    HB2  SER  52           HB2      SER  52  20.055   2.842  -2.368
  406    HB3  SER  52           HB1      SER  52  20.574   3.353  -3.974
  407    HG   SER  52           HG       SER  52  18.942   4.646  -2.554
  408    H    THR  53           HN       THR  53  20.690   1.198  -5.858
  409    HA   THR  53           HA       THR  53  22.405  -0.540  -4.360
  410    HB   THR  53           HB       THR  53  21.067  -2.344  -4.687
  411    HG1  THR  53           HG1      THR  53  21.691  -3.101  -7.062
  412   HG21  THR  53          HG21      THR  53  19.415  -0.845  -5.909
  413   HG22  THR  53          HG22      THR  53  19.380  -2.566  -6.288
  414   HG23  THR  53          HG23      THR  53  20.160  -1.433  -7.395
  415    H    GLU  54           HN       GLU  54  21.371   0.055  -7.709
  416    HA   GLU  54           HA       GLU  54  24.092  -0.030  -8.665
  417    HB2  GLU  54           HB2      GLU  54  21.515   0.668 -10.084
  418    HB3  GLU  54           HB1      GLU  54  23.075   0.456 -10.866
  419    HG2  GLU  54           HG2      GLU  54  23.125  -1.874 -10.153
  420    HG3  GLU  54           HG1      GLU  54  21.568  -1.664  -9.352
  421    H    ALA  55           HN       ALA  55  23.707   1.978  -6.731
  422    HA   ALA  55           HA       ALA  55  24.097   4.179  -6.309
  423    HB1  ALA  55           HB1      ALA  55  25.349   4.077  -9.052
  424    HB2  ALA  55           HB2      ALA  55  26.148   3.687  -7.529
  425    HB3  ALA  55           HB3      ALA  55  25.609   5.335  -7.844
  Start of MODEL   14
    1    H1   ALA 106           HT1      ALA 106  -4.558   1.879  10.757
    2    H2   ALA 106           HT2      ALA 106  -3.030   1.859  11.485
    3    H3   ALA 106           HT3      ALA 106  -3.950   3.279  11.488
    4    HA   ALA 106           HA       ALA 106  -3.999   2.216  13.646
    5    HB1  ALA 106           HB1      ALA 106  -6.425   2.176  13.929
    6    HB2  ALA 106           HB2      ALA 106  -6.632   2.096  12.178
    7    HB3  ALA 106           HB3      ALA 106  -5.920   3.530  12.917
    8    H    ALA 107           HN       ALA 107  -2.730   0.168  12.626
    9    HA   ALA 107           HA       ALA 107  -2.439  -2.079  12.772
   10    HB1  ALA 107           HB1      ALA 107  -3.366  -1.782  15.026
   11    HB2  ALA 107           HB2      ALA 107  -3.801  -3.343  14.331
   12    HB3  ALA 107           HB3      ALA 107  -4.988  -2.039  14.383
   13    H    ALA 108           HN       ALA 108  -2.612  -3.109  10.910
   14    HA   ALA 108           HA       ALA 108  -5.254  -3.445   9.679
   15    HB1  ALA 108           HB1      ALA 108  -2.477  -3.461   8.560
   16    HB2  ALA 108           HB2      ALA 108  -3.843  -2.435   8.118
   17    HB3  ALA 108           HB3      ALA 108  -3.835  -4.138   7.664
   18    H    THR 109           HN       THR 109  -3.286  -5.555   8.239
   19    HA   THR 109           HA       THR 109  -3.382  -7.747  10.094
   20    HB   THR 109           HB       THR 109  -5.644  -7.966   9.473
   21    HG1  THR 109           HG1      THR 109  -4.496  -9.934   9.247
   22   HG21  THR 109          HG21      THR 109  -5.088  -6.436   7.312
   23   HG22  THR 109          HG22      THR 109  -6.577  -7.374   7.491
   24   HG23  THR 109          HG23      THR 109  -5.236  -8.021   6.545
   25    H    ASN 110           HN       ASN 110  -3.370  -7.108   6.646
   26    HA   ASN 110           HA       ASN 110  -0.645  -7.963   6.320
   27    HB2  ASN 110           HB2      ASN 110  -2.927  -9.548   5.115
   28    HB3  ASN 110           HB1      ASN 110  -1.270  -9.643   4.532
   29   HD21  ASN 110          HD21      ASN 110   0.276 -10.652   5.783
   30   HD22  ASN 110          HD22      ASN 110  -0.140 -11.666   7.115
   31    HA   PRO 111           HA       PRO 111  -2.090  -4.456   3.730
   32    HB2  PRO 111           HB2      PRO 111   0.346  -3.295   3.568
   33    HB3  PRO 111           HB1      PRO 111  -0.772  -3.033   4.901
   34    HG2  PRO 111           HG2      PRO 111   1.555  -4.919   4.744
   35    HG3  PRO 111           HG1      PRO 111   1.106  -3.808   6.055
   36    HD2  PRO 111           HD2      PRO 111   0.507  -6.406   6.195
   37    HD3  PRO 111           HD1      PRO 111  -0.633  -5.175   6.781
   38    H    ALA 112           HN       ALA 112   0.001  -7.053   3.193
   39    HA   ALA 112           HA       ALA 112   0.644  -6.271   0.461
   40    HB1  ALA 112           HB1      ALA 112   1.222  -8.957   1.653
   41    HB2  ALA 112           HB2      ALA 112   2.179  -7.546   2.091
   42    HB3  ALA 112           HB3      ALA 112   2.112  -8.074   0.410
   43    H    ARG 113           HN       ARG 113  -1.182  -8.727   2.195
   44    HA   ARG 113           HA       ARG 113  -2.316  -9.859  -0.187
   45    HB2  ARG 113           HB2      ARG 113  -2.517 -10.338   2.737
   46    HB3  ARG 113           HB1      ARG 113  -3.836 -10.908   1.730
   47    HG2  ARG 113           HG2      ARG 113  -2.256 -12.687   2.055
   48    HG3  ARG 113           HG1      ARG 113  -2.211 -12.172   0.368
   49    HD2  ARG 113           HD2      ARG 113  -0.235 -10.758   0.926
   50    HD3  ARG 113           HD1      ARG 113  -0.248 -11.460   2.544
   51    HE   ARG 113           HE       ARG 113  -0.176 -13.606   0.847
   52   HH11  ARG 113          HH11      ARG 113   1.802 -10.782   1.362
   53   HH12  ARG 113          HH12      ARG 113   3.265 -11.559   0.854
   54   HH21  ARG 113          HH21      ARG 113   1.742 -14.633   0.178
   55   HH22  ARG 113          HH22      ARG 113   3.231 -13.746   0.182
   56    H    TYR 114           HN       TYR 114  -3.668  -8.054   2.576
   57    HA   TYR 114           HA       TYR 114  -6.264  -7.836   1.711
   58    HB2  TYR 114           HB2      TYR 114  -6.523  -6.635   3.578
   59    HB3  TYR 114           HB1      TYR 114  -4.804  -6.840   3.840
   60    HD1  TYR 114           HD1      TYR 114  -7.012  -4.536   1.841
   61    HD2  TYR 114           HD2      TYR 114  -3.687  -4.924   4.480
   62    HE1  TYR 114           HE1      TYR 114  -6.744  -2.095   1.862
   63    HE2  TYR 114           HE2      TYR 114  -3.421  -2.488   4.515
   64    HH   TYR 114           HH       TYR 114  -5.780  -0.359   3.295
   65    H    CYS 115           HN       CYS 115  -3.470  -6.033   0.594
   66    HA   CYS 115           HA       CYS 115  -5.161  -4.214  -0.887
   67    HB2  CYS 115           HB2      CYS 115  -2.131  -4.440  -0.914
   68    HB3  CYS 115           HB1      CYS 115  -3.099  -3.189  -1.689
   69    H    CYS 116           HN       CYS 116  -3.196  -7.047  -1.533
   70    HA   CYS 116           HA       CYS 116  -3.036  -6.969  -4.295
   71    HB2  CYS 116           HB2      CYS 116  -1.992  -8.737  -2.943
   72    HB3  CYS 116           HB1      CYS 116  -3.573  -9.367  -2.511
   73    H    LEU 117           HN       LEU 117  -5.730  -7.818  -2.206
   74    HA   LEU 117           HA       LEU 117  -7.459  -8.586  -4.357
   75    HB2  LEU 117           HB2      LEU 117  -7.841  -8.140  -1.426
   76    HB3  LEU 117           HB1      LEU 117  -9.164  -8.547  -2.484
   77    HG   LEU 117           HG       LEU 117  -6.725 -10.262  -2.033
   78   HD11  LEU 117          HD11      LEU 117  -8.113 -10.136  -0.037
   79   HD12  LEU 117          HD12      LEU 117  -8.236 -11.726  -0.788
   80   HD13  LEU 117          HD13      LEU 117  -9.539 -10.555  -0.988
   81   HD21  LEU 117          HD21      LEU 117  -7.664 -10.600  -4.239
   82   HD22  LEU 117          HD22      LEU 117  -9.280 -10.776  -3.553
   83   HD23  LEU 117          HD23      LEU 117  -8.039 -11.983  -3.211
   84    H    SER 118           HN       SER 118  -7.570  -5.953  -1.946
   85    HA   SER 118           HA       SER 118  -9.292  -4.433  -3.759
   86    HB2  SER 118           HB2      SER 118  -8.726  -4.159  -0.805
   87    HB3  SER 118           HB1      SER 118  -9.703  -3.018  -1.723
   88    HG   SER 118           HG       SER 118 -10.216  -5.764  -1.260
   89    H    GLY 119           HN       GLY 119  -6.539  -3.800  -1.550
   90    HA2  GLY 119           HA2      GLY 119  -4.584  -2.717  -2.654
   91    HA3  GLY 119           HA1      GLY 119  -5.751  -1.625  -3.392
   92    H    CYS 120           HN       CYS 120  -3.581  -0.656  -1.916
   93    HA   CYS 120           HA       CYS 120  -4.846   0.242   0.594
   94    HB2  CYS 120           HB2      CYS 120  -2.056   0.944   0.430
   95    HB3  CYS 120           HB1      CYS 120  -2.903   0.060   1.687
   96    H    THR 121           HN       THR 121  -4.158   2.398   1.321
   97    HA   THR 121           HA       THR 121  -4.284   4.276  -0.929
   98    HB   THR 121           HB       THR 121  -5.097   5.921   0.614
   99    HG1  THR 121           HG1      THR 121  -5.136   4.125   2.774
  100   HG21  THR 121          HG21      THR 121  -6.620   4.154  -0.257
  101   HG22  THR 121          HG22      THR 121  -7.196   5.010   1.169
  102   HG23  THR 121          HG23      THR 121  -6.526   3.381   1.319
  103    H    GLN 122           HN       GLN 122  -2.977   6.165  -0.844
  104    HA   GLN 122           HA       GLN 122  -0.283   5.655  -0.184
  105    HB2  GLN 122           HB2      GLN 122  -1.860   8.011  -1.087
  106    HB3  GLN 122           HB1      GLN 122  -0.321   8.348  -0.313
  107    HG2  GLN 122           HG2      GLN 122   0.864   7.063  -1.923
  108    HG3  GLN 122           HG1      GLN 122  -0.630   6.427  -2.595
  109   HE21  GLN 122          HE21      GLN 122   1.553   7.895  -3.878
  110   HE22  GLN 122          HE22      GLN 122   0.829   9.283  -4.607
  111    H    GLN 123           HN       GLN 123  -2.876   6.262   1.837
  112    HA   GLN 123           HA       GLN 123  -1.257   7.573   3.859
  113    HB2  GLN 123           HB2      GLN 123  -4.120   6.840   3.579
  114    HB3  GLN 123           HB1      GLN 123  -3.457   6.904   5.207
  115    HG2  GLN 123           HG2      GLN 123  -4.485   9.018   4.557
  116    HG3  GLN 123           HG1      GLN 123  -2.763   9.196   4.867
  117   HE21  GLN 123          HE21      GLN 123  -1.370   9.599   3.150
  118   HE22  GLN 123          HE22      GLN 123  -1.939  10.147   1.614
  119    H    ASP 124           HN       ASP 124  -2.990   4.480   3.407
  120    HA   ASP 124           HA       ASP 124  -2.000   3.164   5.659
  121    HB2  ASP 124           HB2      ASP 124  -3.748   2.278   3.995
  122    HB3  ASP 124           HB1      ASP 124  -2.393   1.830   2.968
  123    H    LEU 125           HN       LEU 125  -0.776   3.119   2.335
  124    HA   LEU 125           HA       LEU 125   1.583   1.747   2.799
  125    HB2  LEU 125           HB2      LEU 125   0.985   3.832   0.693
  126    HB3  LEU 125           HB1      LEU 125   2.353   2.774   0.674
  127    HG   LEU 125           HG       LEU 125  -0.032   1.215   0.941
  128   HD11  LEU 125          HD11      LEU 125  -1.393   1.946  -0.715
  129   HD12  LEU 125          HD12      LEU 125  -0.051   2.569  -1.666
  130   HD13  LEU 125          HD13      LEU 125  -0.678   3.509  -0.319
  131   HD21  LEU 125          HD21      LEU 125   2.325   0.748  -0.017
  132   HD22  LEU 125          HD22      LEU 125   1.661   1.456  -1.498
  133   HD23  LEU 125          HD23      LEU 125   0.919   0.016  -0.790
  134    H    LEU 126           HN       LEU 126   0.816   5.147   3.295
  135    HA   LEU 126           HA       LEU 126   3.437   6.119   3.612
  136    HB2  LEU 126           HB2      LEU 126   0.723   7.016   4.293
  137    HB3  LEU 126           HB1      LEU 126   1.963   7.624   5.368
  138    HG   LEU 126           HG       LEU 126   1.959   7.952   2.370
  139   HD11  LEU 126          HD11      LEU 126   1.381  10.007   4.502
  140   HD12  LEU 126          HD12      LEU 126   0.145   9.186   3.546
  141   HD13  LEU 126          HD13      LEU 126   1.322  10.236   2.754
  142   HD21  LEU 126          HD21      LEU 126   3.739   9.131   4.503
  143   HD22  LEU 126          HD22      LEU 126   3.767   9.561   2.793
  144   HD23  LEU 126          HD23      LEU 126   4.205   7.930   3.301
  145    H    THR 127           HN       THR 127   1.302   4.347   5.719
  146    HA   THR 127           HA       THR 127   3.109   4.688   7.989
  147    HB   THR 127           HB       THR 127   1.383   4.248   9.362
  148    HG1  THR 127           HG1      THR 127  -0.187   2.537   8.804
  149   HG21  THR 127          HG21      THR 127   0.433   5.766   7.516
  150   HG22  THR 127          HG22      THR 127  -0.712   4.970   8.595
  151   HG23  THR 127          HG23      THR 127  -0.437   4.332   6.974
  152    H    LEU 128           HN       LEU 128   2.830   2.605   5.382
  153    HA   LEU 128           HA       LEU 128   3.565   0.226   6.893
  154    HB2  LEU 128           HB2      LEU 128   3.124   0.609   3.940
  155    HB3  LEU 128           HB1      LEU 128   3.399  -0.916   4.741
  156    HG   LEU 128           HG       LEU 128   1.073   0.844   5.442
  157   HD11  LEU 128          HD11      LEU 128   0.792  -1.516   3.657
  158   HD12  LEU 128          HD12      LEU 128   1.257   0.036   2.965
  159   HD13  LEU 128          HD13      LEU 128  -0.263  -0.117   3.846
  160   HD21  LEU 128          HD21      LEU 128   1.453  -0.739   7.113
  161   HD22  LEU 128          HD22      LEU 128   1.863  -1.982   5.936
  162   HD23  LEU 128          HD23      LEU 128   0.191  -1.452   6.104
  163    H    CYS 129           HN       CYS 129   5.018   2.769   5.072
  164    HA   CYS 129           HA       CYS 129   7.390   1.433   4.298
  165    HB2  CYS 129           HB2      CYS 129   8.340   3.654   3.955
  166    HB3  CYS 129           HB1      CYS 129   6.708   3.572   3.307
  167    HA   PRO 130           HA       PRO 130   9.620   1.241   8.097
  168    HB2  PRO 130           HB2      PRO 130  12.160   1.454   6.724
  169    HB3  PRO 130           HB1      PRO 130  11.387   0.016   7.391
  170    HG2  PRO 130           HG2      PRO 130  11.730   0.427   4.717
  171    HG3  PRO 130           HG1      PRO 130  10.408  -0.542   5.395
  172    HD2  PRO 130           HD2      PRO 130  10.376   2.301   4.439
  173    HD3  PRO 130           HD1      PRO 130   9.180   1.014   4.168
  174    H    TYR 131           HN       TYR 131   9.403   4.019   6.404
  175    HA   TYR 131           HA       TYR 131  11.077   5.471   8.338
  176    HB2  TYR 131           HB2      TYR 131  10.827   6.017   5.376
  177    HB3  TYR 131           HB1      TYR 131  11.535   7.149   6.520
  178    HD1  TYR 131           HD2      TYR 131  11.938   3.814   4.976
  179    HD2  TYR 131           HD1      TYR 131  13.763   6.877   7.297
  180    HE1  TYR 131           HE2      TYR 131  14.117   2.704   4.715
  181    HE2  TYR 131           HE1      TYR 131  15.947   5.776   7.041
  182    HH   TYR 131           HH       TYR 131  16.841   3.546   6.563
  183    H2   PRO  25           HT1      PRO  25  -1.231  16.736  -4.294
  184    H3   PRO  25           HT2      PRO  25  -2.094  18.026  -3.789
  185    HA   PRO  25           HA       PRO  25  -3.777  17.599  -5.009
  186    HB2  PRO  25           HB2      PRO  25  -2.904  16.445  -7.427
  187    HB3  PRO  25           HB1      PRO  25  -3.442  18.113  -7.173
  188    HG2  PRO  25           HG2      PRO  25  -0.685  16.998  -7.211
  189    HG3  PRO  25           HG1      PRO  25  -1.265  18.589  -7.739
  190    HD2  PRO  25           HD2      PRO  25   0.091  18.334  -5.460
  191    HD3  PRO  25           HD1      PRO  25  -1.292  19.439  -5.564
  192    H    THR  26           HN       THR  26  -4.696  15.579  -6.346
  193    HA   THR  26           HA       THR  26  -5.311  13.403  -6.290
  194    HB   THR  26           HB       THR  26  -3.677  11.693  -6.308
  195    HG1  THR  26           HG1      THR  26  -2.232  11.797  -4.769
  196   HG21  THR  26          HG21      THR  26  -1.965  12.544  -7.834
  197   HG22  THR  26          HG22      THR  26  -2.362  14.196  -7.367
  198   HG23  THR  26          HG23      THR  26  -3.549  13.214  -8.226
  199    HA   PRO  27           HA       PRO  27  -6.023  12.689  -1.930
  200    HB2  PRO  27           HB2      PRO  27  -8.300  11.319  -2.204
  201    HB3  PRO  27           HB1      PRO  27  -8.215  13.035  -2.616
  202    HG2  PRO  27           HG2      PRO  27  -8.413  10.688  -4.392
  203    HG3  PRO  27           HG1      PRO  27  -8.879  12.369  -4.693
  204    HD2  PRO  27           HD2      PRO  27  -6.451  11.010  -5.472
  205    HD3  PRO  27           HD1      PRO  27  -6.952  12.674  -5.841
  206    H    GLU  28           HN       GLU  28  -7.304  10.376  -1.034
  207    HA   GLU  28           HA       GLU  28  -5.114   8.505  -1.138
  208    HB2  GLU  28           HB2      GLU  28  -6.722   7.139   0.362
  209    HB3  GLU  28           HB1      GLU  28  -5.966   8.589   0.985
  210    HG2  GLU  28           HG2      GLU  28  -7.973   9.843   0.718
  211    HG3  GLU  28           HG1      GLU  28  -8.734   8.527  -0.172
  212    H    MET  29           HN       MET  29  -5.308   8.114  -3.375
  213    HA   MET  29           HA       MET  29  -7.595   6.646  -4.360
  214    HB2  MET  29           HB2      MET  29  -5.893   8.242  -5.651
  215    HB3  MET  29           HB1      MET  29  -5.043   6.713  -5.863
  216    HG2  MET  29           HG2      MET  29  -7.053   5.738  -6.864
  217    HG3  MET  29           HG1      MET  29  -7.868   7.294  -6.703
  218    HE1  MET  29           HE1      MET  29  -8.418   7.045  -9.361
  219    HE2  MET  29           HE2      MET  29  -7.491   5.546  -9.410
  220    HE3  MET  29           HE3      MET  29  -7.161   6.826 -10.578
  221    H    ARG  30           HN       ARG  30  -7.898   4.684  -3.970
  222    HA   ARG  30           HA       ARG  30  -5.852   2.941  -2.952
  223    HB2  ARG  30           HB2      ARG  30  -8.779   2.951  -3.170
  224    HB3  ARG  30           HB1      ARG  30  -8.032   1.370  -3.284
  225    HG2  ARG  30           HG2      ARG  30  -6.709   2.443  -1.175
  226    HG3  ARG  30           HG1      ARG  30  -8.310   3.165  -1.004
  227    HD2  ARG  30           HD2      ARG  30  -9.318   0.964  -1.091
  228    HD3  ARG  30           HD1      ARG  30  -7.727   0.237  -1.303
  229    HE   ARG  30           HE       ARG  30  -7.725   1.782   1.029
  230   HH11  ARG  30          HH11      ARG  30  -9.115  -1.157  -0.219
  231   HH12  ARG  30          HH12      ARG  30  -9.230  -1.916   1.335
  232   HH21  ARG  30          HH21      ARG  30  -7.874   0.792   3.081
  233   HH22  ARG  30          HH22      ARG  30  -8.526  -0.807   3.210
  234    H    GLU  31           HN       GLU  31  -5.239   0.936  -3.874
  235    HA   GLU  31           HA       GLU  31  -6.096   0.129  -6.468
  236    HB2  GLU  31           HB2      GLU  31  -4.036   0.474  -7.688
  237    HB3  GLU  31           HB1      GLU  31  -4.622   2.021  -7.089
  238    HG2  GLU  31           HG2      GLU  31  -3.014   1.998  -5.310
  239    HG3  GLU  31           HG1      GLU  31  -2.502   0.374  -5.754
  240    H    LYS  32           HN       LYS  32  -5.690  -1.874  -6.876
  241    HA   LYS  32           HA       LYS  32  -5.065  -3.615  -4.838
  242    HB2  LYS  32           HB2      LYS  32  -4.949  -4.170  -7.793
  243    HB3  LYS  32           HB1      LYS  32  -5.225  -5.331  -6.502
  244    HG2  LYS  32           HG2      LYS  32  -7.255  -3.990  -5.891
  245    HG3  LYS  32           HG1      LYS  32  -7.030  -3.119  -7.396
  246    HD2  LYS  32           HD2      LYS  32  -7.149  -5.262  -8.623
  247    HD3  LYS  32           HD1      LYS  32  -7.477  -6.087  -7.102
  248    HE2  LYS  32           HE2      LYS  32  -9.484  -4.713  -6.825
  249    HE3  LYS  32           HE1      LYS  32  -9.168  -3.947  -8.376
  250    HZ1  LYS  32           HZ1      LYS  32 -10.790  -5.700  -8.616
  251    HZ2  LYS  32           HZ2      LYS  32  -9.731  -6.829  -7.934
  252    HZ3  LYS  32           HZ3      LYS  32  -9.369  -6.128  -9.430
  253    H    LEU  33           HN       LEU  33  -3.287  -4.054  -3.907
  254    HA   LEU  33           HA       LEU  33  -0.739  -3.917  -5.353
  255    HB2  LEU  33           HB2      LEU  33  -1.280  -3.526  -2.453
  256    HB3  LEU  33           HB1      LEU  33   0.234  -3.416  -3.274
  257    HG   LEU  33           HG       LEU  33  -2.079  -1.551  -3.524
  258   HD11  LEU  33          HD11      LEU  33  -0.462  -1.265  -1.656
  259   HD12  LEU  33          HD12      LEU  33  -0.515   0.110  -2.753
  260   HD13  LEU  33          HD13      LEU  33   0.808  -1.046  -2.849
  261   HD21  LEU  33          HD21      LEU  33  -1.091  -0.476  -5.352
  262   HD22  LEU  33          HD22      LEU  33  -0.945  -2.192  -5.749
  263   HD23  LEU  33          HD23      LEU  33   0.447  -1.306  -5.124
  264    H    CYS  34           HN       CYS  34  -0.388  -6.004  -5.948
  265    HA   CYS  34           HA       CYS  34  -0.748  -8.123  -3.977
  266    HB2  CYS  34           HB2      CYS  34  -0.225  -8.102  -6.924
  267    HB3  CYS  34           HB1      CYS  34  -0.179  -9.583  -5.984
  268    H    GLY  35           HN       GLY  35   1.030  -7.294  -2.699
  269    HA2  GLY  35           HA2      GLY  35   3.144  -7.583  -1.850
  270    HA3  GLY  35           HA1      GLY  35   3.421  -8.763  -3.112
  271    H    HIS  36           HN       HIS  36   4.172  -7.965  -5.231
  272    HA   HIS  36           HA       HIS  36   6.167  -6.059  -4.989
  273    HB2  HIS  36           HB2      HIS  36   5.989  -7.866  -6.755
  274    HB3  HIS  36           HB1      HIS  36   4.892  -6.783  -7.611
  275    HD1  HIS  36           HD1      HIS  36   6.657  -6.506  -9.557
  276    HD2  HIS  36           HD2      HIS  36   7.891  -5.220  -5.801
  277    HE1  HIS  36           HE1      HIS  36   8.722  -5.106  -9.941
  278    H    HIS  37           HN       HIS  37   2.985  -5.732  -6.663
  279    HA   HIS  37           HA       HIS  37   3.199  -3.019  -7.306
  280    HB2  HIS  37           HB2      HIS  37   0.781  -4.547  -6.283
  281    HB3  HIS  37           HB1      HIS  37   0.707  -2.888  -6.870
  282    HD1  HIS  37           HD1      HIS  37  -0.433  -3.012  -9.067
  283    HD2  HIS  37           HD2      HIS  37   2.330  -6.056  -8.542
  284    HE1  HIS  37           HE1      HIS  37  -0.428  -4.319 -11.213
  285    H    PHE  38           HN       PHE  38   2.160  -4.694  -4.440
  286    HA   PHE  38           HA       PHE  38   1.525  -2.547  -2.838
  287    HB2  PHE  38           HB2      PHE  38   0.848  -4.711  -2.159
  288    HB3  PHE  38           HB1      PHE  38   2.483  -5.324  -2.210
  289    HD1  PHE  38           HD2      PHE  38   0.722  -2.481  -0.672
  290    HD2  PHE  38           HD1      PHE  38   3.354  -5.783  -0.133
  291    HE1  PHE  38           HE2      PHE  38   0.986  -1.872   1.700
  292    HE2  PHE  38           HE1      PHE  38   3.614  -5.197   2.251
  293    HZ   PHE  38           HZ       PHE  38   2.432  -3.235   3.171
  294    H    VAL  39           HN       VAL  39   4.563  -3.895  -3.726
  295    HA   VAL  39           HA       VAL  39   6.088  -2.434  -1.813
  296    HB   VAL  39           HB       VAL  39   6.645  -4.214  -4.110
  297   HG11  VAL  39          HG11      VAL  39   7.959  -2.695  -5.171
  298   HG12  VAL  39          HG12      VAL  39   9.125  -3.235  -3.963
  299   HG13  VAL  39          HG13      VAL  39   8.234  -1.740  -3.713
  300   HG21  VAL  39          HG21      VAL  39   7.093  -4.158  -1.358
  301   HG22  VAL  39          HG22      VAL  39   8.695  -4.026  -2.087
  302   HG23  VAL  39          HG23      VAL  39   7.643  -5.379  -2.505
  303    H    ARG  40           HN       ARG  40   5.587  -2.110  -5.304
  304    HA   ARG  40           HA       ARG  40   6.771   0.274  -5.879
  305    HB2  ARG  40           HB2      ARG  40   4.035  -0.255  -6.960
  306    HB3  ARG  40           HB1      ARG  40   5.463   0.357  -7.785
  307    HG2  ARG  40           HG2      ARG  40   6.470  -1.931  -7.488
  308    HG3  ARG  40           HG1      ARG  40   4.870  -2.465  -6.971
  309    HD2  ARG  40           HD2      ARG  40   5.419  -1.072  -9.540
  310    HD3  ARG  40           HD1      ARG  40   5.363  -2.822  -9.391
  311    HE   ARG  40           HE       ARG  40   2.992  -1.836  -8.348
  312   HH11  ARG  40          HH11      ARG  40   4.633  -1.855 -11.421
  313   HH12  ARG  40          HH12      ARG  40   3.171  -1.782 -12.347
  314   HH21  ARG  40          HH21      ARG  40   1.063  -1.738  -9.560
  315   HH22  ARG  40          HH22      ARG  40   1.143  -1.714 -11.290
  316    H    ALA  41           HN       ALA  41   3.241   0.070  -5.181
  317    HA   ALA  41           HA       ALA  41   2.865   2.793  -4.899
  318    HB1  ALA  41           HB1      ALA  41   0.829   2.276  -3.731
  319    HB2  ALA  41           HB2      ALA  41   1.408   0.667  -3.279
  320    HB3  ALA  41           HB3      ALA  41   1.059   1.044  -4.973
  321    H    LEU  42           HN       LEU  42   3.820   0.373  -2.418
  322    HA   LEU  42           HA       LEU  42   3.770   1.986  -0.191
  323    HB2  LEU  42           HB2      LEU  42   4.773  -0.515  -0.791
  324    HB3  LEU  42           HB1      LEU  42   6.216   0.374  -0.370
  325    HG   LEU  42           HG       LEU  42   3.781   0.089   1.390
  326   HD11  LEU  42          HD11      LEU  42   4.633  -1.831   2.106
  327   HD12  LEU  42          HD12      LEU  42   6.157  -1.028   2.490
  328   HD13  LEU  42          HD13      LEU  42   5.902  -1.717   0.885
  329   HD21  LEU  42          HD21      LEU  42   4.650   2.000   2.216
  330   HD22  LEU  42          HD22      LEU  42   6.228   1.710   1.484
  331   HD23  LEU  42          HD23      LEU  42   5.790   0.897   2.990
  332    H    VAL  43           HN       VAL  43   6.183   1.782  -2.717
  333    HA   VAL  43           HA       VAL  43   7.997   3.671  -1.601
  334    HB   VAL  43           HB       VAL  43   7.923   3.261  -4.566
  335   HG11  VAL  43          HG11      VAL  43  10.233   3.429  -4.398
  336   HG12  VAL  43          HG12      VAL  43  10.239   2.825  -2.738
  337   HG13  VAL  43          HG13      VAL  43   9.700   4.477  -3.077
  338   HG21  VAL  43          HG21      VAL  43   7.385   1.065  -3.912
  339   HG22  VAL  43          HG22      VAL  43   8.543   1.123  -2.583
  340   HG23  VAL  43          HG23      VAL  43   9.116   1.088  -4.250
  341    H    ARG  44           HN       ARG  44   6.055   3.853  -4.534
  342    HA   ARG  44           HA       ARG  44   6.056   6.411  -5.278
  343    HB2  ARG  44           HB2      ARG  44   3.479   4.889  -4.827
  344    HB3  ARG  44           HB1      ARG  44   3.760   6.117  -6.036
  345    HG2  ARG  44           HG2      ARG  44   5.691   4.255  -6.603
  346    HG3  ARG  44           HG1      ARG  44   4.312   3.276  -6.097
  347    HD2  ARG  44           HD2      ARG  44   3.236   5.247  -7.742
  348    HD3  ARG  44           HD1      ARG  44   4.729   4.755  -8.532
  349    HE   ARG  44           HE       ARG  44   3.458   2.418  -7.846
  350   HH11  ARG  44          HH11      ARG  44   2.717   5.212  -9.792
  351   HH12  ARG  44          HH12      ARG  44   1.681   4.345 -10.875
  352   HH21  ARG  44          HH21      ARG  44   2.093   1.267  -9.268
  353   HH22  ARG  44          HH22      ARG  44   1.326   2.103 -10.577
  354    H    VAL  45           HN       VAL  45   4.349   5.102  -2.577
  355    HA   VAL  45           HA       VAL  45   3.008   7.443  -1.700
  356    HB   VAL  45           HB       VAL  45   3.629   4.864  -0.269
  357   HG11  VAL  45          HG11      VAL  45   2.028   7.233   0.454
  358   HG12  VAL  45          HG12      VAL  45   2.968   6.130   1.457
  359   HG13  VAL  45          HG13      VAL  45   1.381   5.646   0.871
  360   HG21  VAL  45          HG21      VAL  45   0.908   5.105  -1.090
  361   HG22  VAL  45          HG22      VAL  45   2.095   3.863  -1.474
  362   HG23  VAL  45          HG23      VAL  45   1.971   5.304  -2.483
  363    H    CYS  46           HN       CYS  46   5.562   5.481  -0.212
  364    HA   CYS  46           HA       CYS  46   6.449   7.847   1.323
  365    HB2  CYS  46           HB2      CYS  46   5.271   5.903   2.515
  366    HB3  CYS  46           HB1      CYS  46   6.709   4.969   2.163
  367    H    GLY  47           HN       GLY  47   7.454   4.659   0.209
  368    HA2  GLY  47           HA2      GLY  47   9.521   4.935  -1.358
  369    HA3  GLY  47           HA1      GLY  47  10.258   5.575   0.104
  370    H    GLY  48           HN       GLY  48  11.370   4.161   1.280
  371    HA2  GLY  48           HA2      GLY  48  10.688   1.796   2.329
  372    HA3  GLY  48           HA1      GLY  48  11.091   1.334   0.688
  373    HA   PRO  49           HA       PRO  49  15.072   1.047   2.868
  374    HB2  PRO  49           HB2      PRO  49  16.013  -1.077   1.554
  375    HB3  PRO  49           HB1      PRO  49  14.746  -1.244   2.772
  376    HG2  PRO  49           HG2      PRO  49  14.478  -1.155  -0.203
  377    HG3  PRO  49           HG1      PRO  49  13.729  -2.274   0.955
  378    HD2  PRO  49           HD2      PRO  49  12.472  -0.082  -0.049
  379    HD3  PRO  49           HD1      PRO  49  12.083  -0.769   1.521
  380    H    ARG  50           HN       ARG  50  14.587   2.995   0.852
  381    HA   ARG  50           HA       ARG  50  15.698   4.382  -0.515
  382    HB2  ARG  50           HB2      ARG  50  18.007   2.550  -0.120
  383    HB3  ARG  50           HB1      ARG  50  18.067   4.212  -0.654
  384    HG2  ARG  50           HG2      ARG  50  17.289   4.971   1.509
  385    HG3  ARG  50           HG1      ARG  50  17.141   3.301   2.056
  386    HD2  ARG  50           HD2      ARG  50  19.549   2.996   1.794
  387    HD3  ARG  50           HD1      ARG  50  19.703   4.656   1.219
  388    HE   ARG  50           HE       ARG  50  18.526   4.943   3.639
  389   HH11  ARG  50          HH11      ARG  50  21.382   3.264   2.553
  390   HH12  ARG  50          HH12      ARG  50  22.226   3.468   4.052
  391   HH21  ARG  50          HH21      ARG  50  19.630   5.214   5.613
  392   HH22  ARG  50          HH22      ARG  50  21.228   4.573   5.793
  393    H    TRP  51           HN       TRP  51  15.755   0.972  -1.189
  394    HA   TRP  51           HA       TRP  51  15.646  -0.234  -3.083
  395    HB2  TRP  51           HB2      TRP  51  14.768   2.309  -4.404
  396    HB3  TRP  51           HB1      TRP  51  14.322   0.656  -4.781
  397    HD1  TRP  51           HD1      TRP  51  13.701   3.308  -2.059
  398    HE1  TRP  51           HE1      TRP  51  11.529   2.672  -0.843
  399    HE3  TRP  51           HE3      TRP  51  12.890  -1.134  -4.287
  400    HZ2  TRP  51           HZ2      TRP  51   9.708   0.495  -0.848
  401    HZ3  TRP  51           HZ3      TRP  51  10.934  -2.460  -3.626
  402    HH2  TRP  51           HH2      TRP  51   9.359  -1.617  -1.929
  403    H    SER  52           HN       SER  52  18.015   1.847  -2.592
  404    HA   SER  52           HA       SER  52  19.970   2.423  -3.592
  405    HB2  SER  52           HB2      SER  52  19.369  -0.164  -5.027
  406    HB3  SER  52           HB1      SER  52  20.904   0.693  -5.167
  407    HG   SER  52           HG       SER  52  21.463  -0.093  -3.309
  408    H    THR  53           HN       THR  53  19.222   0.937  -6.596
  409    HA   THR  53           HA       THR  53  19.103   1.740  -8.711
  410    HB   THR  53           HB       THR  53  17.343   3.510  -9.089
  411    HG1  THR  53           HG1      THR  53  16.522   3.164  -6.433
  412   HG21  THR  53          HG21      THR  53  16.577   1.094  -7.447
  413   HG22  THR  53          HG22      THR  53  16.813   1.135  -9.195
  414   HG23  THR  53          HG23      THR  53  15.482   2.030  -8.462
  415    H    GLU  54           HN       GLU  54  18.598   4.869  -7.132
  416    HA   GLU  54           HA       GLU  54  20.586   6.076  -8.840
  417    HB2  GLU  54           HB2      GLU  54  18.908   7.267  -6.626
  418    HB3  GLU  54           HB1      GLU  54  19.904   8.179  -7.750
  419    HG2  GLU  54           HG2      GLU  54  17.530   6.480  -8.480
  420    HG3  GLU  54           HG1      GLU  54  17.554   8.241  -8.378
  421    H    ALA  55           HN       ALA  55  21.464   4.108  -6.828
  422    HA   ALA  55           HA       ALA  55  22.819   5.558  -4.757
  423    HB1  ALA  55           HB1      ALA  55  23.167   2.710  -5.690
  424    HB2  ALA  55           HB2      ALA  55  22.103   3.259  -4.396
  425    HB3  ALA  55           HB3      ALA  55  23.852   3.402  -4.219
  Start of MODEL   15
    1    H1   ALA 106           HT1      ALA 106  -7.228  -1.542  17.093
    2    H2   ALA 106           HT2      ALA 106  -6.413  -2.869  16.432
    3    H3   ALA 106           HT3      ALA 106  -7.417  -1.921  15.455
    4    HA   ALA 106           HA       ALA 106  -5.962  -0.028  15.725
    5    HB1  ALA 106           HB1      ALA 106  -3.789  -0.317  16.823
    6    HB2  ALA 106           HB2      ALA 106  -4.257  -1.947  17.308
    7    HB3  ALA 106           HB3      ALA 106  -5.128  -0.553  17.944
    8    H    ALA 107           HN       ALA 107  -4.287  -3.178  15.612
    9    HA   ALA 107           HA       ALA 107  -3.140  -2.477  13.035
   10    HB1  ALA 107           HB1      ALA 107  -2.748  -4.946  14.724
   11    HB2  ALA 107           HB2      ALA 107  -1.726  -3.508  14.750
   12    HB3  ALA 107           HB3      ALA 107  -1.813  -4.502  13.295
   13    H    ALA 108           HN       ALA 108  -3.372  -3.737  11.147
   14    HA   ALA 108           HA       ALA 108  -5.908  -5.223  11.041
   15    HB1  ALA 108           HB1      ALA 108  -6.364  -4.151   9.149
   16    HB2  ALA 108           HB2      ALA 108  -4.801  -4.587   8.455
   17    HB3  ALA 108           HB3      ALA 108  -4.949  -3.141   9.458
   18    H    THR 109           HN       THR 109  -5.573  -6.508   8.638
   19    HA   THR 109           HA       THR 109  -4.013  -8.781   9.420
   20    HB   THR 109           HB       THR 109  -6.189  -8.968   8.233
   21    HG1  THR 109           HG1      THR 109  -5.505 -10.672   6.926
   22   HG21  THR 109          HG21      THR 109  -5.378  -7.006   6.611
   23   HG22  THR 109          HG22      THR 109  -6.581  -8.202   6.123
   24   HG23  THR 109          HG23      THR 109  -4.900  -8.389   5.622
   25    H    ASN 110           HN       ASN 110  -3.341  -9.355   6.511
   26    HA   ASN 110           HA       ASN 110  -0.686  -8.247   6.581
   27    HB2  ASN 110           HB2      ASN 110  -2.056 -10.012   4.536
   28    HB3  ASN 110           HB1      ASN 110  -0.350  -9.578   4.506
   29   HD21  ASN 110          HD21      ASN 110   0.303 -11.710   4.671
   30   HD22  ASN 110          HD22      ASN 110   0.161 -12.611   6.137
   31    HA   PRO 111           HA       PRO 111  -1.991  -4.673   4.235
   32    HB2  PRO 111           HB2      PRO 111   0.396  -3.481   4.054
   33    HB3  PRO 111           HB1      PRO 111  -0.554  -3.476   5.538
   34    HG2  PRO 111           HG2      PRO 111   1.745  -5.248   4.778
   35    HG3  PRO 111           HG1      PRO 111   1.442  -4.412   6.314
   36    HD2  PRO 111           HD2      PRO 111   0.876  -7.026   5.959
   37    HD3  PRO 111           HD1      PRO 111  -0.104  -5.977   7.006
   38    H    ALA 112           HN       ALA 112   0.091  -7.161   3.247
   39    HA   ALA 112           HA       ALA 112   0.537  -6.024   0.596
   40    HB1  ALA 112           HB1      ALA 112   1.384  -8.781   1.341
   41    HB2  ALA 112           HB2      ALA 112   2.215  -7.400   2.052
   42    HB3  ALA 112           HB3      ALA 112   2.180  -7.597   0.300
   43    H    ARG 113           HN       ARG 113  -1.043  -8.786   2.115
   44    HA   ARG 113           HA       ARG 113  -2.109  -9.802  -0.325
   45    HB2  ARG 113           HB2      ARG 113  -2.779 -10.418   2.542
   46    HB3  ARG 113           HB1      ARG 113  -3.328 -11.337   1.160
   47    HG2  ARG 113           HG2      ARG 113  -0.453 -10.968   1.952
   48    HG3  ARG 113           HG1      ARG 113  -1.433 -12.393   2.303
   49    HD2  ARG 113           HD2      ARG 113  -0.777 -11.349  -0.452
   50    HD3  ARG 113           HD1      ARG 113   0.011 -12.714   0.338
   51    HE   ARG 113           HE       ARG 113  -2.807 -13.066   0.220
   52   HH11  ARG 113          HH11      ARG 113   0.100 -13.252  -1.696
   53   HH12  ARG 113          HH12      ARG 113  -0.544 -14.431  -2.787
   54   HH21  ARG 113          HH21      ARG 113  -3.659 -14.619  -1.212
   55   HH22  ARG 113          HH22      ARG 113  -2.679 -15.210  -2.512
   56    H    TYR 114           HN       TYR 114  -3.524  -8.091   2.469
   57    HA   TYR 114           HA       TYR 114  -6.155  -8.097   1.590
   58    HB2  TYR 114           HB2      TYR 114  -6.589  -6.872   3.424
   59    HB3  TYR 114           HB1      TYR 114  -4.901  -7.148   3.810
   60    HD1  TYR 114           HD1      TYR 114  -7.017  -4.699   1.911
   61    HD2  TYR 114           HD2      TYR 114  -3.626  -5.320   4.408
   62    HE1  TYR 114           HE1      TYR 114  -6.659  -2.275   2.018
   63    HE2  TYR 114           HE2      TYR 114  -3.263  -2.899   4.534
   64    HH   TYR 114           HH       TYR 114  -3.807  -0.885   3.245
   65    H    CYS 115           HN       CYS 115  -3.482  -6.087   0.560
   66    HA   CYS 115           HA       CYS 115  -5.258  -4.306  -0.861
   67    HB2  CYS 115           HB2      CYS 115  -2.223  -4.427  -0.881
   68    HB3  CYS 115           HB1      CYS 115  -3.210  -3.226  -1.707
   69    H    CYS 116           HN       CYS 116  -3.361  -7.132  -1.544
   70    HA   CYS 116           HA       CYS 116  -3.168  -6.981  -4.316
   71    HB2  CYS 116           HB2      CYS 116  -2.124  -8.776  -2.978
   72    HB3  CYS 116           HB1      CYS 116  -3.710  -9.426  -2.597
   73    H    LEU 117           HN       LEU 117  -5.810  -8.098  -2.244
   74    HA   LEU 117           HA       LEU 117  -7.552  -8.653  -4.464
   75    HB2  LEU 117           HB2      LEU 117  -7.675  -8.857  -1.519
   76    HB3  LEU 117           HB1      LEU 117  -9.199  -8.690  -2.360
   77    HG   LEU 117           HG       LEU 117  -7.167 -10.854  -2.904
   78   HD11  LEU 117          HD11      LEU 117  -8.756 -12.344  -1.788
   79   HD12  LEU 117          HD12      LEU 117  -9.758 -10.956  -1.368
   80   HD13  LEU 117          HD13      LEU 117  -8.137 -11.109  -0.692
   81   HD21  LEU 117          HD21      LEU 117  -8.932 -11.881  -4.219
   82   HD22  LEU 117          HD22      LEU 117  -8.565 -10.269  -4.836
   83   HD23  LEU 117          HD23      LEU 117 -10.010 -10.533  -3.859
   84    H    SER 118           HN       SER 118  -7.364  -6.190  -1.906
   85    HA   SER 118           HA       SER 118  -9.391  -4.610  -3.311
   86    HB2  SER 118           HB2      SER 118  -8.287  -4.404  -0.503
   87    HB3  SER 118           HB1      SER 118  -9.464  -3.291  -1.193
   88    HG   SER 118           HG       SER 118 -10.770  -5.242  -1.578
   89    H    GLY 119           HN       GLY 119  -6.619  -3.669  -1.286
   90    HA2  GLY 119           HA2      GLY 119  -4.685  -2.726  -2.659
   91    HA3  GLY 119           HA1      GLY 119  -5.918  -1.674  -3.346
   92    H    CYS 120           HN       CYS 120  -3.556  -0.764  -1.968
   93    HA   CYS 120           HA       CYS 120  -4.719   0.262   0.532
   94    HB2  CYS 120           HB2      CYS 120  -1.889   0.848   0.189
   95    HB3  CYS 120           HB1      CYS 120  -2.736   0.218   1.585
   96    H    THR 121           HN       THR 121  -3.943   2.417   1.197
   97    HA   THR 121           HA       THR 121  -4.078   4.261  -1.092
   98    HB   THR 121           HB       THR 121  -4.957   5.920   0.359
   99    HG1  THR 121           HG1      THR 121  -5.285   5.140   2.694
  100   HG21  THR 121          HG21      THR 121  -6.498   4.182  -0.371
  101   HG22  THR 121          HG22      THR 121  -6.999   4.946   1.132
  102   HG23  THR 121          HG23      THR 121  -6.267   3.338   1.153
  103    H    GLN 122           HN       GLN 122  -2.821   6.216  -0.923
  104    HA   GLN 122           HA       GLN 122  -0.127   5.693  -0.210
  105    HB2  GLN 122           HB2      GLN 122  -1.662   8.023  -1.229
  106    HB3  GLN 122           HB1      GLN 122  -0.157   8.385  -0.395
  107    HG2  GLN 122           HG2      GLN 122   1.085   7.009  -1.912
  108    HG3  GLN 122           HG1      GLN 122  -0.395   6.445  -2.673
  109   HE21  GLN 122          HE21      GLN 122   1.890   7.776  -3.869
  110   HE22  GLN 122          HE22      GLN 122   1.289   9.217  -4.605
  111    H    GLN 123           HN       GLN 123  -2.739   6.233   1.722
  112    HA   GLN 123           HA       GLN 123  -1.257   7.629   3.789
  113    HB2  GLN 123           HB2      GLN 123  -4.051   6.506   3.656
  114    HB3  GLN 123           HB1      GLN 123  -3.370   7.218   5.100
  115    HG2  GLN 123           HG2      GLN 123  -3.100   9.346   3.928
  116    HG3  GLN 123           HG1      GLN 123  -3.790   8.622   2.475
  117   HE21  GLN 123          HE21      GLN 123  -5.717   7.049   4.033
  118   HE22  GLN 123          HE22      GLN 123  -6.939   8.164   4.533
  119    H    ASP 124           HN       ASP 124  -3.004   4.550   3.400
  120    HA   ASP 124           HA       ASP 124  -2.013   3.257   5.653
  121    HB2  ASP 124           HB2      ASP 124  -3.664   2.540   3.573
  122    HB3  ASP 124           HB1      ASP 124  -2.246   1.545   3.265
  123    H    LEU 125           HN       LEU 125  -0.798   3.170   2.315
  124    HA   LEU 125           HA       LEU 125   1.505   1.700   2.787
  125    HB2  LEU 125           HB2      LEU 125   1.007   3.834   0.698
  126    HB3  LEU 125           HB1      LEU 125   2.371   2.769   0.697
  127    HG   LEU 125           HG       LEU 125  -0.069   1.248   0.849
  128   HD11  LEU 125          HD11      LEU 125  -1.345   2.079  -0.804
  129   HD12  LEU 125          HD12      LEU 125   0.056   2.497  -1.784
  130   HD13  LEU 125          HD13      LEU 125  -0.479   3.589  -0.512
  131   HD21  LEU 125          HD21      LEU 125   2.325   0.701   0.027
  132   HD22  LEU 125          HD22      LEU 125   1.770   1.425  -1.489
  133   HD23  LEU 125          HD23      LEU 125   0.941   0.011  -0.823
  134    H    LEU 126           HN       LEU 126   0.875   5.169   3.184
  135    HA   LEU 126           HA       LEU 126   3.518   5.987   3.672
  136    HB2  LEU 126           HB2      LEU 126   0.822   7.060   4.111
  137    HB3  LEU 126           HB1      LEU 126   1.990   7.609   5.292
  138    HG   LEU 126           HG       LEU 126   2.216   7.922   2.303
  139   HD11  LEU 126          HD11      LEU 126   0.524   9.372   3.260
  140   HD12  LEU 126          HD12      LEU 126   1.935  10.313   2.778
  141   HD13  LEU 126          HD13      LEU 126   1.667   9.935   4.480
  142   HD21  LEU 126          HD21      LEU 126   4.176   9.304   2.792
  143   HD22  LEU 126          HD22      LEU 126   4.407   7.645   3.342
  144   HD23  LEU 126          HD23      LEU 126   4.027   8.915   4.506
  145    H    THR 127           HN       THR 127   1.126   4.407   5.654
  146    HA   THR 127           HA       THR 127   2.702   4.736   8.074
  147    HB   THR 127           HB       THR 127   0.896   3.975   9.287
  148    HG1  THR 127           HG1      THR 127   0.638   1.949   8.334
  149   HG21  THR 127          HG21      THR 127   0.318   5.932   7.640
  150   HG22  THR 127          HG22      THR 127  -0.934   5.197   8.635
  151   HG23  THR 127          HG23      THR 127  -0.772   4.737   6.940
  152    H    LEU 128           HN       LEU 128   2.708   2.610   5.459
  153    HA   LEU 128           HA       LEU 128   3.439   0.300   7.090
  154    HB2  LEU 128           HB2      LEU 128   3.036   0.565   4.117
  155    HB3  LEU 128           HB1      LEU 128   3.389  -0.921   4.962
  156    HG   LEU 128           HG       LEU 128   0.963   0.721   5.618
  157   HD11  LEU 128          HD11      LEU 128   0.945  -1.634   3.771
  158   HD12  LEU 128          HD12      LEU 128   1.081   0.018   3.170
  159   HD13  LEU 128          HD13      LEU 128  -0.342  -0.472   4.090
  160   HD21  LEU 128          HD21      LEU 128   1.398  -0.822   7.305
  161   HD22  LEU 128          HD22      LEU 128   1.913  -2.046   6.153
  162   HD23  LEU 128          HD23      LEU 128   0.207  -1.630   6.281
  163    H    CYS 129           HN       CYS 129   4.795   2.918   5.469
  164    HA   CYS 129           HA       CYS 129   7.211   2.053   4.464
  165    HB2  CYS 129           HB2      CYS 129   6.099   4.453   4.795
  166    HB3  CYS 129           HB1      CYS 129   7.200   4.506   6.159
  167    HA   PRO 130           HA       PRO 130   9.490   0.679   8.024
  168    HB2  PRO 130           HB2      PRO 130  12.025   1.266   6.812
  169    HB3  PRO 130           HB1      PRO 130  11.174  -0.280   6.852
  170    HG2  PRO 130           HG2      PRO 130  11.611   1.173   4.560
  171    HG3  PRO 130           HG1      PRO 130  10.283   0.015   4.766
  172    HD2  PRO 130           HD2      PRO 130  10.250   3.004   5.059
  173    HD3  PRO 130           HD1      PRO 130   9.066   1.956   4.247
  174    H    TYR 131           HN       TYR 131   9.161   3.816   7.385
  175    HA   TYR 131           HA       TYR 131  10.787   4.611   9.683
  176    HB2  TYR 131           HB2      TYR 131  10.804   5.989   6.993
  177    HB3  TYR 131           HB1      TYR 131  11.434   6.715   8.469
  178    HD1  TYR 131           HD1      TYR 131  13.395   5.651   9.609
  179    HD2  TYR 131           HD2      TYR 131  12.086   4.431   5.750
  180    HE1  TYR 131           HE1      TYR 131  15.571   4.577   9.219
  181    HE2  TYR 131           HE2      TYR 131  14.259   3.350   5.349
  182    HH   TYR 131           HH       TYR 131  16.592   3.546   6.172
  183    H2   PRO  25           HT1      PRO  25   0.845  11.340  -6.964
  184    H3   PRO  25           HT2      PRO  25   1.452  11.865  -5.542
  185    HA   PRO  25           HA       PRO  25   0.122  13.518  -5.366
  186    HB2  PRO  25           HB2      PRO  25  -0.559  14.382  -7.982
  187    HB3  PRO  25           HB1      PRO  25   0.485  15.200  -6.811
  188    HG2  PRO  25           HG2      PRO  25   1.210  13.400  -9.055
  189    HG3  PRO  25           HG1      PRO  25   2.121  14.749  -8.353
  190    HD2  PRO  25           HD2      PRO  25   2.858  12.230  -7.885
  191    HD3  PRO  25           HD1      PRO  25   2.938  13.444  -6.597
  192    H    THR  26           HN       THR  26  -1.500  12.201  -4.671
  193    HA   THR  26           HA       THR  26  -3.770  11.876  -6.392
  194    HB   THR  26           HB       THR  26  -3.811   9.310  -5.646
  195    HG1  THR  26           HG1      THR  26  -1.910   8.701  -4.974
  196   HG21  THR  26          HG21      THR  26  -3.123   8.705  -7.871
  197   HG22  THR  26          HG22      THR  26  -2.256  10.227  -8.066
  198   HG23  THR  26          HG23      THR  26  -4.016  10.223  -7.954
  199    HA   PRO  27           HA       PRO  27  -5.592  12.022  -2.337
  200    HB2  PRO  27           HB2      PRO  27  -8.170  11.883  -3.014
  201    HB3  PRO  27           HB1      PRO  27  -7.176  13.262  -3.496
  202    HG2  PRO  27           HG2      PRO  27  -8.133  10.957  -5.115
  203    HG3  PRO  27           HG1      PRO  27  -7.868  12.639  -5.600
  204    HD2  PRO  27           HD2      PRO  27  -6.113  10.466  -6.012
  205    HD3  PRO  27           HD1      PRO  27  -5.746  12.186  -6.249
  206    H    GLU  28           HN       GLU  28  -4.724   9.975  -1.582
  207    HA   GLU  28           HA       GLU  28  -4.719   7.747  -1.107
  208    HB2  GLU  28           HB2      GLU  28  -6.585   7.224   0.385
  209    HB3  GLU  28           HB1      GLU  28  -5.793   8.728   0.727
  210    HG2  GLU  28           HG2      GLU  28  -7.619   9.935  -0.385
  211    HG3  GLU  28           HG1      GLU  28  -8.428   8.394  -0.671
  212    H    MET  29           HN       MET  29  -5.106   7.734  -3.630
  213    HA   MET  29           HA       MET  29  -7.533   6.408  -4.427
  214    HB2  MET  29           HB2      MET  29  -5.519   7.745  -5.796
  215    HB3  MET  29           HB1      MET  29  -5.275   6.055  -6.224
  216    HG2  MET  29           HG2      MET  29  -6.698   7.129  -7.846
  217    HG3  MET  29           HG1      MET  29  -7.598   5.901  -6.958
  218    HE1  MET  29           HE1      MET  29  -9.026   8.070  -8.729
  219    HE2  MET  29           HE2      MET  29 -10.332   8.608  -7.673
  220    HE3  MET  29           HE3      MET  29  -9.926   6.895  -7.772
  221    H    ARG  30           HN       ARG  30  -7.945   4.505  -3.804
  222    HA   ARG  30           HA       ARG  30  -5.966   2.656  -2.909
  223    HB2  ARG  30           HB2      ARG  30  -8.901   2.831  -2.974
  224    HB3  ARG  30           HB1      ARG  30  -8.236   1.209  -3.016
  225    HG2  ARG  30           HG2      ARG  30  -6.752   2.336  -1.057
  226    HG3  ARG  30           HG1      ARG  30  -8.290   3.174  -0.858
  227    HD2  ARG  30           HD2      ARG  30  -9.448   1.091  -0.664
  228    HD3  ARG  30           HD1      ARG  30  -7.973   0.198  -1.026
  229    HE   ARG  30           HE       ARG  30  -7.617   1.862   1.225
  230   HH11  ARG  30          HH11      ARG  30  -9.118  -1.119   0.234
  231   HH12  ARG  30          HH12      ARG  30  -9.041  -1.833   1.810
  232   HH21  ARG  30          HH21      ARG  30  -7.509   0.931   3.304
  233   HH22  ARG  30          HH22      ARG  30  -8.126  -0.667   3.555
  234    H    GLU  31           HN       GLU  31  -4.937   1.169  -4.058
  235    HA   GLU  31           HA       GLU  31  -6.162   0.104  -6.492
  236    HB2  GLU  31           HB2      GLU  31  -4.016   0.280  -7.700
  237    HB3  GLU  31           HB1      GLU  31  -4.671   1.858  -7.281
  238    HG2  GLU  31           HG2      GLU  31  -3.126   2.107  -5.491
  239    HG3  GLU  31           HG1      GLU  31  -2.588   0.439  -5.661
  240    H    LYS  32           HN       LYS  32  -5.625  -1.889  -7.051
  241    HA   LYS  32           HA       LYS  32  -5.168  -3.667  -4.964
  242    HB2  LYS  32           HB2      LYS  32  -4.976  -4.196  -7.916
  243    HB3  LYS  32           HB1      LYS  32  -5.329  -5.359  -6.648
  244    HG2  LYS  32           HG2      LYS  32  -7.355  -4.063  -6.087
  245    HG3  LYS  32           HG1      LYS  32  -7.041  -3.040  -7.463
  246    HD2  LYS  32           HD2      LYS  32  -8.661  -4.684  -8.115
  247    HD3  LYS  32           HD1      LYS  32  -7.140  -5.047  -8.931
  248    HE2  LYS  32           HE2      LYS  32  -7.637  -6.297  -6.301
  249    HE3  LYS  32           HE1      LYS  32  -8.556  -6.910  -7.674
  250    HZ1  LYS  32           HZ1      LYS  32  -5.596  -6.759  -7.456
  251    HZ2  LYS  32           HZ2      LYS  32  -6.434  -7.263  -8.835
  252    HZ3  LYS  32           HZ3      LYS  32  -6.534  -8.166  -7.408
  253    H    LEU  33           HN       LEU  33  -3.379  -3.777  -3.931
  254    HA   LEU  33           HA       LEU  33  -0.812  -3.809  -5.316
  255    HB2  LEU  33           HB2      LEU  33  -1.392  -3.402  -2.420
  256    HB3  LEU  33           HB1      LEU  33   0.123  -3.237  -3.242
  257    HG   LEU  33           HG       LEU  33  -2.278  -1.519  -3.677
  258   HD11  LEU  33          HD11      LEU  33  -1.451  -0.554  -1.825
  259   HD12  LEU  33          HD12      LEU  33  -0.324   0.178  -2.959
  260   HD13  LEU  33          HD13      LEU  33   0.150  -1.250  -2.043
  261   HD21  LEU  33          HD21      LEU  33  -1.053  -0.303  -5.294
  262   HD22  LEU  33          HD22      LEU  33  -0.884  -2.008  -5.726
  263   HD23  LEU  33          HD23      LEU  33   0.436  -1.163  -4.911
  264    H    CYS  34           HN       CYS  34  -0.533  -5.909  -5.918
  265    HA   CYS  34           HA       CYS  34  -0.918  -8.036  -3.970
  266    HB2  CYS  34           HB2      CYS  34  -0.308  -7.976  -6.902
  267    HB3  CYS  34           HB1      CYS  34  -0.256  -9.469  -5.981
  268    H    GLY  35           HN       GLY  35   0.869  -7.039  -2.696
  269    HA2  GLY  35           HA2      GLY  35   2.961  -7.342  -1.791
  270    HA3  GLY  35           HA1      GLY  35   3.245  -8.583  -2.993
  271    H    HIS  36           HN       HIS  36   3.835  -7.787  -5.226
  272    HA   HIS  36           HA       HIS  36   5.924  -5.946  -5.059
  273    HB2  HIS  36           HB2      HIS  36   5.569  -7.817  -6.793
  274    HB3  HIS  36           HB1      HIS  36   4.591  -6.629  -7.660
  275    HD1  HIS  36           HD1      HIS  36   6.407  -6.576  -9.580
  276    HD2  HIS  36           HD2      HIS  36   7.702  -5.309  -5.831
  277    HE1  HIS  36           HE1      HIS  36   8.588  -5.371  -9.963
  278    H    HIS  37           HN       HIS  37   2.686  -5.599  -6.592
  279    HA   HIS  37           HA       HIS  37   2.948  -2.892  -7.274
  280    HB2  HIS  37           HB2      HIS  37   0.542  -4.448  -6.331
  281    HB3  HIS  37           HB1      HIS  37   0.445  -2.761  -6.827
  282    HD1  HIS  37           HD1      HIS  37  -0.589  -2.733  -9.075
  283    HD2  HIS  37           HD2      HIS  37   2.102  -5.852  -8.597
  284    HE1  HIS  37           HE1      HIS  37  -0.515  -3.923 -11.286
  285    H    PHE  38           HN       PHE  38   2.092  -4.569  -4.381
  286    HA   PHE  38           HA       PHE  38   1.467  -2.366  -2.778
  287    HB2  PHE  38           HB2      PHE  38   0.751  -4.551  -2.130
  288    HB3  PHE  38           HB1      PHE  38   2.385  -5.167  -2.154
  289    HD1  PHE  38           HD2      PHE  38   0.514  -2.391  -0.617
  290    HD2  PHE  38           HD1      PHE  38   3.321  -5.544  -0.097
  291    HE1  PHE  38           HE2      PHE  38   0.726  -1.795   1.761
  292    HE2  PHE  38           HE1      PHE  38   3.533  -4.974   2.296
  293    HZ   PHE  38           HZ       PHE  38   2.236  -3.090   3.227
  294    H    VAL  39           HN       VAL  39   4.404  -3.800  -3.825
  295    HA   VAL  39           HA       VAL  39   6.088  -2.485  -1.935
  296    HB   VAL  39           HB       VAL  39   6.494  -4.160  -4.354
  297   HG11  VAL  39          HG11      VAL  39   8.044  -2.792  -5.232
  298   HG12  VAL  39          HG12      VAL  39   9.058  -3.409  -3.929
  299   HG13  VAL  39          HG13      VAL  39   8.226  -1.874  -3.738
  300   HG21  VAL  39          HG21      VAL  39   6.632  -4.684  -1.761
  301   HG22  VAL  39          HG22      VAL  39   8.304  -4.178  -2.016
  302   HG23  VAL  39          HG23      VAL  39   7.637  -5.519  -2.946
  303    H    ARG  40           HN       ARG  40   5.839  -2.043  -5.492
  304    HA   ARG  40           HA       ARG  40   7.059   0.376  -5.718
  305    HB2  ARG  40           HB2      ARG  40   4.598  -0.577  -7.194
  306    HB3  ARG  40           HB1      ARG  40   5.584   0.795  -7.681
  307    HG2  ARG  40           HG2      ARG  40   6.738  -0.646  -8.901
  308    HG3  ARG  40           HG1      ARG  40   7.415  -1.243  -7.394
  309    HD2  ARG  40           HD2      ARG  40   6.068  -3.071  -7.364
  310    HD3  ARG  40           HD1      ARG  40   4.786  -2.296  -8.290
  311    HE   ARG  40           HE       ARG  40   7.304  -2.970  -9.629
  312   HH11  ARG  40          HH11      ARG  40   3.891  -3.515  -9.183
  313   HH12  ARG  40          HH12      ARG  40   3.721  -4.455 -10.628
  314   HH21  ARG  40          HH21      ARG  40   7.088  -4.206 -11.534
  315   HH22  ARG  40          HH22      ARG  40   5.539  -4.849 -11.963
  316    H    ALA  41           HN       ALA  41   3.489  -0.007  -5.248
  317    HA   ALA  41           HA       ALA  41   2.943   2.687  -4.979
  318    HB1  ALA  41           HB1      ALA  41   0.896   2.083  -4.010
  319    HB2  ALA  41           HB2      ALA  41   1.548   0.638  -3.227
  320    HB3  ALA  41           HB3      ALA  41   1.312   0.673  -4.980
  321    H    LEU  42           HN       LEU  42   3.863   0.360  -2.391
  322    HA   LEU  42           HA       LEU  42   3.772   1.986  -0.197
  323    HB2  LEU  42           HB2      LEU  42   4.886  -0.475  -0.822
  324    HB3  LEU  42           HB1      LEU  42   6.261   0.466  -0.308
  325    HG   LEU  42           HG       LEU  42   3.759   0.067   1.329
  326   HD11  LEU  42          HD11      LEU  42   4.582  -1.937   1.829
  327   HD12  LEU  42          HD12      LEU  42   5.949  -1.117   2.585
  328   HD13  LEU  42          HD13      LEU  42   6.050  -1.630   0.900
  329   HD21  LEU  42          HD21      LEU  42   4.614   1.984   2.201
  330   HD22  LEU  42          HD22      LEU  42   6.245   1.630   1.636
  331   HD23  LEU  42          HD23      LEU  42   5.617   0.823   3.074
  332    H    VAL  43           HN       VAL  43   6.362   1.748  -2.557
  333    HA   VAL  43           HA       VAL  43   8.057   3.719  -1.420
  334    HB   VAL  43           HB       VAL  43   8.182   3.309  -4.375
  335   HG11  VAL  43          HG11      VAL  43  10.442   3.456  -4.073
  336   HG12  VAL  43          HG12      VAL  43  10.382   2.632  -2.510
  337   HG13  VAL  43          HG13      VAL  43   9.910   4.336  -2.636
  338   HG21  VAL  43          HG21      VAL  43   7.474   1.116  -3.795
  339   HG22  VAL  43          HG22      VAL  43   8.610   1.065  -2.444
  340   HG23  VAL  43          HG23      VAL  43   9.210   1.073  -4.100
  341    H    ARG  44           HN       ARG  44   6.200   3.807  -4.416
  342    HA   ARG  44           HA       ARG  44   6.196   6.341  -5.239
  343    HB2  ARG  44           HB2      ARG  44   3.680   4.713  -4.815
  344    HB3  ARG  44           HB1      ARG  44   3.860   6.015  -5.961
  345    HG2  ARG  44           HG2      ARG  44   5.909   4.105  -6.405
  346    HG3  ARG  44           HG1      ARG  44   4.351   3.281  -6.313
  347    HD2  ARG  44           HD2      ARG  44   4.495   5.773  -7.900
  348    HD3  ARG  44           HD1      ARG  44   5.280   4.340  -8.539
  349    HE   ARG  44           HE       ARG  44   2.567   3.925  -7.671
  350   HH11  ARG  44          HH11      ARG  44   4.658   4.777 -10.326
  351   HH12  ARG  44          HH12      ARG  44   3.505   4.339 -11.544
  352   HH21  ARG  44          HH21      ARG  44   1.043   3.345  -9.268
  353   HH22  ARG  44          HH22      ARG  44   1.452   3.523 -10.942
  354    H    VAL  45           HN       VAL  45   4.477   5.070  -2.530
  355    HA   VAL  45           HA       VAL  45   3.104   7.409  -1.696
  356    HB   VAL  45           HB       VAL  45   3.790   4.882  -0.196
  357   HG11  VAL  45          HG11      VAL  45   2.144   7.229   0.459
  358   HG12  VAL  45          HG12      VAL  45   3.066   6.140   1.495
  359   HG13  VAL  45          HG13      VAL  45   1.492   5.646   0.881
  360   HG21  VAL  45          HG21      VAL  45   1.080   4.956  -1.002
  361   HG22  VAL  45          HG22      VAL  45   2.347   3.808  -1.433
  362   HG23  VAL  45          HG23      VAL  45   2.093   5.249  -2.418
  363    H    CYS  46           HN       CYS  46   5.754   5.537  -0.292
  364    HA   CYS  46           HA       CYS  46   6.746   7.950   1.078
  365    HB2  CYS  46           HB2      CYS  46   5.583   6.544   2.665
  366    HB3  CYS  46           HB1      CYS  46   6.464   5.135   2.127
  367    H    GLY  47           HN       GLY  47   7.615   4.561   0.629
  368    HA2  GLY  47           HA2      GLY  47   9.751   4.701  -1.035
  369    HA3  GLY  47           HA1      GLY  47  10.440   5.227   0.488
  370    H    GLY  48           HN       GLY  48  11.406   3.678   1.598
  371    HA2  GLY  48           HA2      GLY  48  10.434   1.353   2.556
  372    HA3  GLY  48           HA1      GLY  48  10.916   0.908   0.932
  373    HA   PRO  49           HA       PRO  49  14.715   0.256   3.350
  374    HB2  PRO  49           HB2      PRO  49  15.607  -1.866   1.992
  375    HB3  PRO  49           HB1      PRO  49  14.258  -2.003   3.124
  376    HG2  PRO  49           HG2      PRO  49  14.183  -1.768   0.145
  377    HG3  PRO  49           HG1      PRO  49  13.295  -2.883   1.201
  378    HD2  PRO  49           HD2      PRO  49  12.238  -0.578   0.228
  379    HD3  PRO  49           HD1      PRO  49  11.716  -1.300   1.744
  380    H    ARG  50           HN       ARG  50  14.509   2.327   1.430
  381    HA   ARG  50           HA       ARG  50  15.792   3.698   0.211
  382    HB2  ARG  50           HB2      ARG  50  17.951   1.692   0.600
  383    HB3  ARG  50           HB1      ARG  50  18.142   3.383   0.205
  384    HG2  ARG  50           HG2      ARG  50  16.992   2.353   2.783
  385    HG3  ARG  50           HG1      ARG  50  18.667   2.862   2.564
  386    HD2  ARG  50           HD2      ARG  50  17.949   5.107   2.019
  387    HD3  ARG  50           HD1      ARG  50  16.258   4.618   2.101
  388    HE   ARG  50           HE       ARG  50  17.438   4.024   4.556
  389   HH11  ARG  50          HH11      ARG  50  16.655   6.820   2.629
  390   HH12  ARG  50          HH12      ARG  50  16.440   7.862   3.996
  391   HH21  ARG  50          HH21      ARG  50  17.154   5.387   6.361
  392   HH22  ARG  50          HH22      ARG  50  16.723   7.048   6.116
  393    H    TRP  51           HN       TRP  51  15.687   0.325  -0.659
  394    HA   TRP  51           HA       TRP  51  15.634  -0.765  -2.626
  395    HB2  TRP  51           HB2      TRP  51  15.003   1.888  -3.868
  396    HB3  TRP  51           HB1      TRP  51  14.479   0.287  -4.349
  397    HD1  TRP  51           HD1      TRP  51  13.849   2.860  -1.560
  398    HE1  TRP  51           HE1      TRP  51  11.565   2.324  -0.510
  399    HE3  TRP  51           HE3      TRP  51  12.903  -1.430  -4.022
  400    HZ2  TRP  51           HZ2      TRP  51   9.612   0.269  -0.721
  401    HZ3  TRP  51           HZ3      TRP  51  10.829  -2.648  -3.540
  402    HH2  TRP  51           HH2      TRP  51   9.202  -1.769  -1.908
  403    H    SER  52           HN       SER  52  18.057   1.133  -1.831
  404    HA   SER  52           HA       SER  52  19.513   0.713  -4.360
  405    HB2  SER  52           HB2      SER  52  20.048   2.996  -2.449
  406    HB3  SER  52           HB1      SER  52  20.689   2.778  -4.076
  407    HG   SER  52           HG       SER  52  17.916   2.992  -3.622
  408    H    THR  53           HN       THR  53  22.027   1.435  -3.451
  409    HA   THR  53           HA       THR  53  23.861   0.410  -2.587
  410    HB   THR  53           HB       THR  53  23.893   0.098  -0.160
  411    HG1  THR  53           HG1      THR  53  21.412   1.111   0.344
  412   HG21  THR  53          HG21      THR  53  22.525   2.634  -1.064
  413   HG22  THR  53          HG22      THR  53  24.262   2.332  -1.039
  414   HG23  THR  53          HG23      THR  53  23.360   2.426   0.475
  415    H    GLU  54           HN       GLU  54  23.793  -1.426  -3.824
  416    HA   GLU  54           HA       GLU  54  23.510  -3.621  -4.380
  417    HB2  GLU  54           HB2      GLU  54  24.165  -5.120  -2.277
  418    HB3  GLU  54           HB1      GLU  54  25.350  -4.206  -3.196
  419    HG2  GLU  54           HG2      GLU  54  25.184  -2.392  -1.547
  420    HG3  GLU  54           HG1      GLU  54  24.068  -3.378  -0.605
  421    H    ALA  55           HN       ALA  55  21.280  -3.645  -4.761
  422    HA   ALA  55           HA       ALA  55  19.411  -4.241  -2.674
  423    HB1  ALA  55           HB1      ALA  55  18.778  -2.941  -4.656
  424    HB2  ALA  55           HB2      ALA  55  17.766  -4.372  -4.458
  425    HB3  ALA  55           HB3      ALA  55  19.051  -4.362  -5.666
  Start of MODEL   16
    1    H1   ALA 106           HT1      ALA 106  -1.755   3.633  11.462
    2    H2   ALA 106           HT2      ALA 106  -2.391   2.981  10.036
    3    H3   ALA 106           HT3      ALA 106  -0.760   2.751  10.416
    4    HA   ALA 106           HA       ALA 106  -1.335   1.421  12.322
    5    HB1  ALA 106           HB1      ALA 106  -4.181   1.854  11.423
    6    HB2  ALA 106           HB2      ALA 106  -3.433   2.537  12.868
    7    HB3  ALA 106           HB3      ALA 106  -3.659   0.793  12.731
    8    H    ALA 107           HN       ALA 107  -0.336  -0.277  11.444
    9    HA   ALA 107           HA       ALA 107  -0.953  -1.355   8.891
   10    HB1  ALA 107           HB1      ALA 107   0.642  -3.107   9.455
   11    HB2  ALA 107           HB2      ALA 107   0.642  -2.581  11.138
   12    HB3  ALA 107           HB3      ALA 107   1.277  -1.520   9.883
   13    H    ALA 108           HN       ALA 108  -2.582  -2.633   8.351
   14    HA   ALA 108           HA       ALA 108  -3.953  -4.162  10.458
   15    HB1  ALA 108           HB1      ALA 108  -5.900  -3.670   9.475
   16    HB2  ALA 108           HB2      ALA 108  -5.275  -4.030   7.864
   17    HB3  ALA 108           HB3      ALA 108  -4.991  -2.444   8.588
   18    H    THR 109           HN       THR 109  -3.758  -6.296  10.492
   19    HA   THR 109           HA       THR 109  -2.830  -8.329   9.952
   20    HB   THR 109           HB       THR 109  -5.161  -8.535   9.337
   21    HG1  THR 109           HG1      THR 109  -4.832 -10.112   7.531
   22   HG21  THR 109          HG21      THR 109  -4.307  -7.049   6.934
   23   HG22  THR 109          HG22      THR 109  -5.846  -7.027   7.795
   24   HG23  THR 109          HG23      THR 109  -5.482  -8.338   6.672
   25    H    ASN 110           HN       ASN 110  -3.142  -8.851   6.807
   26    HA   ASN 110           HA       ASN 110  -0.327  -8.354   6.272
   27    HB2  ASN 110           HB2      ASN 110  -2.416  -9.834   4.656
   28    HB3  ASN 110           HB1      ASN 110  -0.705  -9.741   4.257
   29   HD21  ASN 110          HD21      ASN 110   0.763 -10.912   5.443
   30   HD22  ASN 110          HD22      ASN 110   0.286 -12.169   6.523
   31    HA   PRO 111           HA       PRO 111  -1.815  -4.590   4.236
   32    HB2  PRO 111           HB2      PRO 111   0.567  -3.411   3.985
   33    HB3  PRO 111           HB1      PRO 111  -0.304  -3.454   5.518
   34    HG2  PRO 111           HG2      PRO 111   1.920  -5.233   4.570
   35    HG3  PRO 111           HG1      PRO 111   1.738  -4.420   6.137
   36    HD2  PRO 111           HD2      PRO 111   1.098  -7.013   5.791
   37    HD3  PRO 111           HD1      PRO 111   0.191  -5.958   6.895
   38    H    ALA 112           HN       ALA 112   0.279  -7.044   3.147
   39    HA   ALA 112           HA       ALA 112   0.616  -5.896   0.493
   40    HB1  ALA 112           HB1      ALA 112   1.486  -8.655   1.207
   41    HB2  ALA 112           HB2      ALA 112   2.342  -7.271   1.880
   42    HB3  ALA 112           HB3      ALA 112   2.242  -7.480   0.131
   43    H    ARG 113           HN       ARG 113  -0.899  -8.698   2.015
   44    HA   ARG 113           HA       ARG 113  -2.039  -9.655  -0.430
   45    HB2  ARG 113           HB2      ARG 113  -2.059 -10.455   2.417
   46    HB3  ARG 113           HB1      ARG 113  -3.427 -10.978   1.449
   47    HG2  ARG 113           HG2      ARG 113  -0.568 -11.462   0.659
   48    HG3  ARG 113           HG1      ARG 113  -1.522 -12.601   1.610
   49    HD2  ARG 113           HD2      ARG 113  -3.150 -12.768  -0.194
   50    HD3  ARG 113           HD1      ARG 113  -2.243 -11.588  -1.139
   51    HE   ARG 113           HE       ARG 113  -0.390 -13.287  -1.087
   52   HH11  ARG 113          HH11      ARG 113  -3.736 -14.219  -0.792
   53   HH12  ARG 113          HH12      ARG 113  -3.485 -15.804  -1.445
   54   HH21  ARG 113          HH21      ARG 113  -0.051 -15.373  -1.948
   55   HH22  ARG 113          HH22      ARG 113  -1.393 -16.458  -2.104
   56    H    TYR 114           HN       TYR 114  -3.342  -7.962   2.427
   57    HA   TYR 114           HA       TYR 114  -6.015  -8.019   1.637
   58    HB2  TYR 114           HB2      TYR 114  -6.394  -6.900   3.540
   59    HB3  TYR 114           HB1      TYR 114  -4.673  -7.067   3.833
   60    HD1  TYR 114           HD1      TYR 114  -7.120  -4.732   2.218
   61    HD2  TYR 114           HD2      TYR 114  -3.430  -5.178   4.287
   62    HE1  TYR 114           HE1      TYR 114  -6.924  -2.289   2.379
   63    HE2  TYR 114           HE2      TYR 114  -3.214  -2.736   4.454
   64    HH   TYR 114           HH       TYR 114  -4.119  -0.714   3.118
   65    H    CYS 115           HN       CYS 115  -3.391  -5.989   0.532
   66    HA   CYS 115           HA       CYS 115  -5.230  -4.184  -0.779
   67    HB2  CYS 115           HB2      CYS 115  -2.198  -4.301  -0.911
   68    HB3  CYS 115           HB1      CYS 115  -3.205  -3.128  -1.752
   69    H    CYS 116           HN       CYS 116  -3.515  -7.076  -1.530
   70    HA   CYS 116           HA       CYS 116  -3.433  -6.843  -4.324
   71    HB2  CYS 116           HB2      CYS 116  -2.262  -8.650  -3.133
   72    HB3  CYS 116           HB1      CYS 116  -3.795  -9.325  -2.617
   73    H    LEU 117           HN       LEU 117  -5.906  -8.103  -2.126
   74    HA   LEU 117           HA       LEU 117  -7.791  -8.583  -4.240
   75    HB2  LEU 117           HB2      LEU 117  -7.768  -8.836  -1.281
   76    HB3  LEU 117           HB1      LEU 117  -9.306  -8.804  -2.103
   77    HG   LEU 117           HG       LEU 117  -7.102 -10.780  -2.684
   78   HD11  LEU 117          HD11      LEU 117  -9.643 -11.142  -1.101
   79   HD12  LEU 117          HD12      LEU 117  -8.009 -11.093  -0.436
   80   HD13  LEU 117          HD13      LEU 117  -8.483 -12.407  -1.511
   81   HD21  LEU 117          HD21      LEU 117  -8.598 -10.334  -4.577
   82   HD22  LEU 117          HD22      LEU 117  -9.987 -10.719  -3.561
   83   HD23  LEU 117          HD23      LEU 117  -8.805 -11.968  -3.947
   84    H    SER 118           HN       SER 118  -7.297  -6.175  -1.704
   85    HA   SER 118           HA       SER 118  -9.526  -4.587  -2.769
   86    HB2  SER 118           HB2      SER 118  -9.446  -5.038  -0.302
   87    HB3  SER 118           HB1      SER 118  -7.938  -4.129  -0.230
   88    HG   SER 118           HG       SER 118  -9.023  -2.290  -0.802
   89    H    GLY 119           HN       GLY 119  -6.530  -3.554  -1.182
   90    HA2  GLY 119           HA2      GLY 119  -4.741  -2.679  -2.739
   91    HA3  GLY 119           HA1      GLY 119  -6.046  -1.759  -3.477
   92    H    CYS 120           HN       CYS 120  -3.528  -0.858  -2.131
   93    HA   CYS 120           HA       CYS 120  -4.764   0.699   0.036
   94    HB2  CYS 120           HB2      CYS 120  -1.946   1.076   0.079
   95    HB3  CYS 120           HB1      CYS 120  -2.971   0.381   1.319
   96    H    THR 121           HN       THR 121  -4.611   2.890   0.095
   97    HA   THR 121           HA       THR 121  -4.367   4.233  -2.392
   98    HB   THR 121           HB       THR 121  -4.607   6.304  -0.939
   99    HG1  THR 121           HG1      THR 121  -5.396   4.481   1.058
  100   HG21  THR 121          HG21      THR 121  -6.760   4.412  -0.442
  101   HG22  THR 121          HG22      THR 121  -6.391   4.825  -2.096
  102   HG23  THR 121          HG23      THR 121  -6.875   6.074  -0.949
  103    H    GLN 122           HN       GLN 122  -3.053   5.647   0.351
  104    HA   GLN 122           HA       GLN 122  -0.280   5.384  -0.253
  105    HB2  GLN 122           HB2      GLN 122  -1.933   7.776  -0.846
  106    HB3  GLN 122           HB1      GLN 122  -0.405   8.063  -0.037
  107    HG2  GLN 122           HG2      GLN 122   0.780   6.961  -1.766
  108    HG3  GLN 122           HG1      GLN 122  -0.700   6.465  -2.554
  109   HE21  GLN 122          HE21      GLN 122  -0.238   9.620  -1.123
  110   HE22  GLN 122          HE22      GLN 122  -0.225  10.510  -2.603
  111    H    GLN 123           HN       GLN 123  -2.984   6.556   1.718
  112    HA   GLN 123           HA       GLN 123  -1.431   7.415   3.904
  113    HB2  GLN 123           HB2      GLN 123  -4.253   6.419   3.653
  114    HB3  GLN 123           HB1      GLN 123  -3.564   6.859   5.202
  115    HG2  GLN 123           HG2      GLN 123  -3.217   9.122   4.463
  116    HG3  GLN 123           HG1      GLN 123  -3.753   8.703   2.836
  117   HE21  GLN 123          HE21      GLN 123  -4.736   9.223   6.137
  118   HE22  GLN 123          HE22      GLN 123  -6.425   9.399   5.815
  119    H    ASP 124           HN       ASP 124  -3.023   4.324   3.147
  120    HA   ASP 124           HA       ASP 124  -2.146   2.903   5.395
  121    HB2  ASP 124           HB2      ASP 124  -3.808   2.039   3.721
  122    HB3  ASP 124           HB1      ASP 124  -2.484   1.809   2.587
  123    H    LEU 125           HN       LEU 125  -0.749   3.047   2.143
  124    HA   LEU 125           HA       LEU 125   1.608   1.668   2.694
  125    HB2  LEU 125           HB2      LEU 125   1.090   3.803   0.610
  126    HB3  LEU 125           HB1      LEU 125   2.457   2.735   0.622
  127    HG   LEU 125           HG       LEU 125   0.050   1.184   0.753
  128   HD11  LEU 125          HD11      LEU 125  -1.037   1.823  -1.248
  129   HD12  LEU 125          HD12      LEU 125   0.239   2.973  -1.646
  130   HD13  LEU 125          HD13      LEU 125  -0.853   3.299  -0.298
  131   HD21  LEU 125          HD21      LEU 125   2.417   0.692  -0.136
  132   HD22  LEU 125          HD22      LEU 125   1.840   1.483  -1.610
  133   HD23  LEU 125          HD23      LEU 125   1.030   0.032  -1.003
  134    H    LEU 126           HN       LEU 126   0.681   4.936   3.420
  135    HA   LEU 126           HA       LEU 126   3.314   5.978   3.790
  136    HB2  LEU 126           HB2      LEU 126   0.549   6.874   4.391
  137    HB3  LEU 126           HB1      LEU 126   1.824   7.584   5.356
  138    HG   LEU 126           HG       LEU 126   1.666   7.664   2.346
  139   HD11  LEU 126          HD11      LEU 126   1.151  10.017   2.619
  140   HD12  LEU 126          HD12      LEU 126   1.189   9.840   4.373
  141   HD13  LEU 126          HD13      LEU 126  -0.057   9.022   3.429
  142   HD21  LEU 126          HD21      LEU 126   3.577   9.018   4.245
  143   HD22  LEU 126          HD22      LEU 126   3.519   9.240   2.497
  144   HD23  LEU 126          HD23      LEU 126   3.966   7.673   3.171
  145    H    THR 127           HN       THR 127   1.032   4.231   5.761
  146    HA   THR 127           HA       THR 127   2.619   4.636   8.169
  147    HB   THR 127           HB       THR 127   0.862   3.798   9.404
  148    HG1  THR 127           HG1      THR 127   0.590   1.777   8.552
  149   HG21  THR 127          HG21      THR 127   0.183   5.734   7.758
  150   HG22  THR 127          HG22      THR 127  -1.019   4.955   8.782
  151   HG23  THR 127          HG23      THR 127  -0.875   4.495   7.087
  152    H    LEU 128           HN       LEU 128   2.671   2.531   5.541
  153    HA   LEU 128           HA       LEU 128   3.513   0.242   7.147
  154    HB2  LEU 128           HB2      LEU 128   3.114   0.491   4.175
  155    HB3  LEU 128           HB1      LEU 128   3.445  -0.982   5.049
  156    HG   LEU 128           HG       LEU 128   1.022   0.685   5.641
  157   HD11  LEU 128          HD11      LEU 128   1.179  -1.630   3.730
  158   HD12  LEU 128          HD12      LEU 128   1.026   0.060   3.249
  159   HD13  LEU 128          HD13      LEU 128  -0.261  -0.716   4.172
  160   HD21  LEU 128          HD21      LEU 128   1.425  -0.837   7.360
  161   HD22  LEU 128          HD22      LEU 128   1.943  -2.084   6.233
  162   HD23  LEU 128          HD23      LEU 128   0.239  -1.648   6.334
  163    H    CYS 129           HN       CYS 129   4.791   2.810   5.221
  164    HA   CYS 129           HA       CYS 129   7.309   1.641   4.610
  165    HB2  CYS 129           HB2      CYS 129   8.006   3.835   3.968
  166    HB3  CYS 129           HB1      CYS 129   6.322   3.674   3.500
  167    HA   PRO 130           HA       PRO 130   9.556   2.105   8.384
  168    HB2  PRO 130           HB2      PRO 130  11.883   3.259   7.045
  169    HB3  PRO 130           HB1      PRO 130  11.694   1.659   7.764
  170    HG2  PRO 130           HG2      PRO 130  11.897   2.026   5.096
  171    HG3  PRO 130           HG1      PRO 130  10.921   0.725   5.805
  172    HD2  PRO 130           HD2      PRO 130  10.039   3.388   4.737
  173    HD3  PRO 130           HD1      PRO 130   9.307   1.786   4.490
  174    H    TYR 131           HN       TYR 131  10.508   3.601   9.895
  175    HA   TYR 131           HA       TYR 131  10.532   5.567  11.028
  176    HB2  TYR 131           HB2      TYR 131  11.116   6.673   8.275
  177    HB3  TYR 131           HB1      TYR 131  11.345   7.538   9.788
  178    HD1  TYR 131           HD2      TYR 131  12.567   4.750   7.716
  179    HD2  TYR 131           HD1      TYR 131  13.242   7.120  11.182
  180    HE1  TYR 131           HE2      TYR 131  14.837   3.823   7.899
  181    HE2  TYR 131           HE1      TYR 131  15.515   6.203  11.375
  182    HH   TYR 131           HH       TYR 131  16.759   4.198  10.667
  183    H2   PRO  25           HT1      PRO  25  -3.806  15.391 -10.257
  184    H3   PRO  25           HT2      PRO  25  -2.258  15.882 -10.094
  185    HA   PRO  25           HA       PRO  25  -2.332  15.972  -7.979
  186    HB2  PRO  25           HB2      PRO  25  -4.873  16.841  -7.159
  187    HB3  PRO  25           HB1      PRO  25  -3.398  17.814  -7.252
  188    HG2  PRO  25           HG2      PRO  25  -5.612  17.536  -9.221
  189    HG3  PRO  25           HG1      PRO  25  -4.618  18.953  -8.839
  190    HD2  PRO  25           HD2      PRO  25  -4.210  17.581 -11.087
  191    HD3  PRO  25           HD1      PRO  25  -2.838  18.213 -10.158
  192    H    THR  26           HN       THR  26  -2.306  13.719  -7.990
  193    HA   THR  26           HA       THR  26  -4.679  12.148  -8.180
  194    HB   THR  26           HB       THR  26  -3.225  10.271  -7.427
  195    HG1  THR  26           HG1      THR  26  -1.147  12.217  -7.412
  196   HG21  THR  26          HG21      THR  26  -1.737  10.286  -9.379
  197   HG22  THR  26          HG22      THR  26  -2.051  12.007  -9.602
  198   HG23  THR  26          HG23      THR  26  -3.360  10.840  -9.799
  199    HA   PRO  27           HA       PRO  27  -5.685  12.397  -3.821
  200    HB2  PRO  27           HB2      PRO  27  -8.081  11.249  -3.956
  201    HB3  PRO  27           HB1      PRO  27  -7.790  12.804  -4.744
  202    HG2  PRO  27           HG2      PRO  27  -8.082  10.105  -5.940
  203    HG3  PRO  27           HG1      PRO  27  -8.482  11.689  -6.624
  204    HD2  PRO  27           HD2      PRO  27  -6.119  10.137  -7.065
  205    HD3  PRO  27           HD1      PRO  27  -6.481  11.764  -7.678
  206    H    GLU  28           HN       GLU  28  -7.220  10.465  -2.543
  207    HA   GLU  28           HA       GLU  28  -5.256   8.383  -2.186
  208    HB2  GLU  28           HB2      GLU  28  -6.947   7.548  -0.466
  209    HB3  GLU  28           HB1      GLU  28  -6.146   9.067  -0.167
  210    HG2  GLU  28           HG2      GLU  28  -8.099  10.283  -0.835
  211    HG3  GLU  28           HG1      GLU  28  -8.899   8.799  -1.334
  212    H    MET  29           HN       MET  29  -5.510   7.641  -4.337
  213    HA   MET  29           HA       MET  29  -7.915   6.154  -4.996
  214    HB2  MET  29           HB2      MET  29  -5.967   7.397  -6.532
  215    HB3  MET  29           HB1      MET  29  -5.608   5.681  -6.701
  216    HG2  MET  29           HG2      MET  29  -7.077   6.448  -8.473
  217    HG3  MET  29           HG1      MET  29  -7.876   5.256  -7.452
  218    HE1  MET  29           HE1      MET  29 -10.811   7.611  -8.535
  219    HE2  MET  29           HE2      MET  29 -10.077   6.014  -8.686
  220    HE3  MET  29           HE3      MET  29  -9.371   7.392  -9.530
  221    H    ARG  30           HN       ARG  30  -8.237   4.318  -4.141
  222    HA   ARG  30           HA       ARG  30  -6.167   2.691  -3.020
  223    HB2  ARG  30           HB2      ARG  30  -9.114   2.633  -3.176
  224    HB3  ARG  30           HB1      ARG  30  -8.283   1.104  -2.936
  225    HG2  ARG  30           HG2      ARG  30  -7.001   2.613  -1.129
  226    HG3  ARG  30           HG1      ARG  30  -8.568   3.419  -1.139
  227    HD2  ARG  30           HD2      ARG  30  -9.651   1.278  -0.714
  228    HD3  ARG  30           HD1      ARG  30  -8.069   0.502  -0.677
  229    HE   ARG  30           HE       ARG  30  -8.216   2.647   1.171
  230   HH11  ARG  30          HH11      ARG  30  -9.177  -0.666   0.695
  231   HH12  ARG  30          HH12      ARG  30  -9.257  -1.020   2.388
  232   HH21  ARG  30          HH21      ARG  30  -8.322   2.192   3.404
  233   HH22  ARG  30          HH22      ARG  30  -8.770   0.605   3.929
  234    H    GLU  31           HN       GLU  31  -4.867   1.555  -4.321
  235    HA   GLU  31           HA       GLU  31  -6.094   0.213  -6.624
  236    HB2  GLU  31           HB2      GLU  31  -4.512   1.852  -7.400
  237    HB3  GLU  31           HB1      GLU  31  -3.289   1.267  -6.279
  238    HG2  GLU  31           HG2      GLU  31  -2.721   0.471  -8.426
  239    HG3  GLU  31           HG1      GLU  31  -3.318  -0.905  -7.506
  240    H    LYS  32           HN       LYS  32  -5.676  -1.843  -7.060
  241    HA   LYS  32           HA       LYS  32  -5.239  -3.546  -4.891
  242    HB2  LYS  32           HB2      LYS  32  -5.122  -4.272  -7.803
  243    HB3  LYS  32           HB1      LYS  32  -5.553  -5.304  -6.453
  244    HG2  LYS  32           HG2      LYS  32  -7.486  -3.766  -6.030
  245    HG3  LYS  32           HG1      LYS  32  -7.115  -3.010  -7.571
  246    HD2  LYS  32           HD2      LYS  32  -7.485  -5.072  -8.746
  247    HD3  LYS  32           HD1      LYS  32  -7.675  -5.953  -7.232
  248    HE2  LYS  32           HE2      LYS  32  -9.659  -4.631  -6.734
  249    HE3  LYS  32           HE1      LYS  32  -9.473  -3.762  -8.252
  250    HZ1  LYS  32           HZ1      LYS  32  -9.791  -5.831  -9.443
  251    HZ2  LYS  32           HZ2      LYS  32 -11.109  -5.539  -8.424
  252    HZ3  LYS  32           HZ3      LYS  32  -9.942  -6.684  -7.989
  253    H    LEU  33           HN       LEU  33  -3.381  -3.515  -3.929
  254    HA   LEU  33           HA       LEU  33  -0.872  -3.722  -5.394
  255    HB2  LEU  33           HB2      LEU  33  -1.354  -3.230  -2.494
  256    HB3  LEU  33           HB1      LEU  33   0.130  -3.087  -3.379
  257    HG   LEU  33           HG       LEU  33  -2.290  -1.387  -3.794
  258   HD11  LEU  33          HD11      LEU  33  -1.508  -0.286  -2.029
  259   HD12  LEU  33          HD12      LEU  33  -0.235   0.282  -3.098
  260   HD13  LEU  33          HD13      LEU  33   0.039  -1.123  -2.072
  261   HD21  LEU  33          HD21      LEU  33  -1.145  -0.215  -5.461
  262   HD22  LEU  33          HD22      LEU  33  -0.822  -1.915  -5.818
  263   HD23  LEU  33          HD23      LEU  33   0.405  -0.930  -5.017
  264    H    CYS  34           HN       CYS  34  -0.513  -5.838  -5.897
  265    HA   CYS  34           HA       CYS  34  -0.929  -7.857  -3.823
  266    HB2  CYS  34           HB2      CYS  34  -1.627  -7.973  -6.361
  267    HB3  CYS  34           HB1      CYS  34   0.008  -8.586  -6.548
  268    H    GLY  35           HN       GLY  35   0.846  -6.995  -2.630
  269    HA2  GLY  35           HA2      GLY  35   2.953  -7.311  -1.758
  270    HA3  GLY  35           HA1      GLY  35   3.216  -8.530  -2.987
  271    H    HIS  36           HN       HIS  36   3.745  -7.674  -5.223
  272    HA   HIS  36           HA       HIS  36   5.856  -5.837  -5.022
  273    HB2  HIS  36           HB2      HIS  36   5.421  -7.745  -6.769
  274    HB3  HIS  36           HB1      HIS  36   4.631  -6.451  -7.673
  275    HD1  HIS  36           HD1      HIS  36   6.628  -6.700  -9.437
  276    HD2  HIS  36           HD2      HIS  36   7.683  -5.346  -5.643
  277    HE1  HIS  36           HE1      HIS  36   8.932  -5.699  -9.664
  278    H    HIS  37           HN       HIS  37   2.650  -5.498  -6.654
  279    HA   HIS  37           HA       HIS  37   2.937  -2.800  -7.338
  280    HB2  HIS  37           HB2      HIS  37   0.503  -4.351  -6.449
  281    HB3  HIS  37           HB1      HIS  37   0.416  -2.652  -6.906
  282    HD1  HIS  37           HD1      HIS  37  -0.822  -2.799  -9.084
  283    HD2  HIS  37           HD2      HIS  37   2.364  -5.435  -8.818
  284    HE1  HIS  37           HE1      HIS  37  -0.594  -3.836 -11.363
  285    H    PHE  38           HN       PHE  38   2.125  -4.456  -4.451
  286    HA   PHE  38           HA       PHE  38   1.479  -2.242  -2.854
  287    HB2  PHE  38           HB2      PHE  38   0.727  -4.400  -2.197
  288    HB3  PHE  38           HB1      PHE  38   2.348  -5.058  -2.245
  289    HD1  PHE  38           HD2      PHE  38   0.491  -2.302  -0.669
  290    HD2  PHE  38           HD1      PHE  38   3.383  -5.392  -0.235
  291    HE1  PHE  38           HE2      PHE  38   0.757  -1.717   1.717
  292    HE2  PHE  38           HE1      PHE  38   3.654  -4.827   2.150
  293    HZ   PHE  38           HZ       PHE  38   2.348  -2.978   3.126
  294    H    VAL  39           HN       VAL  39   4.417  -3.788  -3.798
  295    HA   VAL  39           HA       VAL  39   6.100  -2.487  -1.910
  296    HB   VAL  39           HB       VAL  39   6.503  -4.151  -4.347
  297   HG11  VAL  39          HG11      VAL  39   8.188  -2.926  -5.147
  298   HG12  VAL  39          HG12      VAL  39   9.085  -3.465  -3.730
  299   HG13  VAL  39          HG13      VAL  39   8.255  -1.916  -3.704
  300   HG21  VAL  39          HG21      VAL  39   6.469  -4.880  -1.880
  301   HG22  VAL  39          HG22      VAL  39   8.098  -4.204  -1.820
  302   HG23  VAL  39          HG23      VAL  39   7.730  -5.520  -2.933
  303    H    ARG  40           HN       ARG  40   5.957  -2.050  -5.473
  304    HA   ARG  40           HA       ARG  40   7.214   0.357  -5.659
  305    HB2  ARG  40           HB2      ARG  40   4.785  -0.546  -7.224
  306    HB3  ARG  40           HB1      ARG  40   5.841   0.784  -7.683
  307    HG2  ARG  40           HG2      ARG  40   6.941  -0.734  -8.869
  308    HG3  ARG  40           HG1      ARG  40   7.605  -1.279  -7.338
  309    HD2  ARG  40           HD2      ARG  40   6.199  -3.077  -7.226
  310    HD3  ARG  40           HD1      ARG  40   4.975  -2.333  -8.249
  311    HE   ARG  40           HE       ARG  40   7.463  -3.597  -9.175
  312   HH11  ARG  40          HH11      ARG  40   4.299  -2.282  -9.815
  313   HH12  ARG  40          HH12      ARG  40   4.231  -2.894 -11.434
  314   HH21  ARG  40          HH21      ARG  40   7.381  -4.403 -11.305
  315   HH22  ARG  40          HH22      ARG  40   5.982  -4.099 -12.280
  316    H    ALA  41           HN       ALA  41   3.623  -0.005  -5.261
  317    HA   ALA  41           HA       ALA  41   3.109   2.703  -5.016
  318    HB1  ALA  41           HB1      ALA  41   1.037   2.137  -4.053
  319    HB2  ALA  41           HB2      ALA  41   1.651   0.657  -3.307
  320    HB3  ALA  41           HB3      ALA  41   1.432   0.746  -5.060
  321    H    LEU  42           HN       LEU  42   3.929   0.364  -2.408
  322    HA   LEU  42           HA       LEU  42   3.859   1.955  -0.205
  323    HB2  LEU  42           HB2      LEU  42   4.999  -0.489  -0.866
  324    HB3  LEU  42           HB1      LEU  42   6.359   0.460  -0.329
  325    HG   LEU  42           HG       LEU  42   3.862  -0.083   1.274
  326   HD11  LEU  42          HD11      LEU  42   4.961  -2.086   1.377
  327   HD12  LEU  42          HD12      LEU  42   5.751  -1.230   2.701
  328   HD13  LEU  42          HD13      LEU  42   6.547  -1.355   1.134
  329   HD21  LEU  42          HD21      LEU  42   4.519   1.879   2.201
  330   HD22  LEU  42          HD22      LEU  42   6.180   1.702   1.649
  331   HD23  LEU  42          HD23      LEU  42   5.625   0.808   3.063
  332    H    VAL  43           HN       VAL  43   6.478   1.719  -2.523
  333    HA   VAL  43           HA       VAL  43   8.152   3.678  -1.357
  334    HB   VAL  43           HB       VAL  43   8.377   3.277  -4.294
  335   HG11  VAL  43          HG11      VAL  43  10.648   3.278  -3.855
  336   HG12  VAL  43          HG12      VAL  43  10.423   2.575  -2.250
  337   HG13  VAL  43          HG13      VAL  43  10.045   4.281  -2.530
  338   HG21  VAL  43          HG21      VAL  43   7.593   1.096  -3.789
  339   HG22  VAL  43          HG22      VAL  43   8.616   1.012  -2.349
  340   HG23  VAL  43          HG23      VAL  43   9.347   1.001  -3.956
  341    H    ARG  44           HN       ARG  44   6.421   3.799  -4.425
  342    HA   ARG  44           HA       ARG  44   6.442   6.319  -5.241
  343    HB2  ARG  44           HB2      ARG  44   3.926   4.683  -4.878
  344    HB3  ARG  44           HB1      ARG  44   4.114   6.002  -6.007
  345    HG2  ARG  44           HG2      ARG  44   6.205   4.143  -6.432
  346    HG3  ARG  44           HG1      ARG  44   4.668   3.276  -6.371
  347    HD2  ARG  44           HD2      ARG  44   4.895   5.786  -7.957
  348    HD3  ARG  44           HD1      ARG  44   5.530   4.278  -8.584
  349    HE   ARG  44           HE       ARG  44   2.847   4.016  -7.651
  350   HH11  ARG  44          HH11      ARG  44   4.807   5.038 -10.345
  351   HH12  ARG  44          HH12      ARG  44   3.560   4.775 -11.518
  352   HH21  ARG  44          HH21      ARG  44   1.200   3.663  -9.191
  353   HH22  ARG  44          HH22      ARG  44   1.510   3.994 -10.861
  354    H    VAL  45           HN       VAL  45   4.577   5.083  -2.604
  355    HA   VAL  45           HA       VAL  45   3.199   7.448  -1.861
  356    HB   VAL  45           HB       VAL  45   3.735   4.907  -0.328
  357   HG11  VAL  45          HG11      VAL  45   2.239   7.334   0.299
  358   HG12  VAL  45          HG12      VAL  45   2.921   6.090   1.350
  359   HG13  VAL  45          HG13      VAL  45   1.369   5.824   0.567
  360   HG21  VAL  45          HG21      VAL  45   1.072   5.023  -1.231
  361   HG22  VAL  45          HG22      VAL  45   2.344   3.893  -1.682
  362   HG23  VAL  45          HG23      VAL  45   2.112   5.371  -2.614
  363    H    CYS  46           HN       CYS  46   5.683   5.523  -0.232
  364    HA   CYS  46           HA       CYS  46   6.522   7.916   1.281
  365    HB2  CYS  46           HB2      CYS  46   5.189   6.096   2.488
  366    HB3  CYS  46           HB1      CYS  46   6.594   5.075   2.268
  367    H    GLY  47           HN       GLY  47   7.514   4.603   0.556
  368    HA2  GLY  47           HA2      GLY  47   9.716   4.834  -0.924
  369    HA3  GLY  47           HA1      GLY  47  10.337   5.397   0.618
  370    H    GLY  48           HN       GLY  48  11.202   3.914   1.918
  371    HA2  GLY  48           HA2      GLY  48  10.368   1.553   2.803
  372    HA3  GLY  48           HA1      GLY  48  10.879   1.113   1.186
  373    HA   PRO  49           HA       PRO  49  14.659   0.614   3.673
  374    HB2  PRO  49           HB2      PRO  49  15.542  -1.612   2.503
  375    HB3  PRO  49           HB1      PRO  49  14.173  -1.650   3.618
  376    HG2  PRO  49           HG2      PRO  49  14.155  -1.668   0.633
  377    HG3  PRO  49           HG1      PRO  49  13.223  -2.669   1.764
  378    HD2  PRO  49           HD2      PRO  49  12.259  -0.412   0.561
  379    HD3  PRO  49           HD1      PRO  49  11.645  -1.032   2.086
  380    H    ARG  50           HN       ARG  50  14.505   2.555   1.654
  381    HA   ARG  50           HA       ARG  50  15.812   3.823   0.350
  382    HB2  ARG  50           HB2      ARG  50  17.892   1.772   0.928
  383    HB3  ARG  50           HB1      ARG  50  18.171   3.371   0.281
  384    HG2  ARG  50           HG2      ARG  50  17.203   4.305   2.387
  385    HG3  ARG  50           HG1      ARG  50  17.205   2.660   3.031
  386    HD2  ARG  50           HD2      ARG  50  19.190   3.952   3.718
  387    HD3  ARG  50           HD1      ARG  50  19.603   2.522   2.770
  388    HE   ARG  50           HE       ARG  50  19.513   5.230   1.603
  389   HH11  ARG  50          HH11      ARG  50  21.052   2.135   2.050
  390   HH12  ARG  50          HH12      ARG  50  22.340   2.471   0.941
  391   HH21  ARG  50          HH21      ARG  50  21.203   5.679   0.140
  392   HH22  ARG  50          HH22      ARG  50  22.426   4.486  -0.143
  393    H    TRP  51           HN       TRP  51  15.644   0.407  -0.352
  394    HA   TRP  51           HA       TRP  51  15.553  -0.766  -2.271
  395    HB2  TRP  51           HB2      TRP  51  14.939   1.873  -3.557
  396    HB3  TRP  51           HB1      TRP  51  14.426   0.268  -4.044
  397    HD1  TRP  51           HD1      TRP  51  13.765   2.829  -1.236
  398    HE1  TRP  51           HE1      TRP  51  11.472   2.264  -0.217
  399    HE3  TRP  51           HE3      TRP  51  12.874  -1.443  -3.748
  400    HZ2  TRP  51           HZ2      TRP  51   9.531   0.194  -0.470
  401    HZ3  TRP  51           HZ3      TRP  51  10.802  -2.680  -3.309
  402    HH2  TRP  51           HH2      TRP  51   9.152  -1.833  -1.690
  403    H    SER  52           HN       SER  52  18.043   1.097  -1.588
  404    HA   SER  52           HA       SER  52  19.333   0.834  -4.221
  405    HB2  SER  52           HB2      SER  52  20.367   2.502  -1.930
  406    HB3  SER  52           HB1      SER  52  20.806   2.600  -3.634
  407    HG   SER  52           HG       SER  52  19.374   4.168  -3.553
  408    H    THR  53           HN       THR  53  21.913   0.853  -3.648
  409    HA   THR  53           HA       THR  53  23.649  -0.517  -3.207
  410    HB   THR  53           HB       THR  53  23.951  -1.238  -0.869
  411    HG1  THR  53           HG1      THR  53  22.131  -1.652   0.146
  412   HG21  THR  53          HG21      THR  53  22.875   1.571  -1.145
  413   HG22  THR  53          HG22      THR  53  24.515   1.053  -1.532
  414   HG23  THR  53          HG23      THR  53  23.942   0.991   0.134
  415    H    GLU  54           HN       GLU  54  21.302  -2.272  -1.212
  416    HA   GLU  54           HA       GLU  54  21.042  -4.407  -3.108
  417    HB2  GLU  54           HB2      GLU  54  23.151  -5.118  -2.308
  418    HB3  GLU  54           HB1      GLU  54  22.747  -4.715  -0.645
  419    HG2  GLU  54           HG2      GLU  54  21.118  -6.535  -0.607
  420    HG3  GLU  54           HG1      GLU  54  21.557  -6.956  -2.262
  421    H    ALA  55           HN       ALA  55  19.183  -5.501  -2.782
  422    HA   ALA  55           HA       ALA  55  17.974  -5.782  -0.200
  423    HB1  ALA  55           HB1      ALA  55  15.969  -4.479  -0.612
  424    HB2  ALA  55           HB2      ALA  55  16.601  -3.964  -2.176
  425    HB3  ALA  55           HB3      ALA  55  17.396  -3.445  -0.690
  Start of MODEL   17
    1    H1   ALA 106           HT1      ALA 106   1.093  -5.457  15.053
    2    H2   ALA 106           HT2      ALA 106  -0.101  -5.447  16.252
    3    H3   ALA 106           HT3      ALA 106   0.089  -4.106  15.237
    4    HA   ALA 106           HA       ALA 106  -0.586  -5.394  13.330
    5    HB1  ALA 106           HB1      ALA 106  -1.459  -7.667  13.646
    6    HB2  ALA 106           HB2      ALA 106  -0.964  -7.613  15.337
    7    HB3  ALA 106           HB3      ALA 106   0.252  -7.552  14.060
    8    H    ALA 107           HN       ALA 107  -2.515  -4.633  12.771
    9    HA   ALA 107           HA       ALA 107  -4.760  -4.829  14.627
   10    HB1  ALA 107           HB1      ALA 107  -3.716  -2.648  15.084
   11    HB2  ALA 107           HB2      ALA 107  -5.341  -2.487  14.420
   12    HB3  ALA 107           HB3      ALA 107  -3.936  -2.204  13.392
   13    H    ALA 108           HN       ALA 108  -3.467  -4.739  11.483
   14    HA   ALA 108           HA       ALA 108  -6.147  -4.657  10.274
   15    HB1  ALA 108           HB1      ALA 108  -5.114  -4.095   8.202
   16    HB2  ALA 108           HB2      ALA 108  -3.507  -4.459   8.831
   17    HB3  ALA 108           HB3      ALA 108  -4.398  -3.063   9.441
   18    H    THR 109           HN       THR 109  -5.680  -5.978   7.930
   19    HA   THR 109           HA       THR 109  -5.797  -8.707   8.787
   20    HB   THR 109           HB       THR 109  -7.278  -8.456   7.080
   21    HG1  THR 109           HG1      THR 109  -6.243  -9.276   5.091
   22   HG21  THR 109          HG21      THR 109  -5.417  -6.367   6.124
   23   HG22  THR 109          HG22      THR 109  -7.174  -6.348   6.257
   24   HG23  THR 109          HG23      THR 109  -6.401  -7.169   4.902
   25    H    ASN 110           HN       ASN 110  -4.069  -7.728   5.906
   26    HA   ASN 110           HA       ASN 110  -1.494  -8.504   6.955
   27    HB2  ASN 110           HB2      ASN 110  -3.105 -10.300   5.240
   28    HB3  ASN 110           HB1      ASN 110  -1.431 -10.080   4.749
   29   HD21  ASN 110          HD21      ASN 110   0.198 -10.851   6.020
   30   HD22  ASN 110          HD22      ASN 110  -0.080 -11.937   7.334
   31    HA   PRO 111           HA       PRO 111  -1.178  -5.059   3.974
   32    HB2  PRO 111           HB2      PRO 111   1.425  -4.484   4.671
   33    HB3  PRO 111           HB1      PRO 111   0.001  -3.812   5.467
   34    HG2  PRO 111           HG2      PRO 111   1.699  -6.134   6.295
   35    HG3  PRO 111           HG1      PRO 111   1.027  -4.827   7.289
   36    HD2  PRO 111           HD2      PRO 111  -0.117  -7.239   7.246
   37    HD3  PRO 111           HD1      PRO 111  -1.108  -5.764   7.297
   38    H    ALA 112           HN       ALA 112  -1.301  -6.452   2.261
   39    HA   ALA 112           HA       ALA 112   0.597  -6.610   0.380
   40    HB1  ALA 112           HB1      ALA 112   0.811  -9.090   2.097
   41    HB2  ALA 112           HB2      ALA 112   2.069  -7.886   1.825
   42    HB3  ALA 112           HB3      ALA 112   1.524  -8.903   0.494
   43    H    ARG 113           HN       ARG 113  -1.218  -9.229   1.909
   44    HA   ARG 113           HA       ARG 113  -2.668  -9.856  -0.498
   45    HB2  ARG 113           HB2      ARG 113  -2.431 -10.933   2.233
   46    HB3  ARG 113           HB1      ARG 113  -4.045 -11.071   1.558
   47    HG2  ARG 113           HG2      ARG 113  -2.837 -13.086   1.101
   48    HG3  ARG 113           HG1      ARG 113  -3.081 -12.216  -0.413
   49    HD2  ARG 113           HD2      ARG 113  -0.825 -13.081  -0.314
   50    HD3  ARG 113           HD1      ARG 113  -0.796 -11.319  -0.240
   51    HE   ARG 113           HE       ARG 113  -0.785 -12.565   2.344
   52   HH11  ARG 113          HH11      ARG 113   1.196 -11.543  -0.335
   53   HH12  ARG 113          HH12      ARG 113   2.633 -11.391   0.619
   54   HH21  ARG 113          HH21      ARG 113   1.103 -12.369   3.607
   55   HH22  ARG 113          HH22      ARG 113   2.581 -11.860   2.860
   56    H    TYR 114           HN       TYR 114  -2.901  -7.792   2.145
   57    HA   TYR 114           HA       TYR 114  -5.669  -7.278   2.324
   58    HB2  TYR 114           HB2      TYR 114  -4.435  -6.628   4.171
   59    HB3  TYR 114           HB1      TYR 114  -3.119  -5.998   3.205
   60    HD1  TYR 114           HD1      TYR 114  -6.607  -4.934   2.635
   61    HD2  TYR 114           HD2      TYR 114  -2.895  -4.031   4.512
   62    HE1  TYR 114           HE1      TYR 114  -7.381  -2.652   3.052
   63    HE2  TYR 114           HE2      TYR 114  -3.664  -1.743   4.943
   64    HH   TYR 114           HH       TYR 114  -6.892  -0.796   4.646
   65    H    CYS 115           HN       CYS 115  -3.050  -5.812   0.434
   66    HA   CYS 115           HA       CYS 115  -4.962  -4.012  -0.829
   67    HB2  CYS 115           HB2      CYS 115  -2.084  -4.147  -1.633
   68    HB3  CYS 115           HB1      CYS 115  -3.171  -2.765  -1.587
   69    H    CYS 116           HN       CYS 116  -3.343  -7.000  -1.443
   70    HA   CYS 116           HA       CYS 116  -3.414  -6.965  -4.268
   71    HB2  CYS 116           HB2      CYS 116  -2.061  -8.600  -3.047
   72    HB3  CYS 116           HB1      CYS 116  -3.508  -9.310  -2.356
   73    H    LEU 117           HN       LEU 117  -5.763  -7.865  -1.820
   74    HA   LEU 117           HA       LEU 117  -7.643  -8.907  -3.710
   75    HB2  LEU 117           HB2      LEU 117  -7.633  -8.384  -0.781
   76    HB3  LEU 117           HB1      LEU 117  -9.134  -8.742  -1.595
   77    HG   LEU 117           HG       LEU 117  -6.714 -10.543  -1.571
   78   HD11  LEU 117          HD11      LEU 117  -7.751 -10.352   0.638
   79   HD12  LEU 117          HD12      LEU 117  -7.998 -11.951  -0.064
   80   HD13  LEU 117          HD13      LEU 117  -9.311 -10.776  -0.063
   81   HD21  LEU 117          HD21      LEU 117  -9.518 -11.007  -2.580
   82   HD22  LEU 117          HD22      LEU 117  -8.228 -12.207  -2.525
   83   HD23  LEU 117          HD23      LEU 117  -8.079 -10.800  -3.578
   84    H    SER 118           HN       SER 118  -7.414  -5.950  -1.734
   85    HA   SER 118           HA       SER 118  -9.537  -4.796  -3.408
   86    HB2  SER 118           HB2      SER 118  -8.873  -4.391  -0.501
   87    HB3  SER 118           HB1      SER 118  -9.874  -3.256  -1.397
   88    HG   SER 118           HG       SER 118 -10.602  -5.885  -1.707
   89    H    GLY 119           HN       GLY 119  -6.515  -4.022  -1.672
   90    HA2  GLY 119           HA2      GLY 119  -4.874  -2.727  -2.990
   91    HA3  GLY 119           HA1      GLY 119  -6.219  -1.707  -3.489
   92    H    CYS 120           HN       CYS 120  -3.935  -0.605  -2.300
   93    HA   CYS 120           HA       CYS 120  -5.106   0.333   0.208
   94    HB2  CYS 120           HB2      CYS 120  -2.221  -0.447  -0.141
   95    HB3  CYS 120           HB1      CYS 120  -2.849   0.432   1.241
   96    H    THR 121           HN       THR 121  -4.962   2.422   0.671
   97    HA   THR 121           HA       THR 121  -4.285   4.219  -1.450
   98    HB   THR 121           HB       THR 121  -4.868   6.002   0.163
   99    HG1  THR 121           HG1      THR 121  -5.918   4.935   2.173
  100   HG21  THR 121          HG21      THR 121  -6.507   4.287  -1.079
  101   HG22  THR 121          HG22      THR 121  -7.053   5.719  -0.213
  102   HG23  THR 121          HG23      THR 121  -7.083   4.137   0.577
  103    H    GLN 122           HN       GLN 122  -2.748   5.910  -1.345
  104    HA   GLN 122           HA       GLN 122  -0.196   5.212  -0.495
  105    HB2  GLN 122           HB2      GLN 122  -1.494   7.873  -1.106
  106    HB3  GLN 122           HB1      GLN 122   0.193   7.754  -0.644
  107    HG2  GLN 122           HG2      GLN 122   0.806   6.730  -2.597
  108    HG3  GLN 122           HG1      GLN 122  -0.794   6.056  -2.866
  109   HE21  GLN 122          HE21      GLN 122  -0.243   9.400  -2.036
  110   HE22  GLN 122          HE22      GLN 122  -0.697  10.060  -3.566
  111    H    GLN 123           HN       GLN 123  -2.912   6.384   1.257
  112    HA   GLN 123           HA       GLN 123  -1.508   7.494   3.465
  113    HB2  GLN 123           HB2      GLN 123  -4.290   6.604   2.927
  114    HB3  GLN 123           HB1      GLN 123  -3.783   6.745   4.604
  115    HG2  GLN 123           HG2      GLN 123  -3.448   8.967   2.619
  116    HG3  GLN 123           HG1      GLN 123  -4.900   8.760   3.586
  117   HE21  GLN 123          HE21      GLN 123  -1.530   9.564   3.620
  118   HE22  GLN 123          HE22      GLN 123  -1.492  10.227   5.214
  119    H    ASP 124           HN       ASP 124  -3.101   4.354   2.892
  120    HA   ASP 124           HA       ASP 124  -2.299   3.093   5.248
  121    HB2  ASP 124           HB2      ASP 124  -3.420   2.302   2.709
  122    HB3  ASP 124           HB1      ASP 124  -2.188   1.140   3.190
  123    H    LEU 125           HN       LEU 125  -0.756   3.065   2.063
  124    HA   LEU 125           HA       LEU 125   1.555   1.691   2.806
  125    HB2  LEU 125           HB2      LEU 125   1.111   3.680   0.568
  126    HB3  LEU 125           HB1      LEU 125   2.491   2.627   0.692
  127    HG   LEU 125           HG       LEU 125   0.201   0.983   0.914
  128   HD11  LEU 125          HD11      LEU 125  -1.384   2.003  -0.255
  129   HD12  LEU 125          HD12      LEU 125  -0.338   1.868  -1.670
  130   HD13  LEU 125          HD13      LEU 125  -0.298   3.326  -0.678
  131   HD21  LEU 125          HD21      LEU 125   2.457   0.510  -0.105
  132   HD22  LEU 125          HD22      LEU 125   1.886   1.377  -1.534
  133   HD23  LEU 125          HD23      LEU 125   1.059  -0.088  -1.000
  134    H    LEU 126           HN       LEU 126   0.660   5.062   3.142
  135    HA   LEU 126           HA       LEU 126   3.222   6.128   3.651
  136    HB2  LEU 126           HB2      LEU 126   0.427   6.977   4.104
  137    HB3  LEU 126           HB1      LEU 126   1.602   7.684   5.190
  138    HG   LEU 126           HG       LEU 126   1.631   7.869   2.176
  139   HD11  LEU 126          HD11      LEU 126   1.025   9.901   4.316
  140   HD12  LEU 126          HD12      LEU 126  -0.103   9.232   3.137
  141   HD13  LEU 126          HD13      LEU 126   1.222  10.264   2.600
  142   HD21  LEU 126          HD21      LEU 126   3.499   9.427   2.491
  143   HD22  LEU 126          HD22      LEU 126   3.899   7.812   3.078
  144   HD23  LEU 126          HD23      LEU 126   3.488   9.089   4.222
  145    H    THR 127           HN       THR 127   0.948   4.343   5.574
  146    HA   THR 127           HA       THR 127   2.574   4.750   7.974
  147    HB   THR 127           HB       THR 127   0.741   4.462   9.237
  148    HG1  THR 127           HG1      THR 127  -0.916   2.778   8.236
  149   HG21  THR 127          HG21      THR 127  -0.023   5.904   7.247
  150   HG22  THR 127          HG22      THR 127  -1.260   5.228   8.302
  151   HG23  THR 127          HG23      THR 127  -0.926   4.477   6.742
  152    H    LEU 128           HN       LEU 128   2.535   2.650   5.416
  153    HA   LEU 128           HA       LEU 128   2.930   0.254   7.025
  154    HB2  LEU 128           HB2      LEU 128   2.795   0.711   4.064
  155    HB3  LEU 128           HB1      LEU 128   3.173  -0.834   4.783
  156    HG   LEU 128           HG       LEU 128   0.647   0.641   5.461
  157   HD11  LEU 128          HD11      LEU 128  -0.322  -1.137   3.822
  158   HD12  LEU 128          HD12      LEU 128   1.285  -1.048   3.102
  159   HD13  LEU 128          HD13      LEU 128   0.286   0.399   3.207
  160   HD21  LEU 128          HD21      LEU 128   1.013  -1.030   7.020
  161   HD22  LEU 128          HD22      LEU 128   1.721  -2.106   5.820
  162   HD23  LEU 128          HD23      LEU 128  -0.017  -1.823   5.825
  163    H    CYS 129           HN       CYS 129   4.750   2.696   5.362
  164    HA   CYS 129           HA       CYS 129   7.177   1.208   5.162
  165    HB2  CYS 129           HB2      CYS 129   8.257   3.277   4.634
  166    HB3  CYS 129           HB1      CYS 129   6.679   3.298   3.864
  167    HA   PRO 130           HA       PRO 130   8.618   1.524   9.322
  168    HB2  PRO 130           HB2      PRO 130  11.385   1.477   8.577
  169    HB3  PRO 130           HB1      PRO 130  10.372   0.125   9.085
  170    HG2  PRO 130           HG2      PRO 130  11.414   0.427   6.550
  171    HG3  PRO 130           HG1      PRO 130   9.984  -0.544   6.941
  172    HD2  PRO 130           HD2      PRO 130  10.146   2.235   5.833
  173    HD3  PRO 130           HD1      PRO 130   9.032   0.916   5.403
  174    H    TYR 131           HN       TYR 131   8.645   4.114   7.483
  175    HA   TYR 131           HA       TYR 131  10.047   5.729   9.486
  176    HB2  TYR 131           HB2      TYR 131  10.387   6.082   6.499
  177    HB3  TYR 131           HB1      TYR 131  11.053   7.139   7.739
  178    HD1  TYR 131           HD1      TYR 131  12.815   6.244   9.289
  179    HD2  TYR 131           HD2      TYR 131  11.490   4.086   5.870
  180    HE1  TYR 131           HE1      TYR 131  14.836   4.848   9.394
  181    HE2  TYR 131           HE2      TYR 131  13.507   2.683   5.967
  182    HH   TYR 131           HH       TYR 131  15.594   2.646   8.654
  183    H2   PRO  25           HT1      PRO  25  -0.185  13.344  -6.575
  184    H3   PRO  25           HT2      PRO  25   0.572  14.708  -7.059
  185    HA   PRO  25           HA       PRO  25  -1.080  15.091  -8.295
  186    HB2  PRO  25           HB2      PRO  25  -0.907  12.922 -10.186
  187    HB3  PRO  25           HB1      PRO  25  -0.432  14.614 -10.391
  188    HG2  PRO  25           HG2      PRO  25   1.356  12.551 -10.239
  189    HG3  PRO  25           HG1      PRO  25   1.728  14.219  -9.771
  190    HD2  PRO  25           HD2      PRO  25   0.988  11.880  -8.035
  191    HD3  PRO  25           HD1      PRO  25   2.243  13.109  -7.783
  192    H    THR  26           HN       THR  26  -0.954  11.543  -7.976
  193    HA   THR  26           HA       THR  26  -3.776  11.231  -8.251
  194    HB   THR  26           HB       THR  26  -3.384   8.895  -7.528
  195    HG1  THR  26           HG1      THR  26  -1.497   8.296  -6.689
  196   HG21  THR  26          HG21      THR  26  -1.971   8.236  -9.410
  197   HG22  THR  26          HG22      THR  26  -1.388   9.894  -9.562
  198   HG23  THR  26          HG23      THR  26  -3.082   9.522  -9.882
  199    HA   PRO  27           HA       PRO  27  -4.655  11.954  -3.923
  200    HB2  PRO  27           HB2      PRO  27  -7.303  12.126  -4.134
  201    HB3  PRO  27           HB1      PRO  27  -6.260  13.339  -4.884
  202    HG2  PRO  27           HG2      PRO  27  -7.804  11.139  -6.138
  203    HG3  PRO  27           HG1      PRO  27  -7.349  12.716  -6.803
  204    HD2  PRO  27           HD2      PRO  27  -6.047  10.199  -7.210
  205    HD3  PRO  27           HD1      PRO  27  -5.540  11.794  -7.807
  206    H    GLU  28           HN       GLU  28  -3.842   9.536  -3.801
  207    HA   GLU  28           HA       GLU  28  -4.157   7.327  -3.363
  208    HB2  GLU  28           HB2      GLU  28  -5.380   7.082  -1.218
  209    HB3  GLU  28           HB1      GLU  28  -4.078   8.231  -1.224
  210    HG2  GLU  28           HG2      GLU  28  -5.680  10.060  -1.401
  211    HG3  GLU  28           HG1      GLU  28  -7.004   8.896  -1.409
  212    H    MET  29           HN       MET  29  -5.256   6.987  -5.343
  213    HA   MET  29           HA       MET  29  -8.129   6.768  -5.317
  214    HB2  MET  29           HB2      MET  29  -6.735   7.472  -7.323
  215    HB3  MET  29           HB1      MET  29  -6.259   5.784  -7.463
  216    HG2  MET  29           HG2      MET  29  -8.513   5.110  -7.882
  217    HG3  MET  29           HG1      MET  29  -9.112   6.731  -7.532
  218    HE1  MET  29           HE1      MET  29  -8.792   8.824  -9.158
  219    HE2  MET  29           HE2      MET  29  -7.698   8.791 -10.541
  220    HE3  MET  29           HE3      MET  29  -7.061   8.601  -8.908
  221    H    ARG  30           HN       ARG  30  -6.142   5.077  -3.725
  222    HA   ARG  30           HA       ARG  30  -5.777   2.875  -3.142
  223    HB2  ARG  30           HB2      ARG  30  -8.164   3.858  -2.379
  224    HB3  ARG  30           HB1      ARG  30  -8.663   2.415  -3.256
  225    HG2  ARG  30           HG2      ARG  30  -6.480   1.728  -1.592
  226    HG3  ARG  30           HG1      ARG  30  -7.661   2.617  -0.626
  227    HD2  ARG  30           HD2      ARG  30  -9.399   1.131  -1.680
  228    HD3  ARG  30           HD1      ARG  30  -8.057   0.127  -2.226
  229    HE   ARG  30           HE       ARG  30  -7.616   0.417   0.434
  230   HH11  ARG  30          HH11      ARG  30 -10.346  -0.646  -1.450
  231   HH12  ARG  30          HH12      ARG  30 -10.925  -1.735  -0.235
  232   HH21  ARG  30          HH21      ARG  30  -8.372  -1.013   2.041
  233   HH22  ARG  30          HH22      ARG  30  -9.802  -1.945   1.750
  234    H    GLU  31           HN       GLU  31  -4.837   1.736  -4.812
  235    HA   GLU  31           HA       GLU  31  -6.719   0.213  -6.484
  236    HB2  GLU  31           HB2      GLU  31  -5.046   0.137  -8.245
  237    HB3  GLU  31           HB1      GLU  31  -5.385   1.809  -7.820
  238    HG2  GLU  31           HG2      GLU  31  -3.359   1.932  -6.526
  239    HG3  GLU  31           HG1      GLU  31  -3.044   0.224  -6.821
  240    H    LYS  32           HN       LYS  32  -6.053  -1.888  -7.093
  241    HA   LYS  32           HA       LYS  32  -5.342  -3.409  -4.876
  242    HB2  LYS  32           HB2      LYS  32  -5.345  -4.274  -7.751
  243    HB3  LYS  32           HB1      LYS  32  -5.548  -5.280  -6.331
  244    HG2  LYS  32           HG2      LYS  32  -7.582  -3.898  -5.795
  245    HG3  LYS  32           HG1      LYS  32  -7.437  -3.236  -7.417
  246    HD2  LYS  32           HD2      LYS  32  -7.705  -5.407  -8.402
  247    HD3  LYS  32           HD1      LYS  32  -7.635  -6.187  -6.822
  248    HE2  LYS  32           HE2      LYS  32  -9.693  -5.038  -6.188
  249    HE3  LYS  32           HE1      LYS  32  -9.773  -4.289  -7.779
  250    HZ1  LYS  32           HZ1      LYS  32 -11.205  -6.207  -7.691
  251    HZ2  LYS  32           HZ2      LYS  32  -9.926  -7.198  -7.197
  252    HZ3  LYS  32           HZ3      LYS  32  -9.921  -6.522  -8.747
  253    H    LEU  33           HN       LEU  33  -3.466  -3.382  -3.979
  254    HA   LEU  33           HA       LEU  33  -1.009  -3.497  -5.555
  255    HB2  LEU  33           HB2      LEU  33  -1.065  -3.109  -2.624
  256    HB3  LEU  33           HB1      LEU  33   0.071  -2.574  -3.829
  257    HG   LEU  33           HG       LEU  33  -2.681  -1.438  -3.555
  258   HD11  LEU  33          HD11      LEU  33  -1.927   0.166  -2.158
  259   HD12  LEU  33          HD12      LEU  33  -0.303   0.154  -2.837
  260   HD13  LEU  33          HD13      LEU  33  -0.790  -1.098  -1.694
  261   HD21  LEU  33          HD21      LEU  33  -2.185  -0.109  -5.314
  262   HD22  LEU  33          HD22      LEU  33  -1.100  -1.447  -5.721
  263   HD23  LEU  33          HD23      LEU  33  -0.473  -0.015  -4.895
  264    H    CYS  34           HN       CYS  34  -0.805  -5.622  -6.074
  265    HA   CYS  34           HA       CYS  34  -0.984  -7.587  -3.922
  266    HB2  CYS  34           HB2      CYS  34  -2.042  -7.860  -6.240
  267    HB3  CYS  34           HB1      CYS  34  -0.420  -8.248  -6.793
  268    H    GLY  35           HN       GLY  35   0.823  -7.194  -2.784
  269    HA2  GLY  35           HA2      GLY  35   3.010  -7.445  -2.146
  270    HA3  GLY  35           HA1      GLY  35   3.170  -8.558  -3.485
  271    H    HIS  36           HN       HIS  36   3.673  -7.598  -5.647
  272    HA   HIS  36           HA       HIS  36   5.737  -5.718  -5.423
  273    HB2  HIS  36           HB2      HIS  36   5.278  -7.535  -7.263
  274    HB3  HIS  36           HB1      HIS  36   4.449  -6.202  -8.070
  275    HD1  HIS  36           HD1      HIS  36   6.381  -6.260  -9.907
  276    HD2  HIS  36           HD2      HIS  36   7.562  -5.226  -6.051
  277    HE1  HIS  36           HE1      HIS  36   8.677  -5.234 -10.125
  278    H    HIS  37           HN       HIS  37   2.469  -5.350  -6.917
  279    HA   HIS  37           HA       HIS  37   2.705  -2.609  -7.456
  280    HB2  HIS  37           HB2      HIS  37   0.375  -4.379  -6.806
  281    HB3  HIS  37           HB1      HIS  37   0.141  -2.633  -6.814
  282    HD1  HIS  37           HD1      HIS  37  -1.071  -2.198  -8.957
  283    HD2  HIS  37           HD2      HIS  37   2.129  -4.789  -9.389
  284    HE1  HIS  37           HE1      HIS  37  -0.865  -2.630 -11.429
  285    H    PHE  38           HN       PHE  38   1.997  -4.442  -4.649
  286    HA   PHE  38           HA       PHE  38   1.353  -2.313  -2.915
  287    HB2  PHE  38           HB2      PHE  38   0.604  -4.544  -2.442
  288    HB3  PHE  38           HB1      PHE  38   2.246  -5.154  -2.449
  289    HD1  PHE  38           HD2      PHE  38   0.516  -2.308  -0.878
  290    HD2  PHE  38           HD1      PHE  38   2.920  -5.779  -0.326
  291    HE1  PHE  38           HE2      PHE  38   0.640  -1.828   1.528
  292    HE2  PHE  38           HE1      PHE  38   3.057  -5.307   2.092
  293    HZ   PHE  38           HZ       PHE  38   1.919  -3.317   3.029
  294    H    VAL  39           HN       VAL  39   4.248  -3.753  -4.053
  295    HA   VAL  39           HA       VAL  39   5.974  -2.607  -2.097
  296    HB   VAL  39           HB       VAL  39   6.301  -4.147  -4.609
  297   HG11  VAL  39          HG11      VAL  39   7.942  -2.900  -5.457
  298   HG12  VAL  39          HG12      VAL  39   8.904  -3.434  -4.081
  299   HG13  VAL  39          HG13      VAL  39   8.046  -1.904  -4.005
  300   HG21  VAL  39          HG21      VAL  39   6.407  -4.930  -2.149
  301   HG22  VAL  39          HG22      VAL  39   8.045  -4.275  -2.192
  302   HG23  VAL  39          HG23      VAL  39   7.581  -5.560  -3.306
  303    H    ARG  40           HN       ARG  40   5.727  -1.936  -5.610
  304    HA   ARG  40           HA       ARG  40   7.021   0.441  -5.704
  305    HB2  ARG  40           HB2      ARG  40   4.529  -0.379  -7.208
  306    HB3  ARG  40           HB1      ARG  40   5.509   1.025  -7.616
  307    HG2  ARG  40           HG2      ARG  40   6.693  -0.313  -8.914
  308    HG3  ARG  40           HG1      ARG  40   7.328  -1.061  -7.459
  309    HD2  ARG  40           HD2      ARG  40   5.803  -2.801  -7.560
  310    HD3  ARG  40           HD1      ARG  40   4.734  -1.943  -8.664
  311    HE   ARG  40           HE       ARG  40   7.403  -2.741  -9.575
  312   HH11  ARG  40          HH11      ARG  40   3.937  -3.070  -9.755
  313   HH12  ARG  40          HH12      ARG  40   3.972  -3.958 -11.240
  314   HH21  ARG  40          HH21      ARG  40   7.455  -3.905 -11.530
  315   HH22  ARG  40          HH22      ARG  40   5.970  -4.431 -12.251
  316    H    ALA  41           HN       ALA  41   3.416   0.230  -5.274
  317    HA   ALA  41           HA       ALA  41   3.054   2.934  -4.811
  318    HB1  ALA  41           HB1      ALA  41   0.995   2.364  -3.691
  319    HB2  ALA  41           HB2      ALA  41   1.546   0.718  -3.373
  320    HB3  ALA  41           HB3      ALA  41   1.225   1.240  -5.029
  321    H    LEU  42           HN       LEU  42   3.939   0.374  -2.452
  322    HA   LEU  42           HA       LEU  42   3.928   1.862  -0.133
  323    HB2  LEU  42           HB2      LEU  42   4.833  -0.634  -0.840
  324    HB3  LEU  42           HB1      LEU  42   6.316   0.181  -0.399
  325    HG   LEU  42           HG       LEU  42   3.913  -0.343   1.338
  326   HD11  LEU  42          HD11      LEU  42   5.296  -2.203   1.407
  327   HD12  LEU  42          HD12      LEU  42   5.850  -1.248   2.783
  328   HD13  LEU  42          HD13      LEU  42   6.767  -1.237   1.279
  329   HD21  LEU  42          HD21      LEU  42   4.366   1.732   2.142
  330   HD22  LEU  42          HD22      LEU  42   6.029   1.704   1.561
  331   HD23  LEU  42          HD23      LEU  42   5.597   0.833   3.032
  332    H    VAL  43           HN       VAL  43   6.394   1.693  -2.609
  333    HA   VAL  43           HA       VAL  43   8.206   3.475  -1.300
  334    HB   VAL  43           HB       VAL  43   8.464   3.171  -4.240
  335   HG11  VAL  43          HG11      VAL  43  10.718   3.082  -3.768
  336   HG12  VAL  43          HG12      VAL  43  10.451   2.269  -2.220
  337   HG13  VAL  43          HG13      VAL  43  10.138   4.006  -2.375
  338   HG21  VAL  43          HG21      VAL  43   7.548   1.010  -3.803
  339   HG22  VAL  43          HG22      VAL  43   8.601   0.808  -2.400
  340   HG23  VAL  43          HG23      VAL  43   9.289   0.844  -4.024
  341    H    ARG  44           HN       ARG  44   6.426   3.783  -4.340
  342    HA   ARG  44           HA       ARG  44   6.576   6.333  -5.059
  343    HB2  ARG  44           HB2      ARG  44   3.892   5.010  -4.592
  344    HB3  ARG  44           HB1      ARG  44   4.262   6.212  -5.804
  345    HG2  ARG  44           HG2      ARG  44   6.033   4.153  -6.335
  346    HG3  ARG  44           HG1      ARG  44   4.519   3.352  -5.907
  347    HD2  ARG  44           HD2      ARG  44   3.427   5.027  -7.516
  348    HD3  ARG  44           HD1      ARG  44   5.061   5.296  -8.112
  349    HE   ARG  44           HE       ARG  44   4.170   2.536  -8.012
  350   HH11  ARG  44          HH11      ARG  44   4.616   5.414  -9.927
  351   HH12  ARG  44          HH12      ARG  44   4.587   4.568 -11.437
  352   HH21  ARG  44          HH21      ARG  44   4.132   1.415  -9.995
  353   HH22  ARG  44          HH22      ARG  44   4.310   2.295 -11.476
  354    H    VAL  45           HN       VAL  45   4.781   5.074  -2.396
  355    HA   VAL  45           HA       VAL  45   3.691   7.494  -1.389
  356    HB   VAL  45           HB       VAL  45   4.058   4.750  -0.178
  357   HG11  VAL  45          HG11      VAL  45   3.746   6.775   1.396
  358   HG12  VAL  45          HG12      VAL  45   2.770   5.327   1.605
  359   HG13  VAL  45          HG13      VAL  45   2.083   6.742   0.810
  360   HG21  VAL  45          HG21      VAL  45   1.387   5.665  -0.859
  361   HG22  VAL  45          HG22      VAL  45   2.183   4.119  -1.152
  362   HG23  VAL  45          HG23      VAL  45   2.458   5.475  -2.246
  363    H    CYS  46           HN       CYS  46   5.891   5.196   0.119
  364    HA   CYS  46           HA       CYS  46   7.280   7.386   1.525
  365    HB2  CYS  46           HB2      CYS  46   5.554   5.991   2.804
  366    HB3  CYS  46           HB1      CYS  46   6.684   4.666   2.662
  367    H    GLY  47           HN       GLY  47   7.436   3.885   1.021
  368    HA2  GLY  47           HA2      GLY  47   9.278   2.873  -0.219
  369    HA3  GLY  47           HA1      GLY  47  10.318   4.167   0.357
  370    H    GLY  48           HN       GLY  48   8.900   1.106   1.039
  371    HA2  GLY  48           HA2      GLY  48   9.277   0.764   3.726
  372    HA3  GLY  48           HA1      GLY  48   9.448  -0.504   2.565
  373    HA   PRO  49           HA       PRO  49  13.740  -0.552   3.701
  374    HB2  PRO  49           HB2      PRO  49  14.437  -2.619   2.236
  375    HB3  PRO  49           HB1      PRO  49  13.155  -2.833   3.437
  376    HG2  PRO  49           HG2      PRO  49  12.887  -2.364   0.487
  377    HG3  PRO  49           HG1      PRO  49  12.085  -3.588   1.496
  378    HD2  PRO  49           HD2      PRO  49  10.974  -1.146   0.842
  379    HD3  PRO  49           HD1      PRO  49  10.507  -2.089   2.241
  380    H    ARG  50           HN       ARG  50  15.875  -0.637   2.479
  381    HA   ARG  50           HA       ARG  50  15.737   1.337   0.384
  382    HB2  ARG  50           HB2      ARG  50  17.535   1.941   1.503
  383    HB3  ARG  50           HB1      ARG  50  17.838   0.332   2.130
  384    HG2  ARG  50           HG2      ARG  50  18.742  -0.245  -0.153
  385    HG3  ARG  50           HG1      ARG  50  18.651   1.476  -0.523
  386    HD2  ARG  50           HD2      ARG  50  20.129   1.960   1.362
  387    HD3  ARG  50           HD1      ARG  50  20.219   0.239   1.737
  388    HE   ARG  50           HE       ARG  50  21.025   0.858  -0.945
  389   HH11  ARG  50          HH11      ARG  50  22.071   0.670   2.374
  390   HH12  ARG  50          HH12      ARG  50  23.741   0.453   1.969
  391   HH21  ARG  50          HH21      ARG  50  23.220   0.575  -1.487
  392   HH22  ARG  50          HH22      ARG  50  24.395   0.402  -0.224
  393    H    TRP  51           HN       TRP  51  15.358   0.870  -1.442
  394    HA   TRP  51           HA       TRP  51  15.349  -1.692  -2.597
  395    HB2  TRP  51           HB2      TRP  51  14.973   0.944  -3.972
  396    HB3  TRP  51           HB1      TRP  51  14.261  -0.609  -4.379
  397    HD1  TRP  51           HD1      TRP  51  13.989   2.142  -1.658
  398    HE1  TRP  51           HE1      TRP  51  11.687   1.880  -0.536
  399    HE3  TRP  51           HE3      TRP  51  12.567  -2.140  -3.890
  400    HZ2  TRP  51           HZ2      TRP  51   9.541   0.015  -0.605
  401    HZ3  TRP  51           HZ3      TRP  51  10.402  -3.135  -3.299
  402    HH2  TRP  51           HH2      TRP  51   8.910  -2.031  -1.677
  403    H    SER  52           HN       SER  52  16.773   1.174  -4.152
  404    HA   SER  52           HA       SER  52  19.308  -0.189  -4.511
  405    HB2  SER  52           HB2      SER  52  17.643   0.580  -6.914
  406    HB3  SER  52           HB1      SER  52  19.261  -0.116  -6.943
  407    HG   SER  52           HG       SER  52  16.809  -1.321  -6.359
  408    H    THR  53           HN       THR  53  20.941   1.158  -4.584
  409    HA   THR  53           HA       THR  53  20.707   3.817  -5.677
  410    HB   THR  53           HB       THR  53  21.705   4.851  -3.615
  411    HG1  THR  53           HG1      THR  53  21.911   2.544  -2.689
  412   HG21  THR  53          HG21      THR  53  18.863   3.852  -3.415
  413   HG22  THR  53          HG22      THR  53  19.398   5.295  -4.276
  414   HG23  THR  53          HG23      THR  53  19.535   5.216  -2.519
  415    H    GLU  54           HN       GLU  54  22.195   2.701  -7.036
  416    HA   GLU  54           HA       GLU  54  24.790   1.967  -6.018
  417    HB2  GLU  54           HB2      GLU  54  23.781   2.159  -8.861
  418    HB3  GLU  54           HB1      GLU  54  25.319   1.465  -8.371
  419    HG2  GLU  54           HG2      GLU  54  24.148  -0.262  -7.111
  420    HG3  GLU  54           HG1      GLU  54  22.602   0.437  -7.587
  421    H    ALA  55           HN       ALA  55  23.368   4.846  -6.648
  422    HA   ALA  55           HA       ALA  55  24.078   6.963  -7.091
  423    HB1  ALA  55           HB1      ALA  55  26.268   7.567  -6.186
  424    HB2  ALA  55           HB2      ALA  55  26.680   5.859  -6.040
  425    HB3  ALA  55           HB3      ALA  55  25.370   6.536  -5.072
  Start of MODEL   18
    1    H1   ALA 106           HT1      ALA 106   2.215  -4.982   9.610
    2    H2   ALA 106           HT2      ALA 106   3.860  -4.804   9.256
    3    H3   ALA 106           HT3      ALA 106   3.025  -3.561  10.044
    4    HA   ALA 106           HA       ALA 106   3.526  -6.264  11.144
    5    HB1  ALA 106           HB1      ALA 106   5.066  -5.144  12.683
    6    HB2  ALA 106           HB2      ALA 106   4.793  -3.619  11.842
    7    HB3  ALA 106           HB3      ALA 106   5.574  -4.960  11.005
    8    H    ALA 107           HN       ALA 107   1.978  -3.143  11.413
    9    HA   ALA 107           HA       ALA 107   0.875  -3.821  14.035
   10    HB1  ALA 107           HB1      ALA 107   0.046  -1.531  14.078
   11    HB2  ALA 107           HB2      ALA 107   0.607  -1.286  12.424
   12    HB3  ALA 107           HB3      ALA 107   1.772  -1.566  13.718
   13    H    ALA 108           HN       ALA 108   0.140  -4.637  11.016
   14    HA   ALA 108           HA       ALA 108  -2.750  -4.645  11.560
   15    HB1  ALA 108           HB1      ALA 108  -3.291  -4.090   9.329
   16    HB2  ALA 108           HB2      ALA 108  -1.623  -4.282   8.794
   17    HB3  ALA 108           HB3      ALA 108  -2.064  -2.925   9.832
   18    H    THR 109           HN       THR 109  -3.452  -6.044   9.212
   19    HA   THR 109           HA       THR 109  -2.806  -8.708  10.021
   20    HB   THR 109           HB       THR 109  -4.959  -8.659   9.247
   21    HG1  THR 109           HG1      THR 109  -4.337 -10.323   8.048
   22   HG21  THR 109          HG21      THR 109  -3.999  -6.500   7.496
   23   HG22  THR 109          HG22      THR 109  -5.547  -6.695   8.319
   24   HG23  THR 109          HG23      THR 109  -5.252  -7.523   6.792
   25    H    ASN 110           HN       ASN 110  -2.831  -7.775   6.665
   26    HA   ASN 110           HA       ASN 110   0.001  -8.226   6.298
   27    HB2  ASN 110           HB2      ASN 110  -2.053 -10.018   4.960
   28    HB3  ASN 110           HB1      ASN 110  -0.334  -9.986   4.592
   29   HD21  ASN 110          HD21      ASN 110   1.105 -10.928   5.976
   30   HD22  ASN 110          HD22      ASN 110   0.615 -11.955   7.272
   31    HA   PRO 111           HA       PRO 111  -1.840  -4.848   3.780
   32    HB2  PRO 111           HB2      PRO 111   0.560  -3.562   3.473
   33    HB3  PRO 111           HB1      PRO 111  -0.546  -3.310   4.822
   34    HG2  PRO 111           HG2      PRO 111   1.880  -5.062   4.675
   35    HG3  PRO 111           HG1      PRO 111   1.373  -3.957   5.969
   36    HD2  PRO 111           HD2      PRO 111   0.954  -6.580   6.180
   37    HD3  PRO 111           HD1      PRO 111  -0.269  -5.418   6.740
   38    H    ALA 112           HN       ALA 112   0.278  -7.365   3.056
   39    HA   ALA 112           HA       ALA 112   0.809  -6.480   0.337
   40    HB1  ALA 112           HB1      ALA 112   1.385  -9.202   1.478
   41    HB2  ALA 112           HB2      ALA 112   2.432  -7.812   1.752
   42    HB3  ALA 112           HB3      ALA 112   2.163  -8.398   0.112
   43    H    ARG 113           HN       ARG 113  -0.895  -9.082   1.978
   44    HA   ARG 113           HA       ARG 113  -2.272  -9.982  -0.377
   45    HB2  ARG 113           HB2      ARG 113  -2.220 -10.675   2.513
   46    HB3  ARG 113           HB1      ARG 113  -3.608 -11.186   1.574
   47    HG2  ARG 113           HG2      ARG 113  -1.856 -12.153  -0.058
   48    HG3  ARG 113           HG1      ARG 113  -0.746 -11.994   1.305
   49    HD2  ARG 113           HD2      ARG 113  -3.336 -13.524   1.276
   50    HD3  ARG 113           HD1      ARG 113  -1.716 -14.222   1.240
   51    HE   ARG 113           HE       ARG 113  -1.588 -12.856   3.500
   52   HH11  ARG 113          HH11      ARG 113  -4.160 -14.861   2.272
   53   HH12  ARG 113          HH12      ARG 113  -4.725 -15.321   3.843
   54   HH21  ARG 113          HH21      ARG 113  -2.325 -13.455   5.572
   55   HH22  ARG 113          HH22      ARG 113  -3.683 -14.521   5.720
   56    H    TYR 114           HN       TYR 114  -2.797  -7.746   2.164
   57    HA   TYR 114           HA       TYR 114  -5.619  -7.499   1.995
   58    HB2  TYR 114           HB2      TYR 114  -4.950  -6.782   4.026
   59    HB3  TYR 114           HB1      TYR 114  -3.384  -6.266   3.446
   60    HD1  TYR 114           HD1      TYR 114  -6.559  -4.886   2.099
   61    HD2  TYR 114           HD2      TYR 114  -3.292  -4.334   4.762
   62    HE1  TYR 114           HE1      TYR 114  -7.205  -2.545   2.399
   63    HE2  TYR 114           HE2      TYR 114  -3.925  -1.995   5.082
   64    HH   TYR 114           HH       TYR 114  -6.914  -0.752   4.109
   65    H    CYS 115           HN       CYS 115  -2.991  -5.328   0.822
   66    HA   CYS 115           HA       CYS 115  -4.846  -3.701  -0.594
   67    HB2  CYS 115           HB2      CYS 115  -1.916  -3.923  -1.294
   68    HB3  CYS 115           HB1      CYS 115  -2.999  -2.557  -1.523
   69    H    CYS 116           HN       CYS 116  -3.261  -6.685  -1.299
   70    HA   CYS 116           HA       CYS 116  -3.303  -6.607  -4.102
   71    HB2  CYS 116           HB2      CYS 116  -2.063  -8.336  -2.948
   72    HB3  CYS 116           HB1      CYS 116  -3.527  -8.954  -2.207
   73    H    LEU 117           HN       LEU 117  -5.686  -7.997  -1.839
   74    HA   LEU 117           HA       LEU 117  -7.558  -8.525  -3.943
   75    HB2  LEU 117           HB2      LEU 117  -7.423  -8.928  -1.025
   76    HB3  LEU 117           HB1      LEU 117  -9.021  -8.835  -1.727
   77    HG   LEU 117           HG       LEU 117  -6.877 -10.779  -2.590
   78   HD11  LEU 117          HD11      LEU 117  -9.332 -11.253  -0.905
   79   HD12  LEU 117          HD12      LEU 117  -7.674 -11.212  -0.305
   80   HD13  LEU 117          HD13      LEU 117  -8.172 -12.471  -1.436
   81   HD21  LEU 117          HD21      LEU 117  -8.698 -11.874  -3.800
   82   HD22  LEU 117          HD22      LEU 117  -8.453 -10.222  -4.367
   83   HD23  LEU 117          HD23      LEU 117  -9.804 -10.596  -3.297
   84    H    SER 118           HN       SER 118  -7.134  -6.015  -1.508
   85    HA   SER 118           HA       SER 118  -9.603  -4.729  -2.434
   86    HB2  SER 118           HB2      SER 118  -7.999  -4.428   0.102
   87    HB3  SER 118           HB1      SER 118  -9.306  -3.335  -0.341
   88    HG   SER 118           HG       SER 118  -9.814  -5.241   1.041
   89    H    GLY 119           HN       GLY 119  -6.343  -3.731  -1.348
   90    HA2  GLY 119           HA2      GLY 119  -5.003  -2.418  -2.960
   91    HA3  GLY 119           HA1      GLY 119  -6.482  -1.537  -3.331
   92    H    CYS 120           HN       CYS 120  -4.138  -0.200  -2.488
   93    HA   CYS 120           HA       CYS 120  -5.137   0.891   0.012
   94    HB2  CYS 120           HB2      CYS 120  -2.301  -0.050  -0.328
   95    HB3  CYS 120           HB1      CYS 120  -2.866   0.936   1.011
   96    H    THR 121           HN       THR 121  -4.652   2.994   0.468
   97    HA   THR 121           HA       THR 121  -3.936   4.612  -1.833
   98    HB   THR 121           HB       THR 121  -4.663   6.505  -0.581
   99    HG1  THR 121           HG1      THR 121  -4.678   6.551   1.558
  100   HG21  THR 121          HG21      THR 121  -6.349   4.807  -1.376
  101   HG22  THR 121          HG22      THR 121  -6.906   6.011  -0.225
  102   HG23  THR 121          HG23      THR 121  -6.548   4.368   0.311
  103    H    GLN 122           HN       GLN 122  -2.588   6.574  -1.389
  104    HA   GLN 122           HA       GLN 122  -0.003   5.776  -0.511
  105    HB2  GLN 122           HB2      GLN 122  -1.256   8.325  -1.469
  106    HB3  GLN 122           HB1      GLN 122   0.302   8.402  -0.667
  107    HG2  GLN 122           HG2      GLN 122   1.344   7.104  -2.315
  108    HG3  GLN 122           HG1      GLN 122  -0.193   6.554  -2.970
  109   HE21  GLN 122          HE21      GLN 122   2.093   9.162  -2.807
  110   HE22  GLN 122          HE22      GLN 122   1.445  10.089  -4.113
  111    H    GLN 123           HN       GLN 123  -2.674   6.315   1.252
  112    HA   GLN 123           HA       GLN 123  -1.300   7.624   3.454
  113    HB2  GLN 123           HB2      GLN 123  -4.127   6.673   3.060
  114    HB3  GLN 123           HB1      GLN 123  -3.529   7.262   4.592
  115    HG2  GLN 123           HG2      GLN 123  -3.064   9.429   3.606
  116    HG3  GLN 123           HG1      GLN 123  -3.607   8.839   2.035
  117   HE21  GLN 123          HE21      GLN 123  -5.773   7.268   3.235
  118   HE22  GLN 123          HE22      GLN 123  -6.997   8.410   3.669
  119    H    ASP 124           HN       ASP 124  -3.097   4.613   2.775
  120    HA   ASP 124           HA       ASP 124  -2.370   3.258   5.116
  121    HB2  ASP 124           HB2      ASP 124  -3.629   2.600   2.615
  122    HB3  ASP 124           HB1      ASP 124  -2.438   1.360   2.994
  123    H    LEU 125           HN       LEU 125  -0.906   3.194   1.894
  124    HA   LEU 125           HA       LEU 125   1.291   1.610   2.506
  125    HB2  LEU 125           HB2      LEU 125   0.944   3.758   0.417
  126    HB3  LEU 125           HB1      LEU 125   2.325   2.716   0.488
  127    HG   LEU 125           HG       LEU 125  -0.036   1.108   0.541
  128   HD11  LEU 125          HD11      LEU 125  -1.436   2.371  -0.668
  129   HD12  LEU 125          HD12      LEU 125  -0.394   1.941  -2.025
  130   HD13  LEU 125          HD13      LEU 125  -0.157   3.472  -1.181
  131   HD21  LEU 125          HD21      LEU 125   2.311   0.606  -0.248
  132   HD22  LEU 125          HD22      LEU 125   1.893   1.513  -1.709
  133   HD23  LEU 125          HD23      LEU 125   0.999   0.048  -1.288
  134    H    LEU 126           HN       LEU 126   0.748   5.069   2.989
  135    HA   LEU 126           HA       LEU 126   3.409   5.750   3.653
  136    HB2  LEU 126           HB2      LEU 126   0.752   6.968   3.865
  137    HB3  LEU 126           HB1      LEU 126   1.835   7.444   5.156
  138    HG   LEU 126           HG       LEU 126   2.288   7.794   2.202
  139   HD11  LEU 126          HD11      LEU 126   2.190  10.175   2.717
  140   HD12  LEU 126          HD12      LEU 126   1.864   9.800   4.409
  141   HD13  LEU 126          HD13      LEU 126   0.691   9.360   3.167
  142   HD21  LEU 126          HD21      LEU 126   4.081   8.466   4.533
  143   HD22  LEU 126          HD22      LEU 126   4.332   9.021   2.878
  144   HD23  LEU 126          HD23      LEU 126   4.405   7.299   3.252
  145    H    THR 127           HN       THR 127   0.718   4.439   5.468
  146    HA   THR 127           HA       THR 127   2.069   4.683   8.005
  147    HB   THR 127           HB       THR 127   0.144   3.826   9.019
  148    HG1  THR 127           HG1      THR 127  -1.427   2.622   7.827
  149   HG21  THR 127          HG21      THR 127  -0.131   5.961   7.481
  150   HG22  THR 127          HG22      THR 127  -1.491   5.274   8.365
  151   HG23  THR 127          HG23      THR 127  -1.279   4.912   6.653
  152    H    LEU 128           HN       LEU 128   2.385   2.546   5.417
  153    HA   LEU 128           HA       LEU 128   2.823   0.242   7.141
  154    HB2  LEU 128           HB2      LEU 128   2.931   0.515   4.151
  155    HB3  LEU 128           HB1      LEU 128   3.131  -0.975   5.035
  156    HG   LEU 128           HG       LEU 128   0.643   0.697   5.244
  157   HD11  LEU 128          HD11      LEU 128   0.999  -1.720   3.505
  158   HD12  LEU 128          HD12      LEU 128   1.101  -0.067   2.898
  159   HD13  LEU 128          HD13      LEU 128  -0.403  -0.654   3.611
  160   HD21  LEU 128          HD21      LEU 128   0.784  -0.764   7.056
  161   HD22  LEU 128          HD22      LEU 128   1.452  -2.049   6.056
  162   HD23  LEU 128          HD23      LEU 128  -0.245  -1.602   5.891
  163    H    CYS 129           HN       CYS 129   4.714   1.599   4.409
  164    HA   CYS 129           HA       CYS 129   6.992   1.630   4.087
  165    HB2  CYS 129           HB2      CYS 129   6.248   3.223   6.295
  166    HB3  CYS 129           HB1      CYS 129   7.739   2.425   6.765
  167    HA   PRO 130           HA       PRO 130   9.063  -1.901   5.874
  168    HB2  PRO 130           HB2      PRO 130  11.536  -0.827   6.790
  169    HB3  PRO 130           HB1      PRO 130  11.198  -1.585   5.236
  170    HG2  PRO 130           HG2      PRO 130  11.819   1.100   5.645
  171    HG3  PRO 130           HG1      PRO 130  11.103   0.410   4.182
  172    HD2  PRO 130           HD2      PRO 130   9.809   1.917   6.391
  173    HD3  PRO 130           HD1      PRO 130   9.383   1.834   4.672
  174    H    TYR 131           HN       TYR 131   9.140  -3.102   7.699
  175    HA   TYR 131           HA       TYR 131   8.821  -3.653   9.882
  176    HB2  TYR 131           HB2      TYR 131  10.642  -1.306  10.439
  177    HB3  TYR 131           HB1      TYR 131  10.397  -2.727  11.447
  178    HD1  TYR 131           HD1      TYR 131  11.328  -4.914  10.755
  179    HD2  TYR 131           HD2      TYR 131  12.130  -1.355   8.566
  180    HE1  TYR 131           HE1      TYR 131  13.203  -6.036   9.627
  181    HE2  TYR 131           HE2      TYR 131  14.006  -2.466   7.432
  182    HH   TYR 131           HH       TYR 131  15.517  -4.346   7.781
  183    H2   PRO  25           HT1      PRO  25  -2.347  15.374  -8.190
  184    H3   PRO  25           HT2      PRO  25  -2.965  16.878  -8.051
  185    HA   PRO  25           HA       PRO  25  -4.213  16.730  -9.771
  186    HB2  PRO  25           HB2      PRO  25  -2.967  14.975 -11.616
  187    HB3  PRO  25           HB1      PRO  25  -3.130  16.732 -11.739
  188    HG2  PRO  25           HG2      PRO  25  -0.860  15.110 -10.730
  189    HG3  PRO  25           HG1      PRO  25  -0.846  16.688 -11.536
  190    HD2  PRO  25           HD2      PRO  25  -0.376  16.503  -8.920
  191    HD3  PRO  25           HD1      PRO  25  -1.351  17.837  -9.566
  192    H    THR  26           HN       THR  26  -3.658  14.705  -7.574
  193    HA   THR  26           HA       THR  26  -5.720  12.871  -8.298
  194    HB   THR  26           HB       THR  26  -3.999  11.699  -9.486
  195    HG1  THR  26           HG1      THR  26  -5.198  10.195  -8.459
  196   HG21  THR  26          HG21      THR  26  -2.378  11.918  -6.946
  197   HG22  THR  26          HG22      THR  26  -2.025  12.678  -8.498
  198   HG23  THR  26          HG23      THR  26  -1.937  10.924  -8.334
  199    HA   PRO  27           HA       PRO  27  -5.686  12.765  -3.830
  200    HB2  PRO  27           HB2      PRO  27  -8.067  11.598  -3.504
  201    HB3  PRO  27           HB1      PRO  27  -7.934  13.211  -4.210
  202    HG2  PRO  27           HG2      PRO  27  -8.608  10.650  -5.505
  203    HG3  PRO  27           HG1      PRO  27  -8.982  12.304  -6.016
  204    HD2  PRO  27           HD2      PRO  27  -6.831  10.585  -6.904
  205    HD3  PRO  27           HD1      PRO  27  -7.266  12.207  -7.488
  206    H    GLU  28           HN       GLU  28  -6.958  10.770  -2.356
  207    HA   GLU  28           HA       GLU  28  -4.961   8.692  -2.459
  208    HB2  GLU  28           HB2      GLU  28  -6.363   7.777  -0.497
  209    HB3  GLU  28           HB1      GLU  28  -5.435   9.243  -0.284
  210    HG2  GLU  28           HG2      GLU  28  -7.385  10.597  -0.472
  211    HG3  GLU  28           HG1      GLU  28  -8.358   9.213  -0.967
  212    H    MET  29           HN       MET  29  -5.589   7.976  -4.539
  213    HA   MET  29           HA       MET  29  -8.109   6.602  -4.851
  214    HB2  MET  29           HB2      MET  29  -6.489   7.786  -6.651
  215    HB3  MET  29           HB1      MET  29  -5.927   6.121  -6.780
  216    HG2  MET  29           HG2      MET  29  -8.756   7.064  -7.157
  217    HG3  MET  29           HG1      MET  29  -7.635   6.591  -8.431
  218    HE1  MET  29           HE1      MET  29 -10.312   3.704  -8.377
  219    HE2  MET  29           HE2      MET  29  -9.426   4.814  -9.423
  220    HE3  MET  29           HE3      MET  29 -10.524   5.446  -8.196
  221    H    ARG  30           HN       ARG  30  -8.482   4.666  -4.191
  222    HA   ARG  30           HA       ARG  30  -6.417   2.984  -3.137
  223    HB2  ARG  30           HB2      ARG  30  -9.377   2.836  -3.340
  224    HB3  ARG  30           HB1      ARG  30  -8.472   1.391  -2.931
  225    HG2  ARG  30           HG2      ARG  30  -8.027   3.928  -1.455
  226    HG3  ARG  30           HG1      ARG  30  -9.422   2.937  -1.103
  227    HD2  ARG  30           HD2      ARG  30  -7.959   1.027  -0.657
  228    HD3  ARG  30           HD1      ARG  30  -6.559   2.061  -0.961
  229    HE   ARG  30           HE       ARG  30  -7.772   3.455   0.909
  230   HH11  ARG  30          HH11      ARG  30  -7.269   0.016   0.758
  231   HH12  ARG  30          HH12      ARG  30  -7.171  -0.178   2.474
  232   HH21  ARG  30          HH21      ARG  30  -7.649   3.213   3.176
  233   HH22  ARG  30          HH22      ARG  30  -7.387   1.638   3.849
  234    H    GLU  31           HN       GLU  31  -5.254   1.580  -4.324
  235    HA   GLU  31           HA       GLU  31  -6.573   0.232  -6.566
  236    HB2  GLU  31           HB2      GLU  31  -4.521   0.424  -7.922
  237    HB3  GLU  31           HB1      GLU  31  -5.234   1.992  -7.567
  238    HG2  GLU  31           HG2      GLU  31  -3.593   2.405  -5.865
  239    HG3  GLU  31           HG1      GLU  31  -2.946   0.786  -6.067
  240    H    LYS  32           HN       LYS  32  -5.974  -1.810  -6.978
  241    HA   LYS  32           HA       LYS  32  -5.260  -3.349  -4.763
  242    HB2  LYS  32           HB2      LYS  32  -5.288  -4.228  -7.640
  243    HB3  LYS  32           HB1      LYS  32  -5.540  -5.213  -6.210
  244    HG2  LYS  32           HG2      LYS  32  -7.557  -3.792  -5.723
  245    HG3  LYS  32           HG1      LYS  32  -7.355  -3.114  -7.332
  246    HD2  LYS  32           HD2      LYS  32  -7.591  -5.319  -8.325
  247    HD3  LYS  32           HD1      LYS  32  -7.712  -6.048  -6.727
  248    HE2  LYS  32           HE2      LYS  32  -9.740  -4.707  -6.328
  249    HE3  LYS  32           HE1      LYS  32  -9.638  -4.096  -7.974
  250    HZ1  LYS  32           HZ1      LYS  32  -9.962  -6.950  -7.215
  251    HZ2  LYS  32           HZ2      LYS  32  -9.888  -6.350  -8.793
  252    HZ3  LYS  32           HZ3      LYS  32 -11.192  -5.944  -7.795
  253    H    LEU  33           HN       LEU  33  -3.371  -3.520  -3.898
  254    HA   LEU  33           HA       LEU  33  -0.934  -3.592  -5.522
  255    HB2  LEU  33           HB2      LEU  33  -0.950  -3.204  -2.595
  256    HB3  LEU  33           HB1      LEU  33   0.167  -2.665  -3.818
  257    HG   LEU  33           HG       LEU  33  -2.585  -1.568  -3.506
  258   HD11  LEU  33          HD11      LEU  33  -1.856   0.021  -2.103
  259   HD12  LEU  33          HD12      LEU  33  -0.278   0.131  -2.878
  260   HD13  LEU  33          HD13      LEU  33  -0.604  -1.160  -1.720
  261   HD21  LEU  33          HD21      LEU  33  -2.154  -0.260  -5.291
  262   HD22  LEU  33          HD22      LEU  33  -1.041  -1.567  -5.707
  263   HD23  LEU  33          HD23      LEU  33  -0.442  -0.109  -4.907
  264    H    CYS  34           HN       CYS  34  -0.675  -5.722  -6.012
  265    HA   CYS  34           HA       CYS  34  -0.789  -7.654  -3.824
  266    HB2  CYS  34           HB2      CYS  34  -1.822  -7.884  -6.240
  267    HB3  CYS  34           HB1      CYS  34  -0.223  -8.511  -6.609
  268    H    GLY  35           HN       GLY  35   1.028  -7.371  -2.731
  269    HA2  GLY  35           HA2      GLY  35   3.233  -7.595  -2.156
  270    HA3  GLY  35           HA1      GLY  35   3.370  -8.665  -3.533
  271    H    HIS  36           HN       HIS  36   3.919  -7.702  -5.635
  272    HA   HIS  36           HA       HIS  36   5.914  -5.753  -5.387
  273    HB2  HIS  36           HB2      HIS  36   5.585  -7.596  -7.206
  274    HB3  HIS  36           HB1      HIS  36   4.682  -6.332  -8.044
  275    HD1  HIS  36           HD1      HIS  36   6.604  -6.256  -9.867
  276    HD2  HIS  36           HD2      HIS  36   7.731  -5.170  -6.008
  277    HE1  HIS  36           HE1      HIS  36   8.827  -5.086 -10.087
  278    H    HIS  37           HN       HIS  37   2.656  -5.490  -6.929
  279    HA   HIS  37           HA       HIS  37   2.808  -2.763  -7.525
  280    HB2  HIS  37           HB2      HIS  37   0.531  -4.541  -6.724
  281    HB3  HIS  37           HB1      HIS  37   0.272  -2.802  -6.816
  282    HD1  HIS  37           HD1      HIS  37  -1.032  -2.522  -8.931
  283    HD2  HIS  37           HD2      HIS  37   2.224  -5.048  -9.335
  284    HE1  HIS  37           HE1      HIS  37  -0.902  -3.088 -11.377
  285    H    PHE  38           HN       PHE  38   2.061  -4.534  -4.679
  286    HA   PHE  38           HA       PHE  38   1.459  -2.396  -2.977
  287    HB2  PHE  38           HB2      PHE  38   0.742  -4.586  -2.392
  288    HB3  PHE  38           HB1      PHE  38   2.374  -5.224  -2.507
  289    HD1  PHE  38           HD2      PHE  38   0.779  -2.341  -0.876
  290    HD2  PHE  38           HD1      PHE  38   3.215  -5.809  -0.443
  291    HE1  PHE  38           HE2      PHE  38   1.122  -1.802   1.508
  292    HE2  PHE  38           HE1      PHE  38   3.559  -5.285   1.946
  293    HZ   PHE  38           HZ       PHE  38   2.516  -3.267   2.927
  294    H    VAL  39           HN       VAL  39   4.397  -3.828  -4.073
  295    HA   VAL  39           HA       VAL  39   6.070  -2.557  -2.152
  296    HB   VAL  39           HB       VAL  39   6.516  -4.057  -4.697
  297   HG11  VAL  39          HG11      VAL  39   8.183  -2.720  -5.347
  298   HG12  VAL  39          HG12      VAL  39   9.068  -3.388  -3.977
  299   HG13  VAL  39          HG13      VAL  39   8.215  -1.860  -3.808
  300   HG21  VAL  39          HG21      VAL  39   6.428  -5.030  -2.343
  301   HG22  VAL  39          HG22      VAL  39   8.000  -4.269  -2.103
  302   HG23  VAL  39          HG23      VAL  39   7.795  -5.489  -3.358
  303    H    ARG  40           HN       ARG  40   5.901  -1.995  -5.684
  304    HA   ARG  40           HA       ARG  40   7.096   0.400  -5.867
  305    HB2  ARG  40           HB2      ARG  40   4.607  -0.506  -7.310
  306    HB3  ARG  40           HB1      ARG  40   5.550   0.904  -7.773
  307    HG2  ARG  40           HG2      ARG  40   6.792  -0.425  -9.019
  308    HG3  ARG  40           HG1      ARG  40   7.389  -1.181  -7.552
  309    HD2  ARG  40           HD2      ARG  40   5.858  -2.903  -7.685
  310    HD3  ARG  40           HD1      ARG  40   4.805  -2.030  -8.794
  311    HE   ARG  40           HE       ARG  40   7.466  -2.778  -9.735
  312   HH11  ARG  40          HH11      ARG  40   4.028  -3.342  -9.762
  313   HH12  ARG  40          HH12      ARG  40   4.065  -4.291 -11.209
  314   HH21  ARG  40          HH21      ARG  40   7.524  -4.027 -11.643
  315   HH22  ARG  40          HH22      ARG  40   6.052  -4.682 -12.279
  316    H    ALA  41           HN       ALA  41   3.518   0.106  -5.275
  317    HA   ALA  41           HA       ALA  41   3.169   2.857  -4.932
  318    HB1  ALA  41           HB1      ALA  41   1.076   2.338  -3.886
  319    HB2  ALA  41           HB2      ALA  41   1.596   0.704  -3.460
  320    HB3  ALA  41           HB3      ALA  41   1.335   1.140  -5.153
  321    H    LEU  42           HN       LEU  42   3.880   0.320  -2.468
  322    HA   LEU  42           HA       LEU  42   3.859   1.848  -0.187
  323    HB2  LEU  42           HB2      LEU  42   4.760  -0.671  -0.859
  324    HB3  LEU  42           HB1      LEU  42   6.225   0.124  -0.351
  325    HG   LEU  42           HG       LEU  42   3.721  -0.258   1.283
  326   HD11  LEU  42          HD11      LEU  42   4.796  -2.257   1.489
  327   HD12  LEU  42          HD12      LEU  42   5.644  -1.344   2.740
  328   HD13  LEU  42          HD13      LEU  42   6.382  -1.563   1.155
  329   HD21  LEU  42          HD21      LEU  42   4.355   1.669   2.242
  330   HD22  LEU  42          HD22      LEU  42   5.970   1.591   1.541
  331   HD23  LEU  42          HD23      LEU  42   5.599   0.668   2.996
  332    H    VAL  43           HN       VAL  43   6.316   1.709  -2.663
  333    HA   VAL  43           HA       VAL  43   8.190   3.403  -1.314
  334    HB   VAL  43           HB       VAL  43   8.311   3.140  -4.283
  335   HG11  VAL  43          HG11      VAL  43  10.637   2.941  -3.875
  336   HG12  VAL  43          HG12      VAL  43  10.356   2.519  -2.183
  337   HG13  VAL  43          HG13      VAL  43  10.061   4.171  -2.743
  338   HG21  VAL  43          HG21      VAL  43   7.543   0.964  -3.827
  339   HG22  VAL  43          HG22      VAL  43   8.538   0.858  -2.372
  340   HG23  VAL  43          HG23      VAL  43   9.299   0.843  -3.966
  341    H    ARG  44           HN       ARG  44   6.364   3.808  -4.301
  342    HA   ARG  44           HA       ARG  44   6.539   6.399  -4.936
  343    HB2  ARG  44           HB2      ARG  44   3.945   4.865  -4.658
  344    HB3  ARG  44           HB1      ARG  44   4.185   6.252  -5.687
  345    HG2  ARG  44           HG2      ARG  44   6.157   4.305  -6.287
  346    HG3  ARG  44           HG1      ARG  44   4.562   3.544  -6.274
  347    HD2  ARG  44           HD2      ARG  44   4.920   6.155  -7.649
  348    HD3  ARG  44           HD1      ARG  44   5.496   4.683  -8.408
  349    HE   ARG  44           HE       ARG  44   2.848   4.308  -7.543
  350   HH11  ARG  44          HH11      ARG  44   4.679   6.006  -9.974
  351   HH12  ARG  44          HH12      ARG  44   3.383   6.021 -11.122
  352   HH21  ARG  44          HH21      ARG  44   1.139   4.321  -9.050
  353   HH22  ARG  44          HH22      ARG  44   1.373   5.062 -10.599
  354    H    VAL  45           HN       VAL  45   4.714   5.000  -2.382
  355    HA   VAL  45           HA       VAL  45   3.454   7.352  -1.386
  356    HB   VAL  45           HB       VAL  45   3.716   4.603  -0.188
  357   HG11  VAL  45          HG11      VAL  45   1.976   6.952   0.435
  358   HG12  VAL  45          HG12      VAL  45   3.038   6.033   1.501
  359   HG13  VAL  45          HG13      VAL  45   1.547   5.309   0.909
  360   HG21  VAL  45          HG21      VAL  45   1.160   5.257  -1.374
  361   HG22  VAL  45          HG22      VAL  45   2.175   3.838  -1.585
  362   HG23  VAL  45          HG23      VAL  45   2.465   5.279  -2.554
  363    H    CYS  46           HN       CYS  46   5.492   4.989   0.308
  364    HA   CYS  46           HA       CYS  46   6.326   7.084   2.199
  365    HB2  CYS  46           HB2      CYS  46   5.159   4.863   2.856
  366    HB3  CYS  46           HB1      CYS  46   6.716   4.121   2.541
  367    H    GLY  47           HN       GLY  47   7.468   4.864  -0.167
  368    HA2  GLY  47           HA2      GLY  47   9.557   4.837  -1.213
  369    HA3  GLY  47           HA1      GLY  47  10.160   5.973  -0.019
  370    H    GLY  48           HN       GLY  48   8.474   3.375   1.317
  371    HA2  GLY  48           HA2      GLY  48   9.302   1.919   2.953
  372    HA3  GLY  48           HA1      GLY  48   9.841   1.153   1.472
  373    HA   PRO  49           HA       PRO  49  13.746   1.576   3.725
  374    HB2  PRO  49           HB2      PRO  49  15.080  -0.281   2.273
  375    HB3  PRO  49           HB1      PRO  49  13.943  -0.719   3.550
  376    HG2  PRO  49           HG2      PRO  49  13.497  -0.635   0.598
  377    HG3  PRO  49           HG1      PRO  49  13.042  -1.893   1.763
  378    HD2  PRO  49           HD2      PRO  49  11.300  -0.041   0.893
  379    HD3  PRO  49           HD1      PRO  49  11.205  -0.698   2.513
  380    H    ARG  50           HN       ARG  50  15.983   0.967   1.792
  381    HA   ARG  50           HA       ARG  50  16.008   3.594   0.590
  382    HB2  ARG  50           HB2      ARG  50  18.356   2.816  -0.088
  383    HB3  ARG  50           HB1      ARG  50  18.041   3.322   1.562
  384    HG2  ARG  50           HG2      ARG  50  17.713   0.905   2.113
  385    HG3  ARG  50           HG1      ARG  50  18.320   0.521   0.504
  386    HD2  ARG  50           HD2      ARG  50  19.764   1.881   2.767
  387    HD3  ARG  50           HD1      ARG  50  20.156   0.344   1.999
  388    HE   ARG  50           HE       ARG  50  20.441   1.974  -0.059
  389   HH11  ARG  50          HH11      ARG  50  21.470   2.387   3.243
  390   HH12  ARG  50          HH12      ARG  50  22.842   3.358   2.831
  391   HH21  ARG  50          HH21      ARG  50  22.249   3.255  -0.611
  392   HH22  ARG  50          HH22      ARG  50  23.285   3.852   0.642
  393    H    TRP  51           HN       TRP  51  15.757   0.278  -0.415
  394    HA   TRP  51           HA       TRP  51  15.416  -0.709  -2.395
  395    HB2  TRP  51           HB2      TRP  51  14.831   2.058  -3.395
  396    HB3  TRP  51           HB1      TRP  51  14.305   0.533  -4.072
  397    HD1  TRP  51           HD1      TRP  51  13.619   2.824  -1.070
  398    HE1  TRP  51           HE1      TRP  51  11.345   2.112  -0.071
  399    HE3  TRP  51           HE3      TRP  51  12.818  -1.301  -3.854
  400    HZ2  TRP  51           HZ2      TRP  51   9.454   0.030  -0.458
  401    HZ3  TRP  51           HZ3      TRP  51  10.764  -2.615  -3.493
  402    HH2  TRP  51           HH2      TRP  51   9.109  -1.910  -1.810
  403    H    SER  52           HN       SER  52  18.023   0.965  -1.739
  404    HA   SER  52           HA       SER  52  19.139   1.201  -4.416
  405    HB2  SER  52           HB2      SER  52  20.377   1.751  -1.708
  406    HB3  SER  52           HB1      SER  52  21.129   2.099  -3.264
  407    HG   SER  52           HG       SER  52  20.160   3.967  -2.611
  408    H    THR  53           HN       THR  53  18.814  -1.188  -2.091
  409    HA   THR  53           HA       THR  53  21.327  -2.516  -2.548
  410    HB   THR  53           HB       THR  53  20.344  -4.365  -1.225
  411    HG1  THR  53           HG1      THR  53  18.251  -3.327  -0.136
  412   HG21  THR  53          HG21      THR  53  20.103  -1.622   0.011
  413   HG22  THR  53          HG22      THR  53  21.571  -2.593  -0.095
  414   HG23  THR  53          HG23      THR  53  20.224  -3.136   0.906
  415    H    GLU  54           HN       GLU  54  21.402  -2.894  -4.714
  416    HA   GLU  54           HA       GLU  54  20.989  -3.840  -6.737
  417    HB2  GLU  54           HB2      GLU  54  19.953  -6.280  -5.403
  418    HB3  GLU  54           HB1      GLU  54  21.160  -6.104  -6.663
  419    HG2  GLU  54           HG2      GLU  54  22.783  -5.319  -5.028
  420    HG3  GLU  54           HG1      GLU  54  21.577  -5.487  -3.753
  421    H    ALA  55           HN       ALA  55  19.266  -2.521  -7.396
  422    HA   ALA  55           HA       ALA  55  16.546  -3.189  -6.781
  423    HB1  ALA  55           HB1      ALA  55  15.962  -1.407  -8.329
  424    HB2  ALA  55           HB2      ALA  55  17.632  -1.327  -8.891
  425    HB3  ALA  55           HB3      ALA  55  17.239  -0.880  -7.232
  Start of MODEL   19
    1    H1   ALA 106           HT1      ALA 106   1.798  -7.449  15.408
    2    H2   ALA 106           HT2      ALA 106   1.394  -6.081  14.499
    3    H3   ALA 106           HT3      ALA 106   2.974  -6.683  14.464
    4    HA   ALA 106           HA       ALA 106   1.774  -7.256  12.452
    5    HB1  ALA 106           HB1      ALA 106   2.302  -9.619  12.439
    6    HB2  ALA 106           HB2      ALA 106   2.332  -9.647  14.202
    7    HB3  ALA 106           HB3      ALA 106   3.547  -8.728  13.314
    8    H    ALA 107           HN       ALA 107  -0.393  -6.614  12.387
    9    HA   ALA 107           HA       ALA 107  -2.282  -8.752  12.566
   10    HB1  ALA 107           HB1      ALA 107  -2.677  -6.430  14.450
   11    HB2  ALA 107           HB2      ALA 107  -2.203  -8.059  14.927
   12    HB3  ALA 107           HB3      ALA 107  -3.785  -7.779  14.199
   13    H    ALA 108           HN       ALA 108  -1.303  -6.989  10.545
   14    HA   ALA 108           HA       ALA 108  -3.640  -5.297   9.969
   15    HB1  ALA 108           HB1      ALA 108  -2.304  -3.907   8.748
   16    HB2  ALA 108           HB2      ALA 108  -1.203  -5.204   8.291
   17    HB3  ALA 108           HB3      ALA 108  -1.120  -4.510   9.910
   18    H    THR 109           HN       THR 109  -3.525  -8.198   9.671
   19    HA   THR 109           HA       THR 109  -3.874  -9.899   8.181
   20    HB   THR 109           HB       THR 109  -6.065  -8.967   8.270
   21    HG1  THR 109           HG1      THR 109  -6.784  -9.579   6.130
   22   HG21  THR 109          HG21      THR 109  -5.006  -6.972   6.331
   23   HG22  THR 109          HG22      THR 109  -5.993  -6.719   7.768
   24   HG23  THR 109          HG23      THR 109  -6.718  -7.380   6.304
   25    H    ASN 110           HN       ASN 110  -1.561  -9.256   7.567
   26    HA   ASN 110           HA       ASN 110   0.079  -8.937   6.023
   27    HB2  ASN 110           HB2      ASN 110  -2.016 -10.361   4.379
   28    HB3  ASN 110           HB1      ASN 110  -0.350 -10.125   3.867
   29   HD21  ASN 110          HD21      ASN 110   0.228 -12.236   3.814
   30   HD22  ASN 110          HD22      ASN 110   0.328 -13.239   5.218
   31    HA   PRO 111           HA       PRO 111  -1.559  -4.989   4.406
   32    HB2  PRO 111           HB2      PRO 111   0.921  -3.845   4.192
   33    HB3  PRO 111           HB1      PRO 111  -0.066  -3.812   5.652
   34    HG2  PRO 111           HG2      PRO 111   2.190  -5.648   4.940
   35    HG3  PRO 111           HG1      PRO 111   1.849  -4.839   6.482
   36    HD2  PRO 111           HD2      PRO 111   1.236  -7.417   6.111
   37    HD3  PRO 111           HD1      PRO 111   0.167  -6.345   7.042
   38    H    ALA 112           HN       ALA 112   0.280  -7.457   3.097
   39    HA   ALA 112           HA       ALA 112   0.622  -6.134   0.507
   40    HB1  ALA 112           HB1      ALA 112   1.475  -8.942   0.976
   41    HB2  ALA 112           HB2      ALA 112   2.362  -7.651   1.783
   42    HB3  ALA 112           HB3      ALA 112   2.245  -7.670   0.024
   43    H    ARG 113           HN       ARG 113  -0.924  -8.898   2.031
   44    HA   ARG 113           HA       ARG 113  -2.222  -9.815  -0.345
   45    HB2  ARG 113           HB2      ARG 113  -2.528 -10.461   2.579
   46    HB3  ARG 113           HB1      ARG 113  -3.467 -11.247   1.325
   47    HG2  ARG 113           HG2      ARG 113  -0.465 -11.281   1.505
   48    HG3  ARG 113           HG1      ARG 113  -1.532 -12.577   2.048
   49    HD2  ARG 113           HD2      ARG 113  -2.370 -12.843  -0.233
   50    HD3  ARG 113           HD1      ARG 113  -1.313 -11.542  -0.778
   51    HE   ARG 113           HE       ARG 113   0.422 -13.273   0.334
   52   HH11  ARG 113          HH11      ARG 113  -2.149 -13.687  -1.983
   53   HH12  ARG 113          HH12      ARG 113  -1.377 -15.006  -2.797
   54   HH21  ARG 113          HH21      ARG 113   1.446 -15.009  -0.733
   55   HH22  ARG 113          HH22      ARG 113   0.667 -15.758  -2.086
   56    H    TYR 114           HN       TYR 114  -3.067  -7.839   2.407
   57    HA   TYR 114           HA       TYR 114  -5.842  -7.675   1.948
   58    HB2  TYR 114           HB2      TYR 114  -5.662  -6.915   4.018
   59    HB3  TYR 114           HB1      TYR 114  -3.931  -6.721   3.838
   60    HD1  TYR 114           HD1      TYR 114  -6.871  -4.861   2.451
   61    HD2  TYR 114           HD2      TYR 114  -3.277  -4.731   4.708
   62    HE1  TYR 114           HE1      TYR 114  -7.135  -2.451   2.714
   63    HE2  TYR 114           HE2      TYR 114  -3.518  -2.309   4.993
   64    HH   TYR 114           HH       TYR 114  -6.412  -0.665   4.257
   65    H    CYS 115           HN       CYS 115  -3.142  -5.709   0.757
   66    HA   CYS 115           HA       CYS 115  -4.982  -3.863  -0.511
   67    HB2  CYS 115           HB2      CYS 115  -2.019  -4.058  -1.073
   68    HB3  CYS 115           HB1      CYS 115  -3.089  -2.682  -1.316
   69    H    CYS 116           HN       CYS 116  -3.385  -6.805  -1.274
   70    HA   CYS 116           HA       CYS 116  -3.245  -6.643  -4.079
   71    HB2  CYS 116           HB2      CYS 116  -2.128  -8.409  -2.806
   72    HB3  CYS 116           HB1      CYS 116  -3.677  -9.038  -2.268
   73    H    LEU 117           HN       LEU 117  -5.781  -8.108  -2.018
   74    HA   LEU 117           HA       LEU 117  -7.512  -8.523  -4.256
   75    HB2  LEU 117           HB2      LEU 117  -7.758  -8.910  -1.309
   76    HB3  LEU 117           HB1      LEU 117  -9.123  -9.137  -2.368
   77    HG   LEU 117           HG       LEU 117  -6.526 -10.661  -2.552
   78   HD11  LEU 117          HD11      LEU 117  -7.797 -12.554  -1.689
   79   HD12  LEU 117          HD12      LEU 117  -9.215 -11.523  -1.494
   80   HD13  LEU 117          HD13      LEU 117  -7.766 -11.225  -0.530
   81   HD21  LEU 117          HD21      LEU 117  -9.148 -11.045  -3.993
   82   HD22  LEU 117          HD22      LEU 117  -7.735 -12.093  -4.118
   83   HD23  LEU 117          HD23      LEU 117  -7.655 -10.432  -4.706
   84    H    SER 118           HN       SER 118  -7.210  -6.106  -1.720
   85    HA   SER 118           HA       SER 118  -9.658  -4.810  -2.684
   86    HB2  SER 118           HB2      SER 118  -8.095  -4.448  -0.123
   87    HB3  SER 118           HB1      SER 118  -9.503  -3.494  -0.573
   88    HG   SER 118           HG       SER 118 -10.565  -5.046   0.366
   89    H    GLY 119           HN       GLY 119  -6.458  -3.782  -1.460
   90    HA2  GLY 119           HA2      GLY 119  -5.060  -2.454  -3.003
   91    HA3  GLY 119           HA1      GLY 119  -6.525  -1.583  -3.445
   92    H    CYS 120           HN       CYS 120  -4.077  -0.412  -2.367
   93    HA   CYS 120           HA       CYS 120  -5.232   0.672   0.084
   94    HB2  CYS 120           HB2      CYS 120  -2.418  -0.291  -0.228
   95    HB3  CYS 120           HB1      CYS 120  -2.929   0.760   1.075
   96    H    THR 121           HN       THR 121  -5.054   2.718   0.522
   97    HA   THR 121           HA       THR 121  -4.315   4.534  -1.554
   98    HB   THR 121           HB       THR 121  -4.939   6.288  -0.049
   99    HG1  THR 121           HG1      THR 121  -5.441   5.754   2.173
  100   HG21  THR 121          HG21      THR 121  -6.655   4.683  -0.995
  101   HG22  THR 121          HG22      THR 121  -7.178   5.790   0.265
  102   HG23  THR 121          HG23      THR 121  -6.844   4.097   0.648
  103    H    GLN 122           HN       GLN 122  -2.784   6.276  -1.248
  104    HA   GLN 122           HA       GLN 122  -0.234   5.389  -0.490
  105    HB2  GLN 122           HB2      GLN 122  -1.428   8.115  -0.995
  106    HB3  GLN 122           HB1      GLN 122   0.241   7.935  -0.486
  107    HG2  GLN 122           HG2      GLN 122   0.898   6.996  -2.458
  108    HG3  GLN 122           HG1      GLN 122  -0.692   6.326  -2.788
  109   HE21  GLN 122          HE21      GLN 122   1.337   9.136  -2.988
  110   HE22  GLN 122          HE22      GLN 122   0.334  10.040  -4.066
  111    H    GLN 123           HN       GLN 123  -2.916   6.463   1.334
  112    HA   GLN 123           HA       GLN 123  -1.474   7.420   3.600
  113    HB2  GLN 123           HB2      GLN 123  -4.276   6.785   2.968
  114    HB3  GLN 123           HB1      GLN 123  -3.823   6.509   4.643
  115    HG2  GLN 123           HG2      GLN 123  -2.886   8.867   4.619
  116    HG3  GLN 123           HG1      GLN 123  -3.739   9.073   3.091
  117   HE21  GLN 123          HE21      GLN 123  -5.063  10.672   3.971
  118   HE22  GLN 123          HE22      GLN 123  -6.347  10.298   5.065
  119    H    ASP 124           HN       ASP 124  -3.105   4.311   2.846
  120    HA   ASP 124           HA       ASP 124  -2.320   2.925   5.138
  121    HB2  ASP 124           HB2      ASP 124  -3.775   2.116   3.066
  122    HB3  ASP 124           HB1      ASP 124  -2.228   1.524   2.484
  123    H    LEU 125           HN       LEU 125  -0.732   3.088   1.992
  124    HA   LEU 125           HA       LEU 125   1.592   1.705   2.649
  125    HB2  LEU 125           HB2      LEU 125   1.154   3.858   0.573
  126    HB3  LEU 125           HB1      LEU 125   2.509   2.774   0.605
  127    HG   LEU 125           HG       LEU 125   0.098   1.235   0.707
  128   HD11  LEU 125          HD11      LEU 125  -1.306   2.440  -0.526
  129   HD12  LEU 125          HD12      LEU 125  -0.215   2.136  -1.877
  130   HD13  LEU 125          HD13      LEU 125  -0.057   3.619  -0.933
  131   HD21  LEU 125          HD21      LEU 125   2.471   0.759  -0.187
  132   HD22  LEU 125          HD22      LEU 125   1.861   1.500  -1.670
  133   HD23  LEU 125          HD23      LEU 125   1.077   0.061  -1.013
  134    H    LEU 126           HN       LEU 126   0.683   5.049   3.168
  135    HA   LEU 126           HA       LEU 126   3.246   6.074   3.768
  136    HB2  LEU 126           HB2      LEU 126   0.445   6.916   4.220
  137    HB3  LEU 126           HB1      LEU 126   1.622   7.586   5.326
  138    HG   LEU 126           HG       LEU 126   1.654   7.863   2.318
  139   HD11  LEU 126          HD11      LEU 126   1.204  10.220   2.776
  140   HD12  LEU 126          HD12      LEU 126   1.108   9.870   4.502
  141   HD13  LEU 126          HD13      LEU 126  -0.084   9.187   3.395
  142   HD21  LEU 126          HD21      LEU 126   3.523   9.418   2.700
  143   HD22  LEU 126          HD22      LEU 126   3.921   7.772   3.195
  144   HD23  LEU 126          HD23      LEU 126   3.521   8.986   4.410
  145    H    THR 127           HN       THR 127   0.957   4.164   5.538
  146    HA   THR 127           HA       THR 127   2.331   4.571   8.074
  147    HB   THR 127           HB       THR 127   0.530   3.660   9.136
  148    HG1  THR 127           HG1      THR 127  -0.758   1.977   8.161
  149   HG21  THR 127          HG21      THR 127  -0.248   5.444   7.428
  150   HG22  THR 127          HG22      THR 127  -1.460   4.453   8.236
  151   HG23  THR 127          HG23      THR 127  -0.978   4.077   6.583
  152    H    LEU 128           HN       LEU 128   2.467   2.420   5.398
  153    HA   LEU 128           HA       LEU 128   3.587   0.263   7.021
  154    HB2  LEU 128           HB2      LEU 128   3.084   0.297   4.055
  155    HB3  LEU 128           HB1      LEU 128   3.378  -1.089   5.069
  156    HG   LEU 128           HG       LEU 128   0.971   0.673   5.424
  157   HD11  LEU 128          HD11      LEU 128   1.187  -1.859   3.813
  158   HD12  LEU 128          HD12      LEU 128   0.928  -0.240   3.163
  159   HD13  LEU 128          HD13      LEU 128  -0.300  -0.988   4.182
  160   HD21  LEU 128          HD21      LEU 128   1.362  -0.604   7.346
  161   HD22  LEU 128          HD22      LEU 128   1.819  -2.011   6.395
  162   HD23  LEU 128          HD23      LEU 128   0.136  -1.497   6.443
  163    H    CYS 129           HN       CYS 129   4.541   3.026   5.524
  164    HA   CYS 129           HA       CYS 129   6.883   2.409   4.216
  165    HB2  CYS 129           HB2      CYS 129   5.994   4.585   3.969
  166    HB3  CYS 129           HB1      CYS 129   6.045   4.866   5.700
  167    HA   PRO 130           HA       PRO 130   9.257   2.752   8.320
  168    HB2  PRO 130           HB2      PRO 130   7.869   3.028  10.612
  169    HB3  PRO 130           HB1      PRO 130   8.237   4.399   9.561
  170    HG2  PRO 130           HG2      PRO 130   5.677   2.972   9.975
  171    HG3  PRO 130           HG1      PRO 130   5.965   4.651   9.499
  172    HD2  PRO 130           HD2      PRO 130   5.303   2.472   7.791
  173    HD3  PRO 130           HD1      PRO 130   5.756   4.103   7.298
  174    H    TYR 131           HN       TYR 131   7.135   0.511   7.436
  175    HA   TYR 131           HA       TYR 131   8.184  -1.449   9.341
  176    HB2  TYR 131           HB2      TYR 131   5.266  -1.133   8.618
  177    HB3  TYR 131           HB1      TYR 131   5.930  -2.550   9.425
  178    HD1  TYR 131           HD1      TYR 131   6.699  -2.415  11.741
  179    HD2  TYR 131           HD2      TYR 131   4.986   0.958   9.798
  180    HE1  TYR 131           HE1      TYR 131   6.406  -1.317  13.921
  181    HE2  TYR 131           HE2      TYR 131   4.688   2.067  11.973
  182    HH   TYR 131           HH       TYR 131   4.487   1.448  14.343
  183    H2   PRO  25           HT1      PRO  25  -1.866  15.630  -4.484
  184    H3   PRO  25           HT2      PRO  25  -2.616  16.939  -3.864
  185    HA   PRO  25           HA       PRO  25  -3.627  17.455  -5.667
  186    HB2  PRO  25           HB2      PRO  25  -2.026  16.580  -7.843
  187    HB3  PRO  25           HB1      PRO  25  -2.323  18.242  -7.314
  188    HG2  PRO  25           HG2      PRO  25  -0.057  16.433  -6.684
  189    HG3  PRO  25           HG1      PRO  25  -0.089  18.202  -6.808
  190    HD2  PRO  25           HD2      PRO  25   0.079  17.012  -4.427
  191    HD3  PRO  25           HD1      PRO  25  -0.916  18.462  -4.641
  192    H    THR  26           HN       THR  26  -3.984  15.108  -4.323
  193    HA   THR  26           HA       THR  26  -5.194  13.451  -6.335
  194    HB   THR  26           HB       THR  26  -4.030  11.358  -5.255
  195    HG1  THR  26           HG1      THR  26  -2.778  12.622  -3.771
  196   HG21  THR  26          HG21      THR  26  -2.510  13.038  -7.252
  197   HG22  THR  26          HG22      THR  26  -3.920  12.055  -7.645
  198   HG23  THR  26          HG23      THR  26  -2.443  11.285  -7.063
  199    HA   PRO  27           HA       PRO  27  -7.640  12.686  -2.672
  200    HB2  PRO  27           HB2      PRO  27  -9.720  11.540  -3.880
  201    HB3  PRO  27           HB1      PRO  27  -9.307  13.227  -4.206
  202    HG2  PRO  27           HG2      PRO  27  -8.956  10.841  -5.919
  203    HG3  PRO  27           HG1      PRO  27  -9.139  12.540  -6.381
  204    HD2  PRO  27           HD2      PRO  27  -6.708  11.007  -6.122
  205    HD3  PRO  27           HD1      PRO  27  -6.893  12.705  -6.622
  206    H    GLU  28           HN       GLU  28  -5.642  10.964  -2.437
  207    HA   GLU  28           HA       GLU  28  -4.884   8.838  -2.198
  208    HB2  GLU  28           HB2      GLU  28  -7.277   8.062  -0.744
  209    HB3  GLU  28           HB1      GLU  28  -5.612   8.182  -0.227
  210    HG2  GLU  28           HG2      GLU  28  -5.807  10.463   0.266
  211    HG3  GLU  28           HG1      GLU  28  -7.357  10.587  -0.564
  212    H    MET  29           HN       MET  29  -5.298   8.443  -4.518
  213    HA   MET  29           HA       MET  29  -7.601   6.889  -5.239
  214    HB2  MET  29           HB2      MET  29  -5.785   8.361  -6.663
  215    HB3  MET  29           HB1      MET  29  -5.240   6.714  -6.969
  216    HG2  MET  29           HG2      MET  29  -6.757   7.438  -8.701
  217    HG3  MET  29           HG1      MET  29  -7.467   6.121  -7.770
  218    HE1  MET  29           HE1      MET  29  -9.000   8.294  -9.759
  219    HE2  MET  29           HE2      MET  29 -10.499   8.444  -8.843
  220    HE3  MET  29           HE3      MET  29  -9.744   6.863  -9.045
  221    H    ARG  30           HN       ARG  30  -7.878   4.908  -4.713
  222    HA   ARG  30           HA       ARG  30  -5.794   3.306  -3.591
  223    HB2  ARG  30           HB2      ARG  30  -8.717   3.097  -3.935
  224    HB3  ARG  30           HB1      ARG  30  -7.835   1.583  -3.821
  225    HG2  ARG  30           HG2      ARG  30  -6.724   2.995  -1.804
  226    HG3  ARG  30           HG1      ARG  30  -8.377   3.613  -1.792
  227    HD2  ARG  30           HD2      ARG  30  -9.233   1.362  -1.621
  228    HD3  ARG  30           HD1      ARG  30  -7.596   0.713  -1.719
  229    HE   ARG  30           HE       ARG  30  -7.686   2.497   0.410
  230   HH11  ARG  30          HH11      ARG  30  -9.090  -0.566  -0.481
  231   HH12  ARG  30          HH12      ARG  30  -9.235  -1.120   1.153
  232   HH21  ARG  30          HH21      ARG  30  -7.871   1.770   2.567
  233   HH22  ARG  30          HH22      ARG  30  -8.544   0.206   2.885
  234    H    GLU  31           HN       GLU  31  -5.495   1.028  -4.269
  235    HA   GLU  31           HA       GLU  31  -5.983   0.187  -6.934
  236    HB2  GLU  31           HB2      GLU  31  -4.315   1.850  -7.519
  237    HB3  GLU  31           HB1      GLU  31  -3.220   1.235  -6.288
  238    HG2  GLU  31           HG2      GLU  31  -2.411   0.399  -8.305
  239    HG3  GLU  31           HG1      GLU  31  -3.248  -0.954  -7.557
  240    H    LYS  32           HN       LYS  32  -5.575  -1.897  -7.203
  241    HA   LYS  32           HA       LYS  32  -5.221  -3.468  -4.901
  242    HB2  LYS  32           HB2      LYS  32  -5.097  -4.340  -7.776
  243    HB3  LYS  32           HB1      LYS  32  -5.525  -5.314  -6.380
  244    HG2  LYS  32           HG2      LYS  32  -7.436  -3.747  -5.996
  245    HG3  LYS  32           HG1      LYS  32  -7.087  -3.061  -7.567
  246    HD2  LYS  32           HD2      LYS  32  -8.798  -4.654  -7.926
  247    HD3  LYS  32           HD1      LYS  32  -7.306  -5.398  -8.513
  248    HE2  LYS  32           HE2      LYS  32  -7.545  -5.988  -5.764
  249    HE3  LYS  32           HE1      LYS  32  -9.104  -6.329  -6.512
  250    HZ1  LYS  32           HZ1      LYS  32  -6.482  -7.394  -7.414
  251    HZ2  LYS  32           HZ2      LYS  32  -7.975  -7.717  -8.141
  252    HZ3  LYS  32           HZ3      LYS  32  -7.664  -8.264  -6.571
  253    H    LEU  33           HN       LEU  33  -3.376  -3.446  -3.916
  254    HA   LEU  33           HA       LEU  33  -0.866  -3.637  -5.375
  255    HB2  LEU  33           HB2      LEU  33  -1.239  -3.223  -2.453
  256    HB3  LEU  33           HB1      LEU  33   0.153  -2.924  -3.447
  257    HG   LEU  33           HG       LEU  33  -2.413  -1.409  -3.607
  258   HD11  LEU  33          HD11      LEU  33  -1.602  -0.333  -1.831
  259   HD12  LEU  33          HD12      LEU  33  -0.421   0.360  -2.946
  260   HD13  LEU  33          HD13      LEU  33  -0.011  -1.074  -2.004
  261   HD21  LEU  33          HD21      LEU  33  -1.497  -0.126  -5.313
  262   HD22  LEU  33          HD22      LEU  33  -0.947  -1.755  -5.726
  263   HD23  LEU  33          HD23      LEU  33   0.150  -0.621  -4.932
  264    H    CYS  34           HN       CYS  34  -0.653  -5.731  -5.937
  265    HA   CYS  34           HA       CYS  34  -0.958  -7.810  -3.919
  266    HB2  CYS  34           HB2      CYS  34  -0.607  -7.810  -6.885
  267    HB3  CYS  34           HB1      CYS  34  -0.505  -9.294  -5.955
  268    H    GLY  35           HN       GLY  35   0.903  -7.053  -2.730
  269    HA2  GLY  35           HA2      GLY  35   3.054  -7.397  -2.002
  270    HA3  GLY  35           HA1      GLY  35   3.230  -8.578  -3.282
  271    H    HIS  36           HN       HIS  36   3.830  -7.773  -5.445
  272    HA   HIS  36           HA       HIS  36   5.910  -5.943  -5.355
  273    HB2  HIS  36           HB2      HIS  36   5.424  -7.753  -7.115
  274    HB3  HIS  36           HB1      HIS  36   4.407  -6.534  -7.885
  275    HD1  HIS  36           HD1      HIS  36   6.125  -6.535  -9.914
  276    HD2  HIS  36           HD2      HIS  36   7.614  -5.227  -6.256
  277    HE1  HIS  36           HE1      HIS  36   8.283  -5.339 -10.427
  278    H    HIS  37           HN       HIS  37   2.657  -5.485  -6.841
  279    HA   HIS  37           HA       HIS  37   2.893  -2.780  -7.432
  280    HB2  HIS  37           HB2      HIS  37   0.519  -4.325  -6.378
  281    HB3  HIS  37           HB1      HIS  37   0.416  -2.636  -6.865
  282    HD1  HIS  37           HD1      HIS  37  -0.672  -2.533  -9.075
  283    HD2  HIS  37           HD2      HIS  37   1.876  -5.787  -8.719
  284    HE1  HIS  37           HE1      HIS  37  -0.757  -3.722 -11.285
  285    H    PHE  38           HN       PHE  38   2.000  -4.455  -4.540
  286    HA   PHE  38           HA       PHE  38   1.500  -2.287  -2.874
  287    HB2  PHE  38           HB2      PHE  38   0.752  -4.466  -2.263
  288    HB3  PHE  38           HB1      PHE  38   2.376  -5.119  -2.345
  289    HD1  PHE  38           HD2      PHE  38   0.712  -2.254  -0.722
  290    HD2  PHE  38           HD1      PHE  38   3.256  -5.641  -0.308
  291    HE1  PHE  38           HE2      PHE  38   1.020  -1.730   1.669
  292    HE2  PHE  38           HE1      PHE  38   3.565  -5.138   2.085
  293    HZ   PHE  38           HZ       PHE  38   2.455  -3.167   3.077
  294    H    VAL  39           HN       VAL  39   4.411  -3.774  -3.943
  295    HA   VAL  39           HA       VAL  39   6.097  -2.521  -2.024
  296    HB   VAL  39           HB       VAL  39   6.449  -4.246  -4.379
  297   HG11  VAL  39          HG11      VAL  39   7.866  -2.883  -5.476
  298   HG12  VAL  39          HG12      VAL  39   9.008  -3.430  -4.251
  299   HG13  VAL  39          HG13      VAL  39   8.187  -1.891  -4.055
  300   HG21  VAL  39          HG21      VAL  39   7.105  -4.191  -1.622
  301   HG22  VAL  39          HG22      VAL  39   8.599  -4.384  -2.536
  302   HG23  VAL  39          HG23      VAL  39   7.270  -5.520  -2.768
  303    H    ARG  40           HN       ARG  40   5.711  -1.953  -5.550
  304    HA   ARG  40           HA       ARG  40   7.025   0.442  -5.725
  305    HB2  ARG  40           HB2      ARG  40   4.504  -0.411  -7.167
  306    HB3  ARG  40           HB1      ARG  40   5.507   0.955  -7.638
  307    HG2  ARG  40           HG2      ARG  40   6.544  -0.494  -8.957
  308    HG3  ARG  40           HG1      ARG  40   7.320  -1.087  -7.497
  309    HD2  ARG  40           HD2      ARG  40   6.020  -2.938  -7.405
  310    HD3  ARG  40           HD1      ARG  40   4.643  -2.161  -8.177
  311    HE   ARG  40           HE       ARG  40   7.000  -2.737  -9.806
  312   HH11  ARG  40          HH11      ARG  40   3.718  -3.505  -8.922
  313   HH12  ARG  40          HH12      ARG  40   3.421  -4.447 -10.344
  314   HH21  ARG  40          HH21      ARG  40   6.616  -3.974 -11.682
  315   HH22  ARG  40          HH22      ARG  40   5.067  -4.713 -11.913
  316    H    ALA  41           HN       ALA  41   3.415   0.229  -5.321
  317    HA   ALA  41           HA       ALA  41   3.021   2.915  -4.900
  318    HB1  ALA  41           HB1      ALA  41   0.956   2.363  -3.849
  319    HB2  ALA  41           HB2      ALA  41   1.534   0.770  -3.346
  320    HB3  ALA  41           HB3      ALA  41   1.249   1.113  -5.056
  321    H    LEU  42           HN       LEU  42   4.015   0.445  -2.503
  322    HA   LEU  42           HA       LEU  42   3.941   1.965  -0.203
  323    HB2  LEU  42           HB2      LEU  42   5.034  -0.487  -0.997
  324    HB3  LEU  42           HB1      LEU  42   6.378   0.410  -0.346
  325    HG   LEU  42           HG       LEU  42   3.798  -0.121   1.123
  326   HD11  LEU  42          HD11      LEU  42   4.891  -2.199   0.954
  327   HD12  LEU  42          HD12      LEU  42   5.355  -1.560   2.531
  328   HD13  LEU  42          HD13      LEU  42   6.481  -1.473   1.179
  329   HD21  LEU  42          HD21      LEU  42   4.485   1.594   2.368
  330   HD22  LEU  42          HD22      LEU  42   6.055   1.630   1.570
  331   HD23  LEU  42          HD23      LEU  42   5.782   0.531   2.921
  332    H    VAL  43           HN       VAL  43   6.479   1.744  -2.609
  333    HA   VAL  43           HA       VAL  43   8.209   3.656  -1.397
  334    HB   VAL  43           HB       VAL  43   8.500   3.255  -4.324
  335   HG11  VAL  43          HG11      VAL  43  10.724   3.316  -3.841
  336   HG12  VAL  43          HG12      VAL  43  10.523   2.336  -2.380
  337   HG13  VAL  43          HG13      VAL  43  10.146   4.067  -2.348
  338   HG21  VAL  43          HG21      VAL  43   7.599   1.100  -3.845
  339   HG22  VAL  43          HG22      VAL  43   8.651   0.937  -2.434
  340   HG23  VAL  43          HG23      VAL  43   9.342   0.949  -4.057
  341    H    ARG  44           HN       ARG  44   6.387   3.787  -4.438
  342    HA   ARG  44           HA       ARG  44   6.492   6.319  -5.255
  343    HB2  ARG  44           HB2      ARG  44   3.838   4.944  -4.772
  344    HB3  ARG  44           HB1      ARG  44   4.188   6.122  -6.013
  345    HG2  ARG  44           HG2      ARG  44   6.011   4.094  -6.479
  346    HG3  ARG  44           HG1      ARG  44   4.518   3.267  -6.036
  347    HD2  ARG  44           HD2      ARG  44   3.398   4.901  -7.688
  348    HD3  ARG  44           HD1      ARG  44   5.031   5.144  -8.297
  349    HE   ARG  44           HE       ARG  44   4.076   2.400  -8.108
  350   HH11  ARG  44          HH11      ARG  44   4.749   5.182 -10.098
  351   HH12  ARG  44          HH12      ARG  44   4.744   4.284 -11.579
  352   HH21  ARG  44          HH21      ARG  44   4.069   1.212 -10.057
  353   HH22  ARG  44          HH22      ARG  44   4.357   2.030 -11.555
  354    H    VAL  45           HN       VAL  45   4.698   5.126  -2.545
  355    HA   VAL  45           HA       VAL  45   3.509   7.550  -1.677
  356    HB   VAL  45           HB       VAL  45   4.029   4.917  -0.281
  357   HG11  VAL  45          HG11      VAL  45   3.657   7.042   1.161
  358   HG12  VAL  45          HG12      VAL  45   2.779   5.558   1.511
  359   HG13  VAL  45          HG13      VAL  45   1.980   6.868   0.643
  360   HG21  VAL  45          HG21      VAL  45   1.298   5.606  -0.897
  361   HG22  VAL  45          HG22      VAL  45   2.207   4.134  -1.222
  362   HG23  VAL  45          HG23      VAL  45   2.309   5.496  -2.336
  363    H    CYS  46           HN       CYS  46   6.005   5.501  -0.255
  364    HA   CYS  46           HA       CYS  46   7.302   7.849   0.937
  365    HB2  CYS  46           HB2      CYS  46   5.691   6.730   2.500
  366    HB3  CYS  46           HB1      CYS  46   6.662   5.284   2.382
  367    H    GLY  47           HN       GLY  47   7.474   4.318   0.891
  368    HA2  GLY  47           HA2      GLY  47   9.763   3.956  -0.581
  369    HA3  GLY  47           HA1      GLY  47  10.349   4.323   1.032
  370    H    GLY  48           HN       GLY  48  10.748   2.631   2.252
  371    HA2  GLY  48           HA2      GLY  48   9.117   0.562   2.934
  372    HA3  GLY  48           HA1      GLY  48   9.866   0.018   1.449
  373    HA   PRO  49           HA       PRO  49  12.870  -1.370   4.538
  374    HB2  PRO  49           HB2      PRO  49  13.840  -3.422   3.126
  375    HB3  PRO  49           HB1      PRO  49  12.233  -3.491   3.860
  376    HG2  PRO  49           HG2      PRO  49  12.967  -2.878   1.027
  377    HG3  PRO  49           HG1      PRO  49  11.722  -3.983   1.643
  378    HD2  PRO  49           HD2      PRO  49  11.189  -1.447   0.826
  379    HD3  PRO  49           HD1      PRO  49  10.236  -2.269   2.054
  380    H    ARG  50           HN       ARG  50  13.385   0.917   2.900
  381    HA   ARG  50           HA       ARG  50  15.083   2.219   2.242
  382    HB2  ARG  50           HB2      ARG  50  16.813  -0.109   2.908
  383    HB3  ARG  50           HB1      ARG  50  17.326   1.549   2.717
  384    HG2  ARG  50           HG2      ARG  50  15.350   0.745   4.815
  385    HG3  ARG  50           HG1      ARG  50  17.091   0.668   5.093
  386    HD2  ARG  50           HD2      ARG  50  16.305   2.756   5.942
  387    HD3  ARG  50           HD1      ARG  50  17.223   3.080   4.472
  388    HE   ARG  50           HE       ARG  50  14.427   2.801   3.963
  389   HH11  ARG  50          HH11      ARG  50  16.874   5.011   5.089
  390   HH12  ARG  50          HH12      ARG  50  15.984   6.428   4.642
  391   HH21  ARG  50          HH21      ARG  50  13.247   4.663   3.375
  392   HH22  ARG  50          HH22      ARG  50  13.923   6.229   3.670
  393    H    TRP  51           HN       TRP  51  14.954  -1.033   0.966
  394    HA   TRP  51           HA       TRP  51  15.198  -1.898  -1.078
  395    HB2  TRP  51           HB2      TRP  51  15.305   0.905  -2.124
  396    HB3  TRP  51           HB1      TRP  51  14.709  -0.548  -2.902
  397    HD1  TRP  51           HD1      TRP  51  13.714   1.909  -0.127
  398    HE1  TRP  51           HE1      TRP  51  11.184   1.683   0.252
  399    HE3  TRP  51           HE3      TRP  51  12.882  -2.024  -3.150
  400    HZ2  TRP  51           HZ2      TRP  51   9.098  -0.023  -0.645
  401    HZ3  TRP  51           HZ3      TRP  51  10.604  -2.925  -3.330
  402    HH2  TRP  51           HH2      TRP  51   8.743  -1.896  -2.086
  403    H    SER  52           HN       SER  52  17.067   1.079  -1.420
  404    HA   SER  52           HA       SER  52  19.564  -0.412  -1.484
  405    HB2  SER  52           HB2      SER  52  18.578   1.267  -3.798
  406    HB3  SER  52           HB1      SER  52  20.246   0.721  -3.618
  407    HG   SER  52           HG       SER  52  19.241  -1.462  -3.468
  408    H    THR  53           HN       THR  53  19.586   2.664  -2.954
  409    HA   THR  53           HA       THR  53  20.754   4.538  -2.350
  410    HB   THR  53           HB       THR  53  19.788   5.729  -0.434
  411    HG1  THR  53           HG1      THR  53  17.700   4.338   0.198
  412   HG21  THR  53          HG21      THR  53  17.790   4.483  -2.323
  413   HG22  THR  53          HG22      THR  53  18.743   5.938  -2.618
  414   HG23  THR  53          HG23      THR  53  17.505   5.934  -1.362
  415    H    GLU  54           HN       GLU  54  22.660   3.237  -1.988
  416    HA   GLU  54           HA       GLU  54  23.447   2.673   0.733
  417    HB2  GLU  54           HB2      GLU  54  25.003   2.466  -1.851
  418    HB3  GLU  54           HB1      GLU  54  25.553   1.886  -0.285
  419    HG2  GLU  54           HG2      GLU  54  23.749   0.282  -0.204
  420    HG3  GLU  54           HG1      GLU  54  23.098   0.903  -1.720
  421    H    ALA  55           HN       ALA  55  22.925   5.475  -0.190
  422    HA   ALA  55           HA       ALA  55  25.466   6.802  -0.245
  423    HB1  ALA  55           HB1      ALA  55  24.179   8.860  -0.171
  424    HB2  ALA  55           HB2      ALA  55  22.722   7.957   0.239
  425    HB3  ALA  55           HB3      ALA  55  23.475   7.742  -1.341
  Start of MODEL   20
    1    H1   ALA 106           HT1      ALA 106   5.640  -3.268   9.638
    2    H2   ALA 106           HT2      ALA 106   4.135  -2.933   8.942
    3    H3   ALA 106           HT3      ALA 106   5.345  -3.676   8.023
    4    HA   ALA 106           HA       ALA 106   3.683  -5.278   8.687
    5    HB1  ALA 106           HB1      ALA 106   5.183  -6.933   9.655
    6    HB2  ALA 106           HB2      ALA 106   6.314  -5.658  10.113
    7    HB3  ALA 106           HB3      ALA 106   6.008  -5.995   8.410
    8    H    ALA 107           HN       ALA 107   2.069  -4.231   9.987
    9    HA   ALA 107           HA       ALA 107   2.170  -5.116  12.748
   10    HB1  ALA 107           HB1      ALA 107   3.123  -2.852  12.839
   11    HB2  ALA 107           HB2      ALA 107   1.583  -2.960  13.692
   12    HB3  ALA 107           HB3      ALA 107   1.656  -2.218  12.094
   13    H    ALA 108           HN       ALA 108   0.479  -4.143   9.933
   14    HA   ALA 108           HA       ALA 108  -2.106  -4.679  11.238
   15    HB1  ALA 108           HB1      ALA 108  -2.938  -2.943  10.140
   16    HB2  ALA 108           HB2      ALA 108  -2.401  -3.616   8.602
   17    HB3  ALA 108           HB3      ALA 108  -1.316  -2.588   9.539
   18    H    THR 109           HN       THR 109  -2.564  -6.760  11.017
   19    HA   THR 109           HA       THR 109  -2.570  -8.892  10.133
   20    HB   THR 109           HB       THR 109  -4.729  -8.446   9.566
   21    HG1  THR 109           HG1      THR 109  -4.486  -8.639   6.935
   22   HG21  THR 109          HG21      THR 109  -3.646  -6.242   7.866
   23   HG22  THR 109          HG22      THR 109  -4.849  -6.182   9.150
   24   HG23  THR 109          HG23      THR 109  -5.270  -6.861   7.577
   25    H    ASN 110           HN       ASN 110  -2.752  -7.617   6.925
   26    HA   ASN 110           HA       ASN 110   0.010  -8.200   6.287
   27    HB2  ASN 110           HB2      ASN 110  -2.298  -9.792   5.150
   28    HB3  ASN 110           HB1      ASN 110  -0.707  -9.734   4.404
   29   HD21  ASN 110          HD21      ASN 110   0.987 -10.801   5.350
   30   HD22  ASN 110          HD22      ASN 110   0.770 -11.941   6.628
   31    HA   PRO 111           HA       PRO 111  -1.661  -4.586   4.050
   32    HB2  PRO 111           HB2      PRO 111   0.716  -3.368   3.722
   33    HB3  PRO 111           HB1      PRO 111  -0.221  -3.254   5.210
   34    HG2  PRO 111           HG2      PRO 111   2.088  -5.061   4.574
   35    HG3  PRO 111           HG1      PRO 111   1.800  -4.093   6.032
   36    HD2  PRO 111           HD2      PRO 111   1.255  -6.720   5.959
   37    HD3  PRO 111           HD1      PRO 111   0.234  -5.584   6.864
   38    H    ALA 112           HN       ALA 112   0.382  -7.115   3.146
   39    HA   ALA 112           HA       ALA 112   0.775  -6.139   0.429
   40    HB1  ALA 112           HB1      ALA 112   1.513  -8.896   1.286
   41    HB2  ALA 112           HB2      ALA 112   2.430  -7.525   1.904
   42    HB3  ALA 112           HB3      ALA 112   2.332  -7.806   0.166
   43    H    ARG 113           HN       ARG 113  -0.930  -8.662   2.172
   44    HA   ARG 113           HA       ARG 113  -2.154  -9.749  -0.190
   45    HB2  ARG 113           HB2      ARG 113  -2.074 -10.385   2.675
   46    HB3  ARG 113           HB1      ARG 113  -3.609 -10.751   1.899
   47    HG2  ARG 113           HG2      ARG 113  -2.141 -12.684   1.885
   48    HG3  ARG 113           HG1      ARG 113  -2.458 -12.121   0.243
   49    HD2  ARG 113           HD2      ARG 113  -0.291 -10.912   0.293
   50    HD3  ARG 113           HD1      ARG 113   0.025 -11.619   1.877
   51    HE   ARG 113           HE       ARG 113  -0.309 -13.824   0.537
   52   HH11  ARG 113          HH11      ARG 113   1.269 -10.919  -0.562
   53   HH12  ARG 113          HH12      ARG 113   2.337 -11.752  -1.642
   54   HH21  ARG 113          HH21      ARG 113   1.094 -14.931  -0.883
   55   HH22  ARG 113          HH22      ARG 113   2.238 -14.031  -1.824
   56    H    TYR 114           HN       TYR 114  -3.363  -7.875   2.607
   57    HA   TYR 114           HA       TYR 114  -6.017  -7.750   1.834
   58    HB2  TYR 114           HB2      TYR 114  -6.292  -6.439   3.636
   59    HB3  TYR 114           HB1      TYR 114  -4.594  -6.748   3.943
   60    HD1  TYR 114           HD1      TYR 114  -6.655  -4.326   1.922
   61    HD2  TYR 114           HD2      TYR 114  -3.328  -4.913   4.514
   62    HE1  TYR 114           HE1      TYR 114  -6.224  -1.906   1.910
   63    HE2  TYR 114           HE2      TYR 114  -2.887  -2.497   4.507
   64    HH   TYR 114           HH       TYR 114  -5.118  -0.227   3.287
   65    H    CYS 115           HN       CYS 115  -3.285  -5.930   0.613
   66    HA   CYS 115           HA       CYS 115  -4.997  -4.090  -0.786
   67    HB2  CYS 115           HB2      CYS 115  -1.997  -4.459  -1.077
   68    HB3  CYS 115           HB1      CYS 115  -2.972  -3.158  -1.751
   69    H    CYS 116           HN       CYS 116  -3.232  -7.028  -1.578
   70    HA   CYS 116           HA       CYS 116  -3.366  -6.854  -4.354
   71    HB2  CYS 116           HB2      CYS 116  -2.119  -8.639  -3.211
   72    HB3  CYS 116           HB1      CYS 116  -3.617  -9.328  -2.617
   73    H    LEU 117           HN       LEU 117  -5.763  -7.743  -1.967
   74    HA   LEU 117           HA       LEU 117  -7.735  -8.533  -3.888
   75    HB2  LEU 117           HB2      LEU 117  -7.819  -8.031  -0.937
   76    HB3  LEU 117           HB1      LEU 117  -9.198  -8.565  -1.858
   77    HG   LEU 117           HG       LEU 117  -6.616 -10.100  -1.612
   78   HD11  LEU 117          HD11      LEU 117  -9.258 -10.550  -0.232
   79   HD12  LEU 117          HD12      LEU 117  -7.784  -9.952   0.530
   80   HD13  LEU 117          HD13      LEU 117  -7.837 -11.589  -0.125
   81   HD21  LEU 117          HD21      LEU 117  -7.903 -11.944  -2.576
   82   HD22  LEU 117          HD22      LEU 117  -7.824 -10.567  -3.675
   83   HD23  LEU 117          HD23      LEU 117  -9.297 -10.879  -2.756
   84    H    SER 118           HN       SER 118  -7.472  -5.844  -1.552
   85    HA   SER 118           HA       SER 118  -9.450  -4.360  -3.137
   86    HB2  SER 118           HB2      SER 118  -9.569  -2.890  -1.062
   87    HB3  SER 118           HB1      SER 118 -10.169  -4.538  -0.878
   88    HG   SER 118           HG       SER 118  -7.489  -3.928  -0.281
   89    H    GLY 119           HN       GLY 119  -6.404  -3.782  -1.361
   90    HA2  GLY 119           HA2      GLY 119  -4.608  -2.666  -2.628
   91    HA3  GLY 119           HA1      GLY 119  -5.848  -1.601  -3.283
   92    H    CYS 120           HN       CYS 120  -3.560  -0.582  -2.008
   93    HA   CYS 120           HA       CYS 120  -4.705   0.414   0.520
   94    HB2  CYS 120           HB2      CYS 120  -1.929   0.989   0.455
   95    HB3  CYS 120           HB1      CYS 120  -2.798  -0.041   1.582
   96    H    THR 121           HN       THR 121  -4.233   2.542   1.139
   97    HA   THR 121           HA       THR 121  -4.180   4.378  -1.127
   98    HB   THR 121           HB       THR 121  -4.906   6.080   0.436
   99    HG1  THR 121           HG1      THR 121  -3.688   5.303   2.264
  100   HG21  THR 121          HG21      THR 121  -6.485   4.315  -0.462
  101   HG22  THR 121          HG22      THR 121  -7.055   5.293   0.885
  102   HG23  THR 121          HG23      THR 121  -6.488   3.642   1.161
  103    H    GLN 122           HN       GLN 122  -2.856   6.313  -0.980
  104    HA   GLN 122           HA       GLN 122  -0.164   5.697  -0.299
  105    HB2  GLN 122           HB2      GLN 122  -1.627   8.111  -1.296
  106    HB3  GLN 122           HB1      GLN 122  -0.023   8.333  -0.616
  107    HG2  GLN 122           HG2      GLN 122   0.979   6.962  -2.242
  108    HG3  GLN 122           HG1      GLN 122  -0.568   6.303  -2.751
  109   HE21  GLN 122          HE21      GLN 122   1.592   9.014  -2.920
  110   HE22  GLN 122          HE22      GLN 122   0.817   9.816  -4.238
  111    H    GLN 123           HN       GLN 123  -2.647   6.126   1.687
  112    HA   GLN 123           HA       GLN 123  -1.147   7.587   3.713
  113    HB2  GLN 123           HB2      GLN 123  -3.988   6.665   3.454
  114    HB3  GLN 123           HB1      GLN 123  -3.326   7.065   5.025
  115    HG2  GLN 123           HG2      GLN 123  -2.778   9.318   4.185
  116    HG3  GLN 123           HG1      GLN 123  -3.536   8.897   2.650
  117   HE21  GLN 123          HE21      GLN 123  -5.073  10.514   2.835
  118   HE22  GLN 123          HE22      GLN 123  -6.386  10.422   3.953
  119    H    ASP 124           HN       ASP 124  -2.900   4.513   3.253
  120    HA   ASP 124           HA       ASP 124  -1.936   3.204   5.531
  121    HB2  ASP 124           HB2      ASP 124  -2.837   2.183   2.830
  122    HB3  ASP 124           HB1      ASP 124  -2.285   1.083   4.082
  123    H    LEU 125           HN       LEU 125  -0.749   3.122   2.194
  124    HA   LEU 125           HA       LEU 125   1.548   1.639   2.641
  125    HB2  LEU 125           HB2      LEU 125   0.948   3.737   0.557
  126    HB3  LEU 125           HB1      LEU 125   2.375   2.763   0.526
  127    HG   LEU 125           HG       LEU 125   0.028   1.104   0.766
  128   HD11  LEU 125          HD11      LEU 125  -1.231   1.717  -1.045
  129   HD12  LEU 125          HD12      LEU 125   0.122   2.524  -1.833
  130   HD13  LEU 125          HD13      LEU 125  -0.713   3.314  -0.500
  131   HD21  LEU 125          HD21      LEU 125   2.428   0.681  -0.088
  132   HD22  LEU 125          HD22      LEU 125   1.815   1.365  -1.603
  133   HD23  LEU 125          HD23      LEU 125   1.075  -0.090  -0.915
  134    H    LEU 126           HN       LEU 126   0.903   5.070   3.149
  135    HA   LEU 126           HA       LEU 126   3.580   5.868   3.598
  136    HB2  LEU 126           HB2      LEU 126   0.896   6.985   4.039
  137    HB3  LEU 126           HB1      LEU 126   2.091   7.528   5.197
  138    HG   LEU 126           HG       LEU 126   2.203   7.842   2.205
  139   HD11  LEU 126          HD11      LEU 126   1.923   9.850   4.435
  140   HD12  LEU 126          HD12      LEU 126   0.666   9.369   3.296
  141   HD13  LEU 126          HD13      LEU 126   2.091  10.236   2.722
  142   HD21  LEU 126          HD21      LEU 126   4.443   7.429   3.076
  143   HD22  LEU 126          HD22      LEU 126   4.213   8.684   4.295
  144   HD23  LEU 126          HD23      LEU 126   4.268   9.114   2.586
  145    H    THR 127           HN       THR 127   1.052   4.532   5.635
  146    HA   THR 127           HA       THR 127   2.559   4.819   8.064
  147    HB   THR 127           HB       THR 127   0.762   3.819   9.193
  148    HG1  THR 127           HG1      THR 127  -0.900   2.834   7.465
  149   HG21  THR 127          HG21      THR 127   0.262   5.966   7.759
  150   HG22  THR 127          HG22      THR 127  -1.015   5.157   8.661
  151   HG23  THR 127          HG23      THR 127  -0.846   4.879   6.929
  152    H    LEU 128           HN       LEU 128   2.831   2.720   5.452
  153    HA   LEU 128           HA       LEU 128   3.531   0.424   7.094
  154    HB2  LEU 128           HB2      LEU 128   3.445   0.786   4.114
  155    HB3  LEU 128           HB1      LEU 128   3.850  -0.705   4.926
  156    HG   LEU 128           HG       LEU 128   1.228   0.712   5.331
  157   HD11  LEU 128          HD11      LEU 128   1.695  -1.663   3.565
  158   HD12  LEU 128          HD12      LEU 128   1.634  -0.013   2.951
  159   HD13  LEU 128          HD13      LEU 128   0.222  -0.711   3.745
  160   HD21  LEU 128          HD21      LEU 128   1.683  -0.745   7.118
  161   HD22  LEU 128          HD22      LEU 128   2.327  -1.970   6.030
  162   HD23  LEU 128          HD23      LEU 128   0.598  -1.632   6.044
  163    H    CYS 129           HN       CYS 129   5.198   1.858   4.272
  164    HA   CYS 129           HA       CYS 129   7.455   2.024   3.841
  165    HB2  CYS 129           HB2      CYS 129   6.674   3.705   5.952
  166    HB3  CYS 129           HB1      CYS 129   8.214   3.027   6.456
  167    HA   PRO 130           HA       PRO 130   9.970  -1.216   5.609
  168    HB2  PRO 130           HB2      PRO 130  12.179   0.425   6.616
  169    HB3  PRO 130           HB1      PRO 130  12.164  -0.729   5.280
  170    HG2  PRO 130           HG2      PRO 130  12.366   1.924   4.871
  171    HG3  PRO 130           HG1      PRO 130  11.516   0.853   3.742
  172    HD2  PRO 130           HD2      PRO 130  10.388   2.657   5.852
  173    HD3  PRO 130           HD1      PRO 130   9.826   2.389   4.189
  174    H    TYR 131           HN       TYR 131   9.038   1.300   7.643
  175    HA   TYR 131           HA       TYR 131   9.524  -0.366  10.021
  176    HB2  TYR 131           HB2      TYR 131   9.709   2.642   9.789
  177    HB3  TYR 131           HB1      TYR 131   9.686   1.778  11.322
  178    HD1  TYR 131           HD2      TYR 131  11.651   2.489   8.302
  179    HD2  TYR 131           HD1      TYR 131  11.614   0.549  12.089
  180    HE1  TYR 131           HE2      TYR 131  14.091   2.211   8.178
  181    HE2  TYR 131           HE1      TYR 131  14.054   0.266  11.975
  182    HH   TYR 131           HH       TYR 131  15.825   0.192  10.323
  183    H2   PRO  25           HT1      PRO  25  -5.436  17.220  -9.039
  184    H3   PRO  25           HT2      PRO  25  -5.129  18.430  -7.988
  185    HA   PRO  25           HA       PRO  25  -6.626  17.833  -6.621
  186    HB2  PRO  25           HB2      PRO  25  -8.886  16.922  -7.993
  187    HB3  PRO  25           HB1      PRO  25  -8.651  18.540  -7.311
  188    HG2  PRO  25           HG2      PRO  25  -8.224  17.579 -10.098
  189    HG3  PRO  25           HG1      PRO  25  -8.824  19.146  -9.529
  190    HD2  PRO  25           HD2      PRO  25  -6.335  18.907 -10.447
  191    HD3  PRO  25           HD1      PRO  25  -6.679  19.931  -9.041
  192    H    THR  26           HN       THR  26  -6.378  15.971  -5.579
  193    HA   THR  26           HA       THR  26  -7.023  13.436  -6.770
  194    HB   THR  26           HB       THR  26  -4.659  12.539  -6.110
  195    HG1  THR  26           HG1      THR  26  -3.021  14.082  -6.412
  196   HG21  THR  26          HG21      THR  26  -4.929  14.161  -8.639
  197   HG22  THR  26          HG22      THR  26  -5.652  12.571  -8.402
  198   HG23  THR  26          HG23      THR  26  -3.898  12.755  -8.378
  199    HA   PRO  27           HA       PRO  27  -7.437  12.856  -2.324
  200    HB2  PRO  27           HB2      PRO  27  -9.417  11.068  -2.456
  201    HB3  PRO  27           HB1      PRO  27  -9.687  12.753  -2.913
  202    HG2  PRO  27           HG2      PRO  27  -9.521  10.354  -4.615
  203    HG3  PRO  27           HG1      PRO  27 -10.283  11.917  -4.948
  204    HD2  PRO  27           HD2      PRO  27  -7.661  10.965  -5.751
  205    HD3  PRO  27           HD1      PRO  27  -8.483  12.473  -6.209
  206    H    GLU  28           HN       GLU  28  -8.222  10.351  -1.341
  207    HA   GLU  28           HA       GLU  28  -5.724   8.920  -1.525
  208    HB2  GLU  28           HB2      GLU  28  -7.005   7.293   0.042
  209    HB3  GLU  28           HB1      GLU  28  -6.480   8.853   0.634
  210    HG2  GLU  28           HG2      GLU  28  -8.688   9.747   0.444
  211    HG3  GLU  28           HG1      GLU  28  -9.249   8.299  -0.390
  212    H    MET  29           HN       MET  29  -5.905   8.454  -3.736
  213    HA   MET  29           HA       MET  29  -7.945   6.640  -4.666
  214    HB2  MET  29           HB2      MET  29  -6.367   8.441  -5.954
  215    HB3  MET  29           HB1      MET  29  -5.490   6.942  -6.259
  216    HG2  MET  29           HG2      MET  29  -7.534   5.947  -7.182
  217    HG3  MET  29           HG1      MET  29  -8.371   7.477  -6.927
  218    HE1  MET  29           HE1      MET  29  -4.889   6.875  -9.895
  219    HE2  MET  29           HE2      MET  29  -5.637   5.563  -8.984
  220    HE3  MET  29           HE3      MET  29  -4.690   6.790  -8.144
  221    H    ARG  30           HN       ARG  30  -7.967   4.664  -4.221
  222    HA   ARG  30           HA       ARG  30  -5.715   3.248  -3.155
  223    HB2  ARG  30           HB2      ARG  30  -8.604   2.838  -3.430
  224    HB3  ARG  30           HB1      ARG  30  -7.631   1.379  -3.472
  225    HG2  ARG  30           HG2      ARG  30  -6.514   2.641  -1.381
  226    HG3  ARG  30           HG1      ARG  30  -8.172   3.236  -1.269
  227    HD2  ARG  30           HD2      ARG  30  -8.998   0.965  -1.289
  228    HD3  ARG  30           HD1      ARG  30  -7.350   0.360  -1.451
  229    HE   ARG  30           HE       ARG  30  -7.415   1.938   0.817
  230   HH11  ARG  30          HH11      ARG  30  -8.915  -0.997  -0.311
  231   HH12  ARG  30          HH12      ARG  30  -9.090  -1.670   1.276
  232   HH21  ARG  30          HH21      ARG  30  -7.639   1.058   2.910
  233   HH22  ARG  30          HH22      ARG  30  -8.363  -0.503   3.106
  234    H    GLU  31           HN       GLU  31  -5.390   0.932  -3.940
  235    HA   GLU  31           HA       GLU  31  -5.799   0.262  -6.655
  236    HB2  GLU  31           HB2      GLU  31  -4.154   2.020  -7.068
  237    HB3  GLU  31           HB1      GLU  31  -3.044   1.277  -5.925
  238    HG2  GLU  31           HG2      GLU  31  -2.294   0.692  -8.077
  239    HG3  GLU  31           HG1      GLU  31  -3.043  -0.751  -7.401
  240    H    LYS  32           HN       LYS  32  -5.607  -1.812  -6.900
  241    HA   LYS  32           HA       LYS  32  -5.087  -3.472  -4.711
  242    HB2  LYS  32           HB2      LYS  32  -5.218  -4.265  -7.609
  243    HB3  LYS  32           HB1      LYS  32  -5.571  -5.260  -6.206
  244    HG2  LYS  32           HG2      LYS  32  -7.378  -3.563  -5.658
  245    HG3  LYS  32           HG1      LYS  32  -7.145  -2.964  -7.290
  246    HD2  LYS  32           HD2      LYS  32  -7.783  -5.052  -8.241
  247    HD3  LYS  32           HD1      LYS  32  -7.740  -5.851  -6.671
  248    HE2  LYS  32           HE2      LYS  32  -9.577  -4.348  -5.947
  249    HE3  LYS  32           HE1      LYS  32  -9.677  -3.741  -7.595
  250    HZ1  LYS  32           HZ1      LYS  32 -10.219  -5.953  -8.358
  251    HZ2  LYS  32           HZ2      LYS  32 -11.309  -5.486  -7.153
  252    HZ3  LYS  32           HZ3      LYS  32 -10.065  -6.575  -6.793
  253    H    LEU  33           HN       LEU  33  -3.228  -3.779  -3.859
  254    HA   LEU  33           HA       LEU  33  -0.785  -3.938  -5.467
  255    HB2  LEU  33           HB2      LEU  33  -1.106  -3.486  -2.550
  256    HB3  LEU  33           HB1      LEU  33   0.335  -3.392  -3.508
  257    HG   LEU  33           HG       LEU  33  -1.995  -1.518  -3.588
  258   HD11  LEU  33          HD11      LEU  33  -0.230  -1.297  -1.820
  259   HD12  LEU  33          HD12      LEU  33  -0.409   0.121  -2.847
  260   HD13  LEU  33          HD13      LEU  33   0.925  -0.997  -3.106
  261   HD21  LEU  33          HD21      LEU  33  -1.276  -0.559  -5.533
  262   HD22  LEU  33          HD22      LEU  33  -0.779  -2.222  -5.857
  263   HD23  LEU  33          HD23      LEU  33   0.399  -1.045  -5.280
  264    H    CYS  34           HN       CYS  34  -0.332  -6.019  -5.972
  265    HA   CYS  34           HA       CYS  34  -0.682  -8.057  -3.896
  266    HB2  CYS  34           HB2      CYS  34  -1.438  -8.138  -6.457
  267    HB3  CYS  34           HB1      CYS  34   0.154  -8.863  -6.611
  268    H    GLY  35           HN       GLY  35   1.125  -7.237  -2.764
  269    HA2  GLY  35           HA2      GLY  35   3.266  -7.552  -1.983
  270    HA3  GLY  35           HA1      GLY  35   3.509  -8.709  -3.272
  271    H    HIS  36           HN       HIS  36   4.122  -7.834  -5.432
  272    HA   HIS  36           HA       HIS  36   6.121  -5.899  -5.180
  273    HB2  HIS  36           HB2      HIS  36   5.843  -7.757  -6.979
  274    HB3  HIS  36           HB1      HIS  36   4.924  -6.525  -7.850
  275    HD1  HIS  36           HD1      HIS  36   6.928  -6.561  -9.640
  276    HD2  HIS  36           HD2      HIS  36   7.867  -5.162  -5.832
  277    HE1  HIS  36           HE1      HIS  36   9.119  -5.328  -9.864
  278    H    HIS  37           HN       HIS  37   2.904  -5.646  -6.799
  279    HA   HIS  37           HA       HIS  37   3.078  -2.926  -7.423
  280    HB2  HIS  37           HB2      HIS  37   0.707  -4.577  -6.536
  281    HB3  HIS  37           HB1      HIS  37   0.562  -2.875  -6.965
  282    HD1  HIS  37           HD1      HIS  37  -0.693  -3.026  -9.134
  283    HD2  HIS  37           HD2      HIS  37   2.573  -5.570  -8.950
  284    HE1  HIS  37           HE1      HIS  37  -0.470  -4.029 -11.429
  285    H    PHE  38           HN       PHE  38   2.336  -4.679  -4.560
  286    HA   PHE  38           HA       PHE  38   1.617  -2.524  -2.936
  287    HB2  PHE  38           HB2      PHE  38   0.941  -4.687  -2.268
  288    HB3  PHE  38           HB1      PHE  38   2.574  -5.307  -2.351
  289    HD1  PHE  38           HD2      PHE  38   0.800  -2.501  -0.776
  290    HD2  PHE  38           HD1      PHE  38   3.536  -5.725  -0.298
  291    HE1  PHE  38           HE2      PHE  38   1.109  -1.878   1.593
  292    HE2  PHE  38           HE1      PHE  38   3.846  -5.128   2.078
  293    HZ   PHE  38           HZ       PHE  38   2.637  -3.187   3.031
  294    H    VAL  39           HN       VAL  39   4.618  -3.856  -3.938
  295    HA   VAL  39           HA       VAL  39   6.205  -2.456  -2.031
  296    HB   VAL  39           HB       VAL  39   6.733  -4.085  -4.463
  297   HG11  VAL  39          HG11      VAL  39   8.232  -2.627  -5.286
  298   HG12  VAL  39          HG12      VAL  39   9.246  -3.211  -3.968
  299   HG13  VAL  39          HG13      VAL  39   8.334  -1.722  -3.776
  300   HG21  VAL  39          HG21      VAL  39   6.840  -4.646  -1.878
  301   HG22  VAL  39          HG22      VAL  39   8.484  -4.033  -2.071
  302   HG23  VAL  39          HG23      VAL  39   7.933  -5.397  -3.042
  303    H    ARG  40           HN       ARG  40   5.886  -2.009  -5.580
  304    HA   ARG  40           HA       ARG  40   7.029   0.427  -5.856
  305    HB2  ARG  40           HB2      ARG  40   4.557  -0.630  -7.234
  306    HB3  ARG  40           HB1      ARG  40   5.437   0.802  -7.757
  307    HG2  ARG  40           HG2      ARG  40   6.657  -0.550  -9.008
  308    HG3  ARG  40           HG1      ARG  40   7.394  -1.137  -7.529
  309    HD2  ARG  40           HD2      ARG  40   6.040  -3.002  -7.461
  310    HD3  ARG  40           HD1      ARG  40   4.824  -2.297  -8.522
  311    HE   ARG  40           HE       ARG  40   7.438  -2.799  -9.689
  312   HH11  ARG  40          HH11      ARG  40   4.161  -3.892  -9.227
  313   HH12  ARG  40          HH12      ARG  40   4.198  -4.979 -10.576
  314   HH21  ARG  40          HH21      ARG  40   7.494  -4.225 -11.464
  315   HH22  ARG  40          HH22      ARG  40   6.092  -5.167 -11.847
  316    H    ALA  41           HN       ALA  41   3.453   0.049  -5.255
  317    HA   ALA  41           HA       ALA  41   3.014   2.788  -4.974
  318    HB1  ALA  41           HB1      ALA  41   0.962   2.225  -3.873
  319    HB2  ALA  41           HB2      ALA  41   1.550   0.621  -3.424
  320    HB3  ALA  41           HB3      ALA  41   1.240   1.012  -5.120
  321    H    LEU  42           HN       LEU  42   3.951   0.349  -2.514
  322    HA   LEU  42           HA       LEU  42   3.834   1.906  -0.246
  323    HB2  LEU  42           HB2      LEU  42   4.875  -0.558  -0.868
  324    HB3  LEU  42           HB1      LEU  42   6.324   0.336  -0.484
  325    HG   LEU  42           HG       LEU  42   3.961  -0.132   1.331
  326   HD11  LEU  42          HD11      LEU  42   5.172  -2.071   1.466
  327   HD12  LEU  42          HD12      LEU  42   6.005  -1.099   2.680
  328   HD13  LEU  42          HD13      LEU  42   6.695  -1.279   1.068
  329   HD21  LEU  42          HD21      LEU  42   4.587   1.923   2.069
  330   HD22  LEU  42          HD22      LEU  42   6.226   1.763   1.446
  331   HD23  LEU  42          HD23      LEU  42   5.769   0.947   2.942
  332    H    VAL  43           HN       VAL  43   6.269   1.838  -2.746
  333    HA   VAL  43           HA       VAL  43   8.058   3.706  -1.528
  334    HB   VAL  43           HB       VAL  43   8.065   3.350  -4.494
  335   HG11  VAL  43          HG11      VAL  43  10.403   3.370  -4.209
  336   HG12  VAL  43          HG12      VAL  43  10.256   2.928  -2.504
  337   HG13  VAL  43          HG13      VAL  43   9.799   4.552  -3.040
  338   HG21  VAL  43          HG21      VAL  43   7.494   1.144  -3.961
  339   HG22  VAL  43          HG22      VAL  43   8.509   1.158  -2.517
  340   HG23  VAL  43          HG23      VAL  43   9.252   1.140  -4.119
  341    H    ARG  44           HN       ARG  44   6.061   3.904  -4.439
  342    HA   ARG  44           HA       ARG  44   6.096   6.501  -5.128
  343    HB2  ARG  44           HB2      ARG  44   3.522   4.954  -4.758
  344    HB3  ARG  44           HB1      ARG  44   3.824   6.206  -5.938
  345    HG2  ARG  44           HG2      ARG  44   5.770   4.325  -6.469
  346    HG3  ARG  44           HG1      ARG  44   4.338   3.375  -6.070
  347    HD2  ARG  44           HD2      ARG  44   3.114   4.982  -7.673
  348    HD3  ARG  44           HD1      ARG  44   4.729   5.373  -8.256
  349    HE   ARG  44           HE       ARG  44   3.779   2.592  -8.219
  350   HH11  ARG  44          HH11      ARG  44   5.015   5.362  -9.939
  351   HH12  ARG  44          HH12      ARG  44   5.291   4.486 -11.408
  352   HH21  ARG  44          HH21      ARG  44   4.141   1.435 -10.150
  353   HH22  ARG  44          HH22      ARG  44   4.793   2.255 -11.529
  354    H    VAL  45           HN       VAL  45   4.498   5.051  -2.453
  355    HA   VAL  45           HA       VAL  45   3.107   7.346  -1.489
  356    HB   VAL  45           HB       VAL  45   3.647   4.679  -0.198
  357   HG11  VAL  45          HG11      VAL  45   1.816   6.940   0.477
  358   HG12  VAL  45          HG12      VAL  45   3.006   6.123   1.488
  359   HG13  VAL  45          HG13      VAL  45   1.521   5.295   1.037
  360   HG21  VAL  45          HG21      VAL  45   1.957   3.766  -1.342
  361   HG22  VAL  45          HG22      VAL  45   2.260   5.063  -2.487
  362   HG23  VAL  45          HG23      VAL  45   0.987   5.231  -1.286
  363    H    CYS  46           HN       CYS  46   5.433   5.240   0.175
  364    HA   CYS  46           HA       CYS  46   6.191   7.477   1.919
  365    HB2  CYS  46           HB2      CYS  46   5.304   5.248   2.796
  366    HB3  CYS  46           HB1      CYS  46   6.833   4.554   2.288
  367    H    GLY  47           HN       GLY  47   7.429   5.207  -0.383
  368    HA2  GLY  47           HA2      GLY  47   9.417   5.484  -1.628
  369    HA3  GLY  47           HA1      GLY  47   9.989   6.635  -0.430
  370    H    GLY  48           HN       GLY  48   8.678   3.877   0.970
  371    HA2  GLY  48           HA2      GLY  48   9.677   2.325   2.351
  372    HA3  GLY  48           HA1      GLY  48  10.411   1.837   0.836
  373    HA   PRO  49           HA       PRO  49  13.982   2.627   3.537
  374    HB2  PRO  49           HB2      PRO  49  15.666   0.952   2.256
  375    HB3  PRO  49           HB1      PRO  49  14.453   0.398   3.412
  376    HG2  PRO  49           HG2      PRO  49  14.333   0.395   0.430
  377    HG3  PRO  49           HG1      PRO  49  13.867  -0.876   1.574
  378    HD2  PRO  49           HD2      PRO  49  12.094   0.795   0.437
  379    HD3  PRO  49           HD1      PRO  49  11.841   0.117   2.035
  380    H    ARG  50           HN       ARG  50  14.890   1.989   0.168
  381    HA   ARG  50           HA       ARG  50  15.719   4.731  -0.252
  382    HB2  ARG  50           HB2      ARG  50  17.628   2.467   0.090
  383    HB3  ARG  50           HB1      ARG  50  18.054   3.845  -0.901
  384    HG2  ARG  50           HG2      ARG  50  17.745   5.322   1.033
  385    HG3  ARG  50           HG1      ARG  50  17.347   3.919   2.026
  386    HD2  ARG  50           HD2      ARG  50  19.956   4.308   0.566
  387    HD3  ARG  50           HD1      ARG  50  19.698   4.677   2.271
  388    HE   ARG  50           HE       ARG  50  18.931   2.073   2.028
  389   HH11  ARG  50          HH11      ARG  50  21.826   3.853   1.249
  390   HH12  ARG  50          HH12      ARG  50  22.880   2.504   1.512
  391   HH21  ARG  50          HH21      ARG  50  20.313   0.293   2.378
  392   HH22  ARG  50          HH22      ARG  50  22.021   0.482   2.156
  393    H    TRP  51           HN       TRP  51  15.763   1.388  -1.413
  394    HA   TRP  51           HA       TRP  51  15.452   0.454  -3.433
  395    HB2  TRP  51           HB2      TRP  51  14.254   3.076  -4.252
  396    HB3  TRP  51           HB1      TRP  51  13.888   1.467  -4.837
  397    HD1  TRP  51           HD1      TRP  51  13.386   3.624  -1.689
  398    HE1  TRP  51           HE1      TRP  51  11.408   2.624  -0.388
  399    HE3  TRP  51           HE3      TRP  51  12.662  -0.502  -4.486
  400    HZ2  TRP  51           HZ2      TRP  51   9.752   0.328  -0.556
  401    HZ3  TRP  51           HZ3      TRP  51  10.884  -2.067  -3.859
  402    HH2  TRP  51           HH2      TRP  51   9.443  -1.613  -1.915
  403    H    SER  52           HN       SER  52  17.695   2.658  -2.887
  404    HA   SER  52           HA       SER  52  18.472   3.606  -5.422
  405    HB2  SER  52           HB2      SER  52  20.116   3.125  -2.934
  406    HB3  SER  52           HB1      SER  52  20.678   4.017  -4.348
  407    HG   SER  52           HG       SER  52  19.378   5.653  -3.856
  408    H    THR  53           HN       THR  53  20.085   1.167  -3.476
  409    HA   THR  53           HA       THR  53  21.352  -0.641  -3.966
  410    HB   THR  53           HB       THR  53  20.500  -2.187  -5.690
  411    HG1  THR  53           HG1      THR  53  18.374  -0.411  -6.208
  412   HG21  THR  53          HG21      THR  53  18.359  -0.943  -3.961
  413   HG22  THR  53          HG22      THR  53  19.493  -2.201  -3.471
  414   HG23  THR  53          HG23      THR  53  18.277  -2.543  -4.701
  415    H    GLU  54           HN       GLU  54  20.548   0.196  -7.324
  416    HA   GLU  54           HA       GLU  54  23.326  -0.017  -8.065
  417    HB2  GLU  54           HB2      GLU  54  20.930   0.780  -9.726
  418    HB3  GLU  54           HB1      GLU  54  22.523   0.372 -10.345
  419    HG2  GLU  54           HG2      GLU  54  22.282  -1.901  -9.517
  420    HG3  GLU  54           HG1      GLU  54  20.698  -1.500  -8.852
  421    H    ALA  55           HN       ALA  55  21.905   2.295  -6.451
  422    HA   ALA  55           HA       ALA  55  22.174   4.534  -6.152
  423    HB1  ALA  55           HB1      ALA  55  24.359   5.461  -6.712
  424    HB2  ALA  55           HB2      ALA  55  24.703   4.060  -7.726
  425    HB3  ALA  55           HB3      ALA  55  24.516   3.863  -5.983