*HEADER   CYTOKINE                                01-MAY-92   1BCN    
*COMPND   INTERLEUKIN 4 (NMR, 22 STRUCTURES)                          
*SOURCE   HUMAN (HOMO SAPIENS) RECOMBINANT FORM EXPRESSED IN YEAST    
*SOURCE  2 (SACCHAROMYCES CEREVISIAE)                                 
*AUTHOR   G.M.CLORE,B.POWERS,D.S.GARRETT,A.M.GRONENBORN               
*REVDAT  1   31-OCT-93 1BCN    0                                      

REMARK Experimental NMR restraints used for the three-dimensional structure 
REMARK determination of recombinant human interleukin-4
REMARK 
REMARK
REMARK Authors: G.M. Clore, B. Powers, D.S. Garrett and A.M. Gronenborn
REMARK
REMARK References
REMARK
REMARK 1.  R. Powers, D.S. Garrett, C.J. March, E.A. Frieden, A.M. Gronenborn
REMARK     and G.M. Clore (1992) Three dimensional solution structure of 
REMARK     human interleukin-4 by multidimensional heteronuclear magnetic 
REMARK     resonance spectroscopy. Science in press
REMARK
REMARK 2.  R. Powers, D.S. Garrett, C.J. March, E.A. Frieden, A.M. Gronenborn
REMARK     and G.M. Clore (1992) 1H, 15N, 13C and 13CO assignments of human
REMARK     interleukin-4 using three-dimensional double- and triple-resonance
REMARK     hetronuclear magnetic resonance spectroscopy. Biochemistry 31, issue
REMARK     18, in press
REMARK
REMARK 3.  D.S. Garrett, R. Powers, C.J. March, E.A. Frieden, G.M. Clore
REMARK     and A.M. Gronenborn (1992) Determination of the secondary structure
REMARK     and folding topology of human interleukin-4 using three-dimensional
REMARK     heteronuclear magnetic resonance spectroscopy. Biochemistry 31,
REMARK     issue 18, in press
REMARK
REMARK     The numbering scheme in this structure includes the four-residue
REMARK     sequence Glu-Ala-Glu-Ala at the N-terminus of the recombinant
REMARK     protein which is not part of the natural human IL-4; the natural
REMARK     IL-4 sequence therefore starts at residue 5.
REMARK
REMARK    Details of the structure determination and all structural
REMARK    statistics are given in ref. 1 (i.e. agreement with experimental
REMARK    restraints, deviations from ideality for bond lengths, angles,
REMARK    planes and chirality, non-bonded contacts, atomic rms differences
REMARK    between the calculated structures).
REMARK    The structures are based on 823 interproton distance restraints
REMARK    derived from NOE measurements; 98 hydrogen-bonding distance
REMARK    restraints for 49 hydrogen-bonds identified on the basis of the
REMARK    NOE and amide proton exchange data, as well as the initial structure
REMARK    calculations; and 101 phi and 82 psi backbone torsion angle 
REMARK    restraints derived from oupling constants, NOE data, and 13C
REMARK    secondary chemical shifts. 
REMARK
REMARK    The method used to determine the structures
REMARK    is the hybrid metric matrix distance geometry-dynamical simulated
REMARK    annealing method  [Nilges, M., Clore, G.M. & Gronenborn, A.M.
REMARK    FEBS Lett. 229, 317-324 (1988)].
REMARK
REMARK
REMARK
REMARK    The NOE restraints are given in (A) and the torsion angle restraints
REMARK    in (B).
REMARK
REMARK

A. NOE interproton distance restraints

The restraints are represented by square-well potentials with the upper (u)
and lower (l) limits given  by u=i+k and l=i-j where the numbers are
entered in the order i,j,k. [Clore et al. (1986) EMBO J. 5, 2729-2735]

The NOEs are classified into three distance ranges corresponding to
strong, medium and weak NOEs.  These are 1.8-2.7 A, 1.8-3.3 A and 1.8-5.0 A,
respectively.  Appropriate corrections to the upper limits for distances
involving methyl, methylene and Tyr and Phe aromatic ring protons, to account
for centre averaging, are carried out as described by Wuthrich et al. 
[J. Mol. Biol. 169, 949-961 (1983)].  In addition, an extra 0.5 A is added
to the upper limits of distances involving methyl protons [Clore et al.
(1983) Biochemistry 26, 8012-8023; Wagner et al. (1987) 
J. Mol. Biol. 196, 611-640].

The atom notation follows standard PDB format.  The # indicates a single
wild card, and the * a full wild card. e.g. For Leu, HD* representes all the
methyl protons; for a normal methylene beta proton, HB# represents the 
two protons.  In these cases, the distances are calculated as centre 
 averages.

Note that the hard sphere van der Waals repulsion term ensures that
the minimum lower limit for all distances is the sum of the relevant
hard sphere atom radii.


!!sequential NOEs |i-j|=1
!E3
assign (resid    3 and  name HB#  )(resid    4 and  name HN   ) 4.0 3.2 2.0 !
!A4
assign (resid    4 and  name HA   )(resid    5 and  name HN   ) 3.0 1.2 0.5
!K6
assign (resid    6 and  name HB#  )(resid    7 and  name HN   ) 3.0 1.2 1.3 !
assign (resid    6 and  name HA   )(resid    7 and  name HN   ) 2.5 0.7 0.2
!C7
assign (resid    7 and  name HN   )(resid    8 and  name HN   ) 3.0 1.2 0.5
!D8
assign (resid    8 and  name HB#  )(resid    9 and  name HN   ) 2.5 1.7 1.2 !
assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 3.0 1.2 0.5
!I9
assign (resid    9 and  name HB#  )(resid   10 and  name HN   ) 3.0 1.2 0.5
assign (resid    9 and  name HG2# )(resid   10 and  name HA   ) 4.0 3.7 1.8 !
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 3.0 1.2 0.5
!T10
assign (resid   10 and  name HB#  )(resid   11 and  name HN   ) 2.5 0.7 0.2
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 3.0 1.2 0.3
!L11
assign (resid   11 and  name HB#  )(resid   12 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   11 and  name HA   )(resid   12 and  name HN   ) 4.0 2.2 1.0
assign (resid   11 and  name HN   )(resid   12 and  name HN   ) 2.5 0.7 0.4
!Q12
assign (resid   12 and  name HB#  )(resid   13 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   12 and  name HA   )(resid   13 and  name HN   ) 3.0 1.2 0.5
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 2.5 0.7 0.4
!E13
assign (resid   13 and  name HB#  )(resid   14 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   13 and  name HN   )(resid   14 and  name HN   ) 2.5 0.7 0.4
!I14
assign (resid   14 and  name HB#  )(resid   15 and  name HN   ) 3.0 1.2 0.5
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 2.5 0.7 0.4
!I15
assign (resid   15 and  name HB#  )(resid   16 and  name HN   ) 2.5 0.7 0.2
assign (resid   15 and  name HA   )(resid   16 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 3.0 1.2 0.5
!K16
assign (resid   16 and  name HB#  )(resid   17 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   16 and  name HA   )(resid   17 and  name HN   ) 3.0 1.2 0.5
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.5 0.7 0.4
!T17
assign (resid   17 and  name HB#  )(resid   18 and  name HN   ) 2.5 0.7 0.2
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.5 0.7 0.4
!L18
assign (resid   18 and  name HB#  )(resid   19 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 3.0 1.2 0.5
!N19
assign (resid   19 and  name HB#  )(resid   20 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 3.0 1.2 0.5
!S20
assign (resid   20 and  name HB#  )(resid   21 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.5 0.7 0.4
!L21
assign (resid   21 and  name HB#  )(resid   22 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   21 and  name HA   )(resid   22 and  name HN   ) 3.0 1.2 0.5
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 3.0 1.2 0.5
!T22
assign (resid   22 and  name HB   )(resid   23 and  name HN   ) 4.0 2.2 1.0
assign (resid   22 and  name HA   )(resid   23 and  name HN   ) 3.0 1.2 0.5
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 3.0 1.2 0.5
!E23
assign (resid   23 and  name HA   )(resid   24 and  name HN   ) 3.0 1.2 0.5
assign (resid   23 and  name HN   )(resid   24 and  name HN   ) 4.0 2.2 1.0
!Q24
assign (resid   24 and  name HB#  )(resid   25 and  name HN   ) 3.0 2.2 1.3 !
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 2.5 0.7 0.2
assign (resid   24 and  name HN   )(resid   25 and  name HN   ) 3.0 1.2 0.5
!K25
assign (resid   25 and  name HB#  )(resid   26 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   25 and  name HA   )(resid   26 and  name HN   ) 3.0 1.2 0.5
!T26
assign (resid   26 and  name HA   )(resid   27 and  name HN   ) 4.0 2.2 1.0
!L27
assign (resid   27 and  name HA   )(resid   28 and  name HN   ) 3.0 1.2 0.5
!C28
assign (resid   28 and  name HB#  )(resid   29 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   28 and  name HN   )(resid   29 and  name HN   ) 3.0 1.2 0.5
!T29
assign (resid   29 and  name HG2# )(resid   30 and  name HG#  ) 4.0 4.7 3.5 ! !#
!L31
assign (resid   31 and  name HB#  )(resid   32 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   31 and  name HN   )(resid   32 and  name HN   ) 3.0 1.2 0.5
assign (resid   31 and  name HA   )(resid   32 and  name HG2# ) 4.0 3.7 2.5 !#
!T32
assign (resid   32 and  name HB#  )(resid   33 and  name HN   ) 4.0 2.2 1.0
assign (resid   32 and  name HA   )(resid   33 and  name HN   ) 3.0 1.2 0.5
assign (resid   32 and  name HN   )(resid   33 and  name HN   ) 4.0 2.2 1.0
assign (resid   32 and  name HA   )(resid   33 and  name HG*  ) 4.0 4.6 3.4 !#
!V33
assign (resid   33 and  name HB   )(resid   34 and  name HN   ) 4.0 2.2 1.0
!T34
assign (resid   34 and  name HB#  )(resid   35 and  name HN   ) 4.0 2.2 1.0
assign (resid   34 and  name HA   )(resid   35 and  name HN   ) 2.5 0.7 0.2
assign (resid   34 and  name HN   )(resid   35 and  name HN   ) 4.0 2.2 1.0
!I36
assign (resid   36 and  name HN   )(resid   37 and  name HN   ) 3.0 1.2 0.5
assign (resid   36 and  name HG1# )(resid   37 and  name HA   ) 4.0 3.2 2.0 !
assign (resid   36 and  name HD#  )(resid   37 and  name HA   ) 4.0 3.7 2.5 !
assign (resid   36 and  name HD#  )(resid   37 and  name HE#  ) 3.0 4.7 3.8 ! !#
assign (resid   36 and  name HG1# )(resid   37 and  name HE#  ) 3.0 4.2 3.3 ! !#
assign (resid   36 and  name HG2# )(resid   37 and  name HE#  ) 4.0 5.7 4.5 ! !#
assign (resid   36 and  name HG2# )(resid   37 and  name HD#  ) 3.0 4.7 3.8 ! !#
assign (resid   36 and  name HG1# )(resid   37 and  name HD#  ) 3.0 4.2 3.3 ! !#
assign (resid   36 and  name HD#  )(resid   37 and  name HZ   ) 3.0 2.7 1.8 !
assign (resid   36 and  name HG1# )(resid   37 and  name HZ   ) 3.0 2.2 1.3 !
assign (resid   36 and  name HG2# )(resid   37 and  name HZ   ) 4.0 3.7 2.5 !
!F37
assign (resid   37 and  name HB#  )(resid   38 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   37 and  name HA   )(resid   38 and  name HN   ) 3.0 1.2 0.5
assign (resid   37 and  name HN   )(resid   38 and  name HN   ) 2.5 0.7 0.4
!A38
assign (resid   38 and  name HA   )(resid   39 and  name HN   ) 3.0 1.2 0.5
assign (resid   38 and  name HN   )(resid   39 and  name HN   ) 3.0 1.2 0.5
!A39
assign (resid   39 and  name HB#  )(resid   40 and  name HN   ) 3.0 2.7 2.0 !
assign (resid   39 and  name HA   )(resid   40 and  name HN   ) 2.5 0.7 0.2
!S40
assign (resid   40 and  name HN   )(resid   41 and  name HN   ) 4.0 2.2 1.0
!K41
assign (resid   41 and  name HB#  )(resid   42 and  name HN   ) 3.0 2.2 1.5 !
!D42
assign (resid   42 and  name HB#  )(resid   43 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   42 and  name HN   )(resid   43 and  name HN   ) 2.5 0.7 0.4
!T43
assign (resid   43 and  name HB#  )(resid   44 and  name HN   ) 3.0 1.2 0.5
!T44
assign (resid   44 and  name HA   )(resid   45 and  name HN   ) 3.0 1.2 0.5
assign (resid   44 and  name HN   )(resid   45 and  name HN   ) 4.0 2.2 1.0
!K46
assign (resid   46 and  name HN   )(resid   47 and  name HN   ) 3.0 1.2 0.5
!E47
assign (resid   47 and  name HB#  )(resid   48 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   47 and  name HA   )(resid   48 and  name HN   ) 4.0 2.2 1.0
assign (resid   47 and  name HN   )(resid   48 and  name HN   ) 3.0 1.2 0.5
!T48
assign (resid   48 and  name HA   )(resid   49 and  name HN   ) 3.0 1.2 0.5
assign (resid   48 and  name HN   )(resid   49 and  name HN   ) 3.0 1.2 0.5
assign (resid   48 and  name HB#  )(resid   49 and  name HD#  ) 4.0 4.2 3.0 !#
assign (resid   48 and  name HG2# )(resid   49 and  name HD#  ) 4.0 5.7 4.5 ! !#
!F49
assign (resid   49 and  name HB#  )(resid   50 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   49 and  name HA   )(resid   50 and  name HN   ) 4.0 2.2 1.0
assign (resid   49 and  name HN   )(resid   50 and  name HN   ) 3.0 1.2 0.5
!C50
assign (resid   50 and  name HB#  )(resid   51 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   50 and  name HN   )(resid   51 and  name HN   ) 2.5 0.7 0.4
!R51
assign (resid   51 and  name HB#  )(resid   52 and  name HN   ) 3.0 2.2 1.5 !
ssign (resid 51 and name ha)  (resid 52 and name hn) 4.0 2.2 1.0
assign (resid   51 and  name HN   )(resid   52 and  name HN   ) 2.5 0.7 0.4
!A52
assign (resid   52 and  name HB#  )(resid   53 and  name HN   ) 3.0 2.7 2.0 !
assign (resid   52 and  name HA   )(resid   53 and  name HN   ) 3.0 1.2 0.5
assign (resid   52 and  name HN   )(resid   53 and  name HN   ) 2.5 0.7 0.4
!A53
assign (resid   53 and  name HA   )(resid   54 and  name HN   ) 4.0 2.2 1.0
assign (resid   53 and  name HN   )(resid   54 and  name HN   ) 3.0 1.2 0.5
!T54
assign (resid   54 and  name HN   )(resid   55 and  name HN   ) 2.5 0.7 0.4
assign (resid   54 and  name HG2# )(resid   55 and  name HA   ) 3.0 2.7 1.8 !
!V55
assign (resid   55 and  name HB#  )(resid   56 and  name HN   ) 3.0 1.2 0.5
assign (resid   55 and  name HA   )(resid   56 and  name HN   ) 4.0 2.2 1.0
assign (resid   55 and  name HN   )(resid   56 and  name HN   ) 3.0 1.2 0.5
!R57
assign (resid   57 and  name HN   )(resid   58 and  name HN   ) 3.0 1.2 0.5
!Q58
assign (resid   58 and  name HB#  )(resid   59 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   58 and  name HA   )(resid   59 and  name HN   ) 3.0 1.2 0.5
assign (resid   58 and  name HN   )(resid   59 and  name HN   ) 3.0 1.2 0.5
!F59
assign (resid   59 and  name HB#  )(resid   60 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   59 and  name HN   )(resid   60 and  name HN   ) 3.0 1.2 0.5
assign (resid   59 and  name HD#  )(resid   60 and  name HB#  ) 4.0 5.2 4.0 ! !#
!Y60
assign (resid   60 and  name HB#  )(resid   61 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   60 and  name HA   )(resid   61 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HN   )(resid   61 and  name HN   ) 3.0 1.2 0.5
assign (resid   60 and  name HD#  )(resid   61 and  name HA   ) 3.0 3.2 2.3 !
!S61
assign (resid   61 and  name HB#  )(resid   62 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   61 and  name HN   )(resid   62 and  name HN   ) 2.5 0.7 0.4
!H62
assign (resid   62 and  name HB#  )(resid   63 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   62 and  name HN   )(resid   63 and  name HN   ) 2.5 0.7 0.4
!H63
assign (resid   63 and  name HB#  )(resid   64 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   63 and  name HA   )(resid   64 and  name HN   ) 4.0 2.2 1.0
assign (resid   63 and  name HN   )(resid   64 and  name HN   ) 3.0 1.2 0.5
!T67
assign (resid   67 and  name HA   )(resid   68 and  name HN   ) 3.0 1.2 0.5
!R68
assign (resid   68 and  name HB#  )(resid   69 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   68 and  name HA   )(resid   69 and  name HN   ) 4.0 2.2 1.0
assign (resid   68 and  name HN   )(resid   69 and  name HN   ) 3.0 1.2 0.5
!C69
assign (resid   69 and  name HB#  )(resid   70 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   69 and  name HA   )(resid   70 and  name HN   ) 3.0 1.2 0.5
assign (resid   69 and  name HN   )(resid   70 and  name HN   ) 3.0 1.2 0.5
!L70
assign (resid   70 and  name HB#  )(resid   71 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   70 and  name HN   )(resid   71 and  name HN   ) 3.0 1.2 0.5
!G71
assign (resid   71 and  name HA#  )(resid   72 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   71 and  name HN   )(resid   72 and  name HN   ) 4.0 2.2 1.0
!A72
assign (resid   72 and  name HB#  )(resid   73 and  name HN   ) 3.0 2.7 2.0 !
assign (resid   72 and  name HN   )(resid   73 and  name HN   ) 2.5 0.7 0.4
!Q75
assign (resid   75 and  name HB#  )(resid   76 and  name HN   ) 2.5 1.7 1.2 !
!Q76
assign (resid   76 and  name HB#  )(resid   77 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   76 and  name HA   )(resid   77 and  name HN   ) 3.0 1.2 0.5
assign (resid   76 and  name HN   )(resid   77 and  name HN   ) 2.5 0.7 0.4
!F77
assign (resid   77 and  name HB#  )(resid   78 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   77 and  name HA   )(resid   78 and  name HN   ) 4.0 2.2 1.0
!H78
assign (resid   78 and  name HB#  )(resid   79 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   78 and  name HA   )(resid   79 and  name HN   ) 3.0 1.2 0.5
assign (resid   78 and  name HN   )(resid   79 and  name HN   ) 3.0 1.2 0.5
!R79
assign (resid   79 and  name HB#  )(resid   80 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   79 and  name HA   )(resid   80 and  name HN   ) 4.0 2.2 1.0
assign (resid   79 and  name HN   )(resid   80 and  name HN   ) 4.0 2.2 1.0
!H80
assign (resid   80 and  name HB#  )(resid   81 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   80 and  name HN   )(resid   81 and  name HN   ) 2.5 0.7 0.4
!K81
assign (resid   81 and  name HB#  )(resid   82 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   81 and  name HA   )(resid   82 and  name HN   ) 3.0 1.2 0.5
assign (resid   81 and  name HN   )(resid   82 and  name HN   ) 2.5 0.7 0.4
!Q82
assign (resid   82 and  name HB#  )(resid   83 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   82 and  name HA   )(resid   83 and  name HN   ) 4.0 2.2 1.0
!L83
assign (resid   83 and  name HB#  )(resid   84 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   83 and  name HN   )(resid   84 and  name HN   ) 2.5 0.7 0.4
!I84
assign (resid   84 and  name HB#  )(resid   85 and  name HN   ) 2.5 0.7 0.2
assign (resid   84 and  name HA   )(resid   85 and  name HN   ) 4.0 2.2 1.0
assign (resid   84 and  name HN   )(resid   85 and  name HN   ) 2.5 0.7 0.4
!R85
assign (resid   85 and  name HB#  )(resid   86 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   85 and  name HA   )(resid   86 and  name HN   ) 3.0 1.2 0.5
assign (resid   85 and  name HN   )(resid   86 and  name HN   ) 3.0 1.2 0.3
!F86
assign (resid   86 and  name HB#  )(resid   87 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   86 and  name HA   )(resid   87 and  name HN   ) 4.0 2.2 1.0
assign (resid   86 and  name HN   )(resid   87 and  name HN   ) 2.5 0.7 0.4
!L87
assign (resid   87 and  name HB#  )(resid   88 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   87 and  name HA   )(resid   88 and  name HN   ) 4.0 2.2 1.0
assign (resid   87 and  name HN   )(resid   88 and  name HN   ) 2.5 0.7 0.4
assign (resid   87 and  name HD*  )(resid   88 and  name HG1  ) 3.0 4.6 3.7 ! !#
assign (resid   87 and  name HD*  )(resid   88 and  name HG2  ) 3.0 4.6 3.7 ! !#
!K88
assign (resid   88 and  name HB#  )(resid   89 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   88 and  name HA   )(resid   89 and  name HN   ) 4.0 2.2 1.0
assign (resid   88 and  name HN   )(resid   89 and  name HN   ) 2.5 0.7 0.4
!R89
assign (resid   89 and  name HB#  )(resid   90 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   89 and  name HA   )(resid   90 and  name HN   ) 3.0 1.2 0.5
assign (resid   89 and  name HN   )(resid   90 and  name HN   ) 2.5 0.7 0.4
!L90
assign (resid   90 and  name HB#  )(resid   91 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   90 and  name HA   )(resid   91 and  name HN   ) 3.0 1.2 0.5
assign (resid   90 and  name HN   )(resid   91 and  name HN   ) 3.0 1.2 0.5
!D91
assign (resid   91 and  name HB#  )(resid   92 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   91 and  name HN   )(resid   92 and  name HN   ) 2.5 0.7 0.4
!R92
assign (resid   92 and  name HB#  )(resid   93 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   92 and  name HA   )(resid   93 and  name HN   ) 3.0 1.2 0.5
assign (resid   92 and  name HN   )(resid   93 and  name HN   ) 3.0 1.2 0.5
!N93
assign (resid   93 and  name HB#  )(resid   94 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   93 and  name HA   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   93 and  name HN   )(resid   94 and  name HN   ) 2.5 0.7 0.4
!L94
assign (resid   94 and  name HA   )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   94 and  name HN   )(resid   95 and  name HN   ) 3.0 1.2 0.5
!W95
assign (resid   95 and  name HB#  )(resid   96 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   95 and  name HA   )(resid   96 and  name HN   ) 4.0 2.2 1.0
assign (resid   95 and  name HN   )(resid   96 and  name HN   ) 2.5 0.7 0.4
!G96
assign (resid   96 and  name HA#  )(resid   97 and  name HN   ) 3.0 2.2 1.5 !
assign (resid   96 and  name HN   )(resid   97 and  name HN   ) 2.5 0.7 0.4
!L97
assign (resid   97 and  name HN   )(resid   98 and  name HN   ) 2.5 0.7 0.4
!A98
assign (resid   98 and  name HB#  )(resid   99 and  name HN   ) 2.5 2.2 1.7 !
assign (resid   98 and  name HA   )(resid   99 and  name HN   ) 3.0 1.2 0.5
assign (resid   98 and  name HN   )(resid   99 and  name HN   ) 2.5 0.7 0.4
!G99
assign (resid   99 and  name HA#  )(resid  100 and  name HN   ) 2.5 1.7 1.2 !
assign (resid   99 and  name HN   )(resid  100 and  name HN   ) 2.5 0.7 0.4
!N101
assign (resid  101 and  name HB#  )(resid  102 and  name HN   ) 4.0 3.2 2.0 !
!S102
assign (resid  102 and  name HB#  )(resid  103 and  name HA   ) 4.0 3.2 2.0 !
!C103
assign (resid  103 and  name HA   )(resid  104 and  name HD#  ) 2.5 1.7 1.2 !#
assign (resid  103 and  name HA   )(resid  104 and  name HD#  ) 3.0 2.2 1.3 !#
assign (resid  103 and  name HA   )(resid  104 and  name HG#  ) 4.0 3.2 2.0 !#
!P104
assign (resid  104 and  name HB#  )(resid  105 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  104 and  name HA   )(resid  105 and  name HN   ) 3.0 1.2 0.5
!V105
assign (resid  105 and  name HA   )(resid  106 and  name HN   ) 2.5 0.7 0.2
!K106
assign (resid  106 and  name HB#  )(resid  107 and  name HN   ) 3.0 2.2 1.5 !
!E107
assign (resid  107 and  name HB#  )(resid  108 and  name HN   ) 3.0 2.2 1.5 !
!A108
assign (resid  108 and  name HB#  )(resid  109 and  name HN   ) 2.5 2.2 1.7 !
assign (resid  108 and  name HA   )(resid  109 and  name HN   ) 2.5 0.7 0.2
!D109
assign (resid  109 and  name HB#  )(resid  110 and  name HN   ) 4.0 3.2 2.0 !
assign (resid  109 and  name HN   )(resid  110 and  name HN   ) 4.0 2.2 1.0
!Q110
assign (resid  110 and  name HB#  )(resid  111 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  110 and  name HN   )(resid  111 and  name HN   ) 4.0 2.2 1.0
!S111
assign (resid  111 and  name HA   )(resid  112 and  name HN   ) 2.5 0.7 0.2
assign (resid  111 and  name HN   )(resid  112 and  name HN   ) 4.0 2.2 1.0
assign (resid  111 and  name HA   )(resid  112 and  name HG2# ) 4.0 3.7 2.5 !#
!T112
assign (resid  112 and  name HA   )(resid  113 and  name HN   ) 2.5 0.7 0.2
!L113
assign (resid  113 and  name HB#  )(resid  114 and  name HN   ) 4.0 3.2 2.0 !
assign (resid  113 and  name HN   )(resid  114 and  name HN   ) 3.0 1.2 0.5
!E114
assign (resid  114 and  name HB#  )(resid  115 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  114 and  name HA   )(resid  115 and  name HN   ) 3.0 1.2 0.5
assign (resid  114 and  name HN   )(resid  115 and  name HN   ) 3.0 1.2 0.5
!N115
assign (resid  115 and  name HB#  )(resid  116 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  115 and  name HN   )(resid  116 and  name HN   ) 2.5 0.7 0.4
!F116
assign (resid  116 and  name HB#  )(resid  117 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  116 and  name HA   )(resid  117 and  name HN   ) 4.0 2.2 1.0
assign (resid  116 and  name HN   )(resid  117 and  name HN   ) 3.0 1.2 0.5
!L117
assign (resid  117 and  name HN   )(resid  118 and  name HN   ) 3.0 1.2 0.5
!E118
assign (resid  118 and  name HA   )(resid  119 and  name HN   ) 3.0 1.2 0.5
!R119
assign (resid  119 and  name HB#  )(resid  120 and  name HN   ) 2.5 1.7 1.2 !
assign (resid  119 and  name HA   )(resid  120 and  name HN   ) 3.0 1.2 0.5
assign (resid  119 and  name HN   )(resid  120 and  name HN   ) 2.5 0.7 0.4
!L120
assign (resid  120 and  name HB#  )(resid  121 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  120 and  name HA   )(resid  121 and  name HN   ) 4.0 2.2 1.0
assign (resid  120 and  name HN   )(resid  121 and  name HN   ) 2.5 0.7 0.4
!K121
assign (resid  121 and  name HB#  )(resid  122 and  name HN   ) 2.5 1.7 1.2 !
assign (resid  121 and  name HA   )(resid  122 and  name HN   ) 3.0 1.2 0.5
assign (resid  121 and  name HN   )(resid  122 and  name HN   ) 2.5 0.7 0.4
assign (resid  121 and  name HB#  )(resid  122 and  name HG2# ) 3.0 3.7 2.8 ! !#
assign (resid  121 and  name HE#  )(resid  122 and  name HG2# ) 3.0 3.7 2.8 ! !#
!T122
assign (resid  122 and  name HB#  )(resid  123 and  name HN   ) 2.5 0.7 0.2
assign (resid  122 and  name HA   )(resid  123 and  name HN   ) 3.0 1.2 0.5
assign (resid  122 and  name HN   )(resid  123 and  name HN   ) 2.5 0.7 0.4
!I123
assign (resid  123 and  name HB#  )(resid  124 and  name HN   ) 2.5 0.7 0.2
assign (resid  123 and  name HA   )(resid  124 and  name HN   ) 3.0 1.2 0.5
assign (resid  123 and  name HN   )(resid  124 and  name HN   ) 2.5 0.7 0.4
assign (resid  123 and  name HG2# )(resid  124 and  name HA   ) 3.0 2.7 1.8 !
assign (resid  123 and  name HG2# )(resid  124 and  name HG#  ) 4.0 4.7 3.5 ! !#
!M124
assign (resid  124 and  name HB#  )(resid  125 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  124 and  name HA   )(resid  125 and  name HN   ) 3.0 1.2 0.5
assign (resid  124 and  name HN   )(resid  125 and  name HN   ) 3.0 1.2 0.5
!R125
assign (resid  125 and  name HB#  )(resid  126 and  name HN   ) 2.5 1.7 1.2 !
assign (resid  125 and  name HA   )(resid  126 and  name HN   ) 3.0 1.2 0.5
assign (resid  125 and  name HN   )(resid  126 and  name HN   ) 2.5 0.7 0.4
!E126
assign (resid  126 and  name HB#  )(resid  127 and  name HN   ) 2.5 1.7 1.2 !
assign (resid  126 and  name HN   )(resid  127 and  name HN   ) 3.0 1.2 0.5
!K127
assign (resid  127 and  name HA   )(resid  128 and  name HN   ) 4.0 2.2 1.0
assign (resid  127 and  name HN   )(resid  128 and  name HN   ) 2.5 0.7 0.4
!Y128
assign (resid  128 and  name HB#  )(resid  129 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  128 and  name HA   )(resid  129 and  name HN   ) 3.0 1.2 0.5
assign (resid  128 and  name HN   )(resid  129 and  name HN   ) 2.5 0.7 0.4
!S129
assign (resid  129 and  name HN   )(resid  130 and  name HN   ) 3.0 1.2 0.5
!K130
assign (resid  130 and  name HB#  )(resid  131 and  name HN   ) 3.0 2.2 1.5 !
assign (resid  130 and  name HA   )(resid  131 and  name HN   ) 3.0 1.2 0.5
assign (resid  130 and  name HN   )(resid  131 and  name HN   ) 2.5 0.7 0.4
!C131
assign (resid  131 and  name HN   )(resid  132 and  name HN   ) 2.5 0.7 0.4
!S132
assign (resid  132 and  name HB#  )(resid  133 and  name HN   ) 4.0 3.2 2.0 !
assign (resid  132 and  name HA   )(resid  133 and  name HN   ) 2.5 0.7 0.2

!Medium range NOEs 1 < |i-j| <=5
!H5
assign (resid    5 and  name HN   )(resid    7 and  name HN   ) 4.0 2.2 1.0
!C7
assign (resid    7 and  name HA   )(resid   10 and  name HB#  ) 4.0 2.2 1.0
!D8
assign (resid    8 and  name HA   )(resid   11 and  name HB#  ) 4.0 3.2 2.0 !#
!I9
assign (resid    9 and  name HA   )(resid   12 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid    9 and  name HA   )(resid   12 and  name HN   ) 4.0 2.2 1.0
assign (resid    9 and  name HN   )(resid   11 and  name HN   ) 4.0 2.2 1.0
assign (resid    9 and  name HA   )(resid   12 and  name HG#  ) 3.0 2.2 1.3 !#
assign (resid    9 and  name HG2# )(resid   10 and  name HA   ) 4.0 3.7 1.8 !
!T10
assign (resid   10 and  name HA   )(resid   13 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   10 and  name HA   )(resid   13 and  name HN   ) 4.0 2.2 1.0
assign (resid   10 and  name HG2# )(resid   14 and  name HB#  ) 3.0 2.7 1.8 !
assign (resid   10 and  name HG2# )(resid   14 and  name HG1# ) 3.0 3.7 2.8 ! !#
assign (resid   10 and  name HG2# )(resid   14 and  name HD#  ) 3.0 4.2 3.3 ! !#
assign (resid   10 and  name HG2# )(resid   13 and  name HB#  ) 4.0 4.7 3.5 ! !#
!L11
assign (resid   11 and  name HA   )(resid   14 and  name HB#  ) 3.0 1.2 0.3
assign (resid   11 and  name HA   )(resid   14 and  name HN   ) 4.0 2.2 1.0
assign (resid   11 and  name HD*  )(resid   15 and  name HD#  ) 3.0 5.1 4.2 ! !#
assign (resid   11 and  name HG   )(resid   15 and  name HD#  ) 4.0 3.7 2.5 !#
assign (resid   11 and  name HB#  )(resid   15 and  name HD#  ) 4.0 4.7 3.5 ! !#
assign (resid   11 and  name HA   )(resid   14 and  name HD#  ) 3.0 2.7 1.8 !#
!Q12
assign (resid   12 and  name HA   )(resid   15 and  name HB#  ) 3.0 1.2 0.3
assign (resid   12 and  name HA   )(resid   15 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   14 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HN   )(resid   14 and  name HN   ) 4.0 2.2 1.0
assign (resid   12 and  name HA   )(resid   15 and  name HG2# ) 3.0 2.7 1.8 !#
assign (resid   12 and  name HA   )(resid   15 and  name HD#  ) 3.0 2.7 1.8 !#
!E13
assign (resid   13 and  name HA   )(resid   16 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   13 and  name HA   )(resid   15 and  name HN   ) 4.0 2.2 1.0
assign (resid   13 and  name HA   )(resid   16 and  name HE#  ) 3.0 2.2 1.3 !#
!I14
assign (resid   14 and  name HA   )(resid   17 and  name HB#  ) 3.0 1.2 0.3
assign (resid   14 and  name HA   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   16 and  name HN   ) 4.0 2.2 1.0
assign (resid   14 and  name HA   )(resid   17 and  name HG2# ) 4.0 3.7 2.5 !#
!I15
assign (resid   15 and  name HA   )(resid   18 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   15 and  name HA   )(resid   18 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HA   )(resid   17 and  name HN   ) 4.0 2.2 1.0
assign (resid   15 and  name HN   )(resid   17 and  name HN   ) 4.0 2.2 1.0
!K16
assign (resid   16 and  name HA   )(resid   19 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   16 and  name HA   )(resid   19 and  name HN   ) 4.0 2.2 1.0
!T17
assign (resid   17 and  name HA   )(resid   20 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   17 and  name HA   )(resid   19 and  name HN   ) 4.0 2.2 1.0
assign (resid   17 and  name HN   )(resid   19 and  name HN   ) 4.0 2.2 1.0
!L18
assign (resid   18 and  name HA   )(resid   21 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   18 and  name HA   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   18 and  name HN   )(resid   20 and  name HN   ) 4.0 2.2 1.0
!N19
assign (resid   19 and  name HA   )(resid   22 and  name HB#  ) 4.0 2.2 1.0
assign (resid   19 and  name HN   )(resid   21 and  name HN   ) 4.0 2.2 1.0
assign (resid   19 and  name HA   )(resid   22 and  name HG2# ) 4.0 3.7 2.5 !#
!S20
assign (resid   20 and  name HA   )(resid   23 and  name HB#  ) 3.0 2.2 1.3 !#
!L21
assign (resid   21 and  name HA   )(resid   24 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   21 and  name HA   )(resid   24 and  name HN   ) 4.0 2.2 1.0
assign (resid   21 and  name HA   )(resid   23 and  name HN   ) 4.0 2.2 1.0
assign (resid   21 and  name HN   )(resid   23 and  name HN   ) 4.0 2.2 1.0
!T22
assign (resid   22 and  name HA   )(resid   24 and  name HN   ) 4.0 2.2 1.0
!E23
assign (resid   23 and  name HA   )(resid   25 and  name HN   ) 4.0 2.2 1.0
!Q24
assign (resid   24 and  name HA   )(resid   27 and  name HB#  ) 4.0 3.2 2.0 !#
!K25
assign (resid   25 and  name HA   )(resid   28 and  name HB#  ) 4.0 3.2 2.0 !#
!T26
assign (resid   26 and  name HA   )(resid   29 and  name HN   ) 4.0 2.2 1.0
assign (resid   26 and  name HA   )(resid   28 and  name HN   ) 4.0 2.2 1.0
!L27
assign (resid   27 and  name HA   )(resid   30 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   27 and  name HN   )(resid   29 and  name HN   ) 4.0 2.2 1.0
!C28
assign (resid   28 and  name HA   )(resid   31 and  name HD1# ) 4.0 3.7 2.5 !#
assign (resid   28 and  name HA   )(resid   31 and  name HD2# ) 4.0 3.7 2.5 !#
assign (resid   28 and  name HA   )(resid   31 and  name HG   ) 4.0 2.2 1.0
assign (resid   28 and  name HB#  )(resid   31 and  name HD*  ) 4.0 5.6 4.4 ! !#
!T29
assign (resid   29 and  name HA   )(resid   31 and  name HN   ) 4.0 2.2 1.0
!E30
assign (resid   30 and  name HA   )(resid   32 and  name HG2# ) 4.0 3.7 2.5 !#
!T34
assign (resid   34 and  name HB   )(resid   36 and  name HG2# ) 3.0 2.7 1.8 !#
assign (resid   34 and  name HG2# )(resid   36 and  name HB   ) 3.0 2.7 1.8 !
assign (resid   34 and  name HG2# )(resid   36 and  name HD#  ) 3.0 4.2 3.3 ! !#
!I36
assign (resid   36 and  name HA   )(resid   38 and  name HN   ) 4.0 2.2 1.0
assign (resid   36 and  name HN   )(resid   38 and  name HN   ) 4.0 2.2 1.0
!F37
assign (resid   37 and  name HN   )(resid   39 and  name HN   ) 4.0 2.2 1.0
!T43
assign (resid   43 and  name HB   )(resid   47 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   43 and  name HG2# )(resid   47 and  name HB#  ) 3.0 3.7 2.8 ! !#
!T44
assign (resid   44 and  name HA   )(resid   48 and  name HN   ) 4.0 2.2 1.0
assign (resid   44 and  name HA   )(resid   47 and  name HN   ) 4.0 2.2 1.0
!E45
assign (resid   45 and  name HA   )(resid   48 and  name HB#  ) 3.0 1.2 0.3
assign (resid   45 and  name HB#  )(resid   49 and  name HE#  ) 3.0 4.2 3.3 ! !#
assign (resid   45 and  name HB#  )(resid   49 and  name HZ   ) 3.0 2.2 1.3 !
!K46
assign (resid   46 and  name HA   )(resid   49 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   46 and  name HA   )(resid   49 and  name HN   ) 4.0 2.2 1.0
assign (resid   46 and  name HA   )(resid   49 and  name HD#  ) 3.0 3.2 2.3 !#
!E47
assign (resid   47 and  name HA   )(resid   50 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   47 and  name HA   )(resid   50 and  name HN   ) 4.0 2.2 1.0
assign (resid   47 and  name HN   )(resid   49 and  name HN   ) 4.0 2.2 1.0
!T48
assign (resid   48 and  name HA   )(resid   51 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   48 and  name HA   )(resid   52 and  name HN   ) 4.0 2.2 1.0
assign (resid   48 and  name HA   )(resid   51 and  name HN   ) 4.0 2.2 1.0
assign (resid   48 and  name HN   )(resid   50 and  name HN   ) 4.0 2.2 1.0
assign (resid   48 and  name HG2# )(resid   52 and  name HB#  ) 3.0 4.2 3.3 ! !#
assign (resid   48 and  name HA   )(resid   51 and  name HD#  ) 4.0 3.2 2.0 !#
!F49
assign (resid   49 and  name HA   )(resid   52 and  name HB#  ) 3.0 2.7 1.8 !#
assign (resid   49 and  name HA   )(resid   52 and  name HN   ) 4.0 2.2 1.0
assign (resid   49 and  name HA   )(resid   51 and  name HN   ) 4.0 2.2 1.0
assign (resid   49 and  name HA   )(resid   52 and  name HB#  ) 3.0 2.7 1.8 !#
!C50
assign (resid   50 and  name HA   )(resid   53 and  name HB#  ) 4.0 3.7 2.5 !#
assign (resid   50 and  name HN   )(resid   52 and  name HN   ) 4.0 2.2 1.0
assign (resid   50 and  name HA   )(resid   52 and  name HB#  ) 4.0 3.7 2.5 !#
!R51
assign (resid   51 and  name HA   )(resid   54 and  name HB#  ) 3.0 1.2 0.3
assign (resid   51 and  name HA   )(resid   54 and  name HN   ) 4.0 2.2 1.0
assign (resid   51 and  name HA   )(resid   53 and  name HN   ) 4.0 2.2 1.0
assign (resid   51 and  name HN   )(resid   53 and  name HN   ) 4.0 2.2 1.0
!A52
assign (resid   52 and  name HA   )(resid   55 and  name HB#  ) 3.0 1.2 0.3
assign (resid   52 and  name HA   )(resid   56 and  name HN   ) 4.0 2.2 1.0
assign (resid   52 and  name HA   )(resid   55 and  name HN   ) 4.0 2.2 1.0
assign (resid   52 and  name HN   )(resid   54 and  name HN   ) 4.0 2.2 1.0
assign (resid   52 and  name HA   )(resid   55 and  name HG2# ) 4.0 3.7 2.5 !#
assign (resid   52 and  name HA   )(resid   55 and  name HG1# ) 4.0 3.7 2.5 !#
assign (resid   52 and  name HB#  )(resid   55 and  name HB   ) 3.0 2.7 1.8 !
assign (resid   52 and  name HB#  )(resid   56 and  name HD*  ) 3.0 5.1 4.2 ! !#
!A53
assign (resid   53 and  name HA   )(resid   56 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   53 and  name HA   )(resid   55 and  name HN   ) 4.0 2.2 1.0
assign (resid   53 and  name HA   )(resid   56 and  name HD1# ) 3.0 2.7 1.8 !#
assign (resid   53 and  name HA   )(resid   56 and  name HD2# ) 3.0 2.7 1.8 !#
!T54
assign (resid   54 and  name HA   )(resid   57 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   54 and  name HA   )(resid   57 and  name HD#  ) 4.0 3.2 2.0 !#
!V55
assign (resid   55 and  name HA   )(resid   58 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   55 and  name HA   )(resid   58 and  name HN   ) 4.0 2.2 1.0
assign (resid   55 and  name HA   )(resid   57 and  name HN   ) 4.0 2.2 1.0
!L56
assign (resid   56 and  name HA   )(resid   59 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   56 and  name HA   )(resid   59 and  name HN   ) 4.0 2.2 1.0
!Q58
assign (resid   58 and  name HA   )(resid   61 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   58 and  name HN   )(resid   60 and  name HN   ) 4.0 2.2 1.0
!F59
assign (resid   59 and  name HA   )(resid   62 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   59 and  name HA   )(resid   62 and  name HN   ) 4.0 2.2 1.0
assign (resid   59 and  name HN   )(resid   61 and  name HN   ) 4.0 2.2 1.0
assign (resid   59 and  name HA   )(resid   63 and  name HD2  ) 3.0 1.2 0.3
assign (resid   59 and  name HB#  )(resid   63 and  name HD2  ) 4.0 3.2 2.0 !
assign (resid   59 and  name HD#  )(resid   63 and  name HB#  ) 4.0 5.2 4.0 ! !#
!Y60
assign (resid   60 and  name HA   )(resid   63 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   60 and  name HA   )(resid   64 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HA   )(resid   63 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HA   )(resid   62 and  name HN   ) 4.0 2.2 1.0
assign (resid   60 and  name HN   )(resid   62 and  name HN   ) 4.0 2.2 1.0
!S61
assign (resid   61 and  name HA   )(resid   64 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   61 and  name HN   )(resid   63 and  name HN   ) 4.0 2.2 1.0
!H62
assign (resid   62 and  name HN   )(resid   64 and  name HN   ) 4.0 2.2 1.0
!H63
assign (resid   63 and  name HA   )(resid   66 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   63 and  name HA   )(resid   66 and  name HN   ) 4.0 2.2 1.0
!T67
assign (resid   67 and  name HA   )(resid   70 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   67 and  name HN   )(resid   69 and  name HN   ) 4.0 2.2 1.0
assign (resid   67 and  name HA   )(resid   70 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   67 and  name HA   )(resid   70 and  name HG   ) 3.0 1.2 0.3
assign (resid   67 and  name HA   )(resid   70 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   67 and  name HB   )(resid   70 and  name HD*  ) 4.0 4.6 3.4 !#
assign (resid   67 and  name HB   )(resid   70 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   67 and  name HG2# )(resid   70 and  name HD*  ) 4.0 6.1 4.9 ! !#
!R68
assign (resid   68 and  name HN   )(resid   70 and  name HN   ) 4.0 2.2 1.0
!G71
assign (resid   71 and  name HA#  )(resid   73 and  name HN   ) 4.0 3.2 2.0 !
assign (resid   71 and  name HA#  )(resid   76 and  name HB#  ) 4.0 4.2 3.0 ! !#
!T73
assign (resid   73 and  name HA   )(resid   75 and  name HN   ) 4.0 2.2 1.0
assign (resid   73 and  name HG2# )(resid   76 and  name HB#  ) 4.0 4.7 3.5 ! !#
assign (resid   73 and  name HG2# )(resid   76 and  name HG#  ) 4.0 4.7 3.5 ! !#
!A74
assign (resid   74 and  name HA   )(resid   77 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   74 and  name HB#  )(resid   77 and  name HB#  ) 4.0 4.7 3.5 ! !#
!Q75
assign (resid   75 and  name HA   )(resid   78 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   75 and  name HA   )(resid   77 and  name HN   ) 4.0 2.2 1.0
!Q76
assign (resid   76 and  name HA   )(resid   79 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   76 and  name HA   )(resid   79 and  name HN   ) 4.0 2.2 1.0
assign (resid   76 and  name HN   )(resid   78 and  name HN   ) 4.0 2.2 1.0
!F77
assign (resid   77 and  name HA   )(resid   80 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   77 and  name HA   )(resid   80 and  name HN   ) 4.0 2.2 1.0
assign (resid   77 and  name HA   )(resid   80 and  name HD2  ) 4.0 2.2 1.0
!H78
assign (resid   78 and  name HA   )(resid   81 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   78 and  name HA   )(resid   82 and  name HN   ) 4.0 2.2 1.0
assign (resid   78 and  name HE1  )(resid   82 and  name HG#  ) 4.0 3.2 2.0 !#
!R79
assign (resid   79 and  name HA   )(resid   82 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   79 and  name HA   )(resid   83 and  name HN   ) 4.0 2.2 1.0
assign (resid   79 and  name HA   )(resid   82 and  name HN   ) 4.0 2.2 1.0
!H80
assign (resid   80 and  name HA   )(resid   83 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   80 and  name HA   )(resid   84 and  name HN   ) 4.0 2.2 1.0
assign (resid   80 and  name HN   )(resid   82 and  name HN   ) 4.0 2.2 1.0
assign (resid   80 and  name HE1  )(resid   84 and  name HD#  ) 4.0 3.7 2.5 !#
assign (resid   80 and  name HE1  )(resid   83 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   80 and  name HA   )(resid   83 and  name HD*  ) 4.0 4.6 3.4 !#
!K81
assign (resid   81 and  name HA   )(resid   84 and  name HB#  ) 4.0 2.2 1.0
assign (resid   81 and  name HA   )(resid   84 and  name HN   ) 4.0 2.2 1.0
assign (resid   81 and  name HA   )(resid   83 and  name HN   ) 4.0 2.2 1.0
assign (resid   81 and  name HN   )(resid   83 and  name HN   ) 4.0 2.2 1.0
assign (resid   81 and  name HA   )(resid   84 and  name HG2# ) 4.0 3.7 2.5 !#
!Q82
assign (resid   82 and  name HA   )(resid   85 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   82 and  name HA   )(resid   84 and  name HN   ) 4.0 2.2 1.0
assign (resid   82 and  name HN   )(resid   84 and  name HN   ) 4.0 2.2 1.0
assign (resid   82 and  name HA   )(resid   85 and  name HG#  ) 4.0 3.2 2.0 !#
assign (resid   82 and  name HA   )(resid   85 and  name HD#  ) 3.0 2.2 1.3 !#
!L83
assign (resid   83 and  name HA   )(resid   86 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   83 and  name HA   )(resid   86 and  name HN   ) 4.0 2.2 1.0
assign (resid   83 and  name HA   )(resid   85 and  name HN   ) 4.0 2.2 1.0
assign (resid   83 and  name HN   )(resid   85 and  name HN   ) 4.0 2.2 1.0
assign (resid   83 and  name HA   )(resid   86 and  name HE#  ) 4.0 4.2 3.0 !#
assign (resid   83 and  name HA   )(resid   86 and  name HD#  ) 4.0 4.2 3.0 !#
!I84
assign (resid   84 and  name HA   )(resid   87 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   84 and  name HA   )(resid   88 and  name HN   ) 4.0 2.2 1.0
assign (resid   84 and  name HA   )(resid   87 and  name HN   ) 4.0 2.2 1.0
assign (resid   84 and  name HN   )(resid   86 and  name HN   ) 4.0 2.2 1.0
assign (resid   84 and  name HA   )(resid   87 and  name HD*  ) 3.0 3.6 2.7 !#
!R85
assign (resid   85 and  name HA   )(resid   88 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   85 and  name HN   )(resid   87 and  name HN   ) 4.0 2.2 1.0
!F86
assign (resid   86 and  name HA   )(resid   89 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   86 and  name HA   )(resid   90 and  name HN   ) 4.0 2.2 1.0
assign (resid   86 and  name HA   )(resid   89 and  name HN   ) 4.0 2.2 1.0
assign (resid   86 and  name HA   )(resid   88 and  name HN   ) 4.0 2.2 1.0
!L87
assign (resid   87 and  name HA   )(resid   90 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   87 and  name HN   )(resid   89 and  name HN   ) 4.0 2.2 1.0
assign (resid   87 and  name HA   )(resid   90 and  name HD*  ) 3.0 3.6 2.7 !#
!K88
assign (resid   88 and  name HA   )(resid   91 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   88 and  name HA   )(resid   92 and  name HN   ) 4.0 2.2 1.0
assign (resid   88 and  name HA   )(resid   91 and  name HN   ) 4.0 2.2 1.0
assign (resid   88 and  name HN   )(resid   90 and  name HN   ) 4.0 2.2 1.0
!R89
assign (resid   89 and  name HA   )(resid   92 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   89 and  name HA   )(resid   92 and  name HN   ) 4.0 2.2 1.0
assign (resid   89 and  name HN   )(resid   91 and  name HN   ) 4.0 2.2 1.0
!L90
assign (resid   90 and  name HA   )(resid   93 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   90 and  name HA   )(resid   93 and  name HN   ) 4.0 2.2 1.0
!D91
assign (resid   91 and  name HA   )(resid   94 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   91 and  name HA   )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HA   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   91 and  name HA   )(resid   94 and  name HD*  ) 4.0 4.6 3.4 !#
!R92
assign (resid   92 and  name HA   )(resid   95 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   92 and  name HA   )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   92 and  name HA   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   92 and  name HN   )(resid   94 and  name HN   ) 4.0 2.2 1.0
assign (resid   92 and  name HD#  )(resid   95 and  name HZ2  ) 4.0 3.2 2.0 !
!N93
assign (resid   93 and  name HA   )(resid   97 and  name HN   ) 4.0 2.2 1.0
assign (resid   93 and  name HA   )(resid   96 and  name HN   ) 4.0 2.2 1.0
assign (resid   93 and  name HA   )(resid   95 and  name HN   ) 4.0 2.2 1.0
assign (resid   93 and  name HN   )(resid   95 and  name HN   ) 4.0 2.2 1.0
!L94
assign (resid   94 and  name HA   )(resid   97 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   94 and  name HA   )(resid   97 and  name HN   ) 4.0 2.2 1.0
assign (resid   94 and  name HA   )(resid   97 and  name HD*  ) 4.0 4.6 3.4 !#
!W95
assign (resid   95 and  name HA   )(resid   98 and  name HB#  ) 4.0 3.7 2.5 !#
assign (resid   95 and  name HN   )(resid   97 and  name HN   ) 4.0 2.2 1.0
assign (resid   95 and  name HH2  )(resid   99 and  name HA#  ) 4.0 3.2 3.0 !#
assign (resid   95 and  name HE3  )(resid   98 and  name HB#  ) 4.0 3.7 2.5 !#
assign (resid   95 and  name HD1  )(resid   98 and  name HB#  ) 4.0 3.7 2.5 !#
!A98
assign (resid   98 and  name HB#  )(resid  100 and  name HD*  ) 2.5 4.6 4.1 ! !#
!L100
assign (resid  100 and  name HB#  )(resid  103 and  name HB#  ) 4.0 4.2 3.0 ! !#
assign (resid  100 and  name HD*  )(resid  103 and  name HB#  ) 4.0 5.6 4.4 ! !#
!C103
assign (resid  103 and  name HN   )(resid  105 and  name HN   ) 4.0 2.2 1.0
!E107
assign (resid  107 and  name HA   )(resid  109 and  name HN   ) 4.0 2.2 2.0
!D109
assign (resid  109 and  name HN   )(resid  111 and  name HN   ) 4.0 2.2 1.0
!Q110
assign (resid  110 and  name HB#  )(resid  112 and  name HG2# ) 4.0 4.7 3.5 ! !#
assign (resid  110 and  name HG#  )(resid  112 and  name HG2# ) 4.0 4.7 3.5 ! !#
!T112
assign (resid  112 and  name HB   )(resid  114 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  112 and  name HB   )(resid  114 and  name HG#  ) 4.0 3.2 2.0 !#
!L113
assign (resid  113 and  name HA   )(resid  116 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  113 and  name HG#  )(resid  117 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid  113 and  name HD*  )(resid  117 and  name HG   ) 3.0 3.6 2.7 !
assign (resid  113 and  name HD*  )(resid  116 and  name HB#  ) 4.0 5.6 4.4 ! !#
assign (resid  113 and  name HA   )(resid  116 and  name HD#  ) 4.0 4.2 3.0 !#
assign (resid  113 and  name HD*  )(resid  116 and  name HD#  ) 3.0 5.6 4.7 ! !#
assign (resid  113 and  name HD*  )(resid  116 and  name HE#  ) 3.0 5.6 4.7 ! !#
assign (resid  113 and  name HA   )(resid  116 and  name HD#  ) 2.5 2.7 2.2 !#
!E114
assign (resid  114 and  name HA   )(resid  117 and  name HB#  ) 4.0 3.2 2.0 !#
!N115
assign (resid  115 and  name HA   )(resid  118 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  115 and  name HA   )(resid  117 and  name HN   ) 4.0 2.2 1.0
assign (resid  115 and  name HN   )(resid  117 and  name HN   ) 4.0 2.2 1.0
assign (resid  115 and  name HA   )(resid  118 and  name HG#  ) 3.0 2.2 1.3 !#
!F116
assign (resid  116 and  name HA   )(resid  119 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  116 and  name HA   )(resid  120 and  name HN   ) 4.0 2.2 1.0
assign (resid  116 and  name HA   )(resid  119 and  name HN   ) 4.0 2.2 1.0
assign (resid  116 and  name HN   )(resid  118 and  name HN   ) 4.0 2.2 1.0
assign (resid  116 and  name HA   )(resid  119 and  name HG#  ) 3.0 2.2 1.3 !#
!L117
assign (resid  117 and  name HA   )(resid  120 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  117 and  name HA   )(resid  121 and  name HN   ) 4.0 2.2 1.0
assign (resid  117 and  name HN   )(resid  119 and  name HN   ) 4.0 2.2 1.0
assign (resid  117 and  name HA   )(resid  120 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid  117 and  name HB#  )(resid  120 and  name HD*  ) 4.0 5.6 4.4 ! !#
!E118
assign (resid  118 and  name HA   )(resid  122 and  name HN   ) 4.0 2.2 1.0
assign (resid  118 and  name HA   )(resid  121 and  name HN   ) 4.0 2.2 1.0
assign (resid  118 and  name HA   )(resid  120 and  name HN   ) 4.0 2.2 1.0
assign (resid  118 and  name HG#  )(resid  122 and  name HG2# ) 3.0 3.7 2.8 ! !#
!R119
assign (resid  119 and  name HA   )(resid  122 and  name HB#  ) 3.0 1.2 0.3
assign (resid  119 and  name HN   )(resid  121 and  name HN   ) 4.0 2.2 1.0
!L120
assign (resid  120 and  name HA   )(resid  123 and  name HB#  ) 3.0 1.2 0.3
assign (resid  120 and  name HA   )(resid  122 and  name HN   ) 4.4 2.6 1.0
assign (resid  120 and  name HN   )(resid  122 and  name HN   ) 4.0 2.2 1.0
!K121
assign (resid  121 and  name HA   )(resid  124 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  121 and  name HA   )(resid  125 and  name HN   ) 4.0 2.2 1.0
assign (resid  121 and  name HA   )(resid  124 and  name HN   ) 4.0 2.2 1.0
assign (resid  121 and  name HN   )(resid  123 and  name HN   ) 4.0 2.2 1.0
!T122
assign (resid  122 and  name HA   )(resid  125 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid  122 and  name HA   )(resid  126 and  name HN   ) 4.0 2.2 1.0
assign (resid  122 and  name HA   )(resid  125 and  name HN   ) 4.0 2.2 1.0
assign (resid  122 and  name HA   )(resid  124 and  name HN   ) 4.0 2.2 1.0
assign (resid  122 and  name HN   )(resid  124 and  name HN   ) 4.0 2.2 1.0
!I123
assign (resid  123 and  name HA   )(resid  126 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid  123 and  name HA   )(resid  126 and  name HN   ) 4.0 2.2 1.0
assign (resid  123 and  name HN   )(resid  125 and  name HN   ) 4.0 2.2 1.0
!M124
assign (resid  124 and  name HA   )(resid  127 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  124 and  name HA   )(resid  128 and  name HN   ) 4.0 2.2 1.0
assign (resid  124 and  name HA   )(resid  127 and  name HN   ) 4.0 2.2 1.0
assign (resid  124 and  name HN   )(resid  126 and  name HN   ) 4.0 2.2 1.0
assign (resid  124 and  name HA   )(resid  128 and  name HD#  ) 3.0 3.2 2.3 !#
assign (resid  124 and  name HE#  )(resid  128 and  name HD#  ) 3.0 4.7 3.8 ! !#
assign (resid  124 and  name HB#  )(resid  128 and  name HD#  ) 3.0 4.2 3.3 ! !#
assign (resid  124 and  name HA   )(resid  128 and  name HE#  ) 4.0 4.2 3.0 !#
assign (resid  124 and  name HE#  )(resid  128 and  name HE#  ) 4.0 5.7 4.5 ! !#
assign (resid  124 and  name HB#  )(resid  128 and  name HE#  ) 4.0 5.2 4.0 ! !#
!R125
assign (resid  125 and  name HA   )(resid  128 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid  125 and  name HA   )(resid  128 and  name HN   ) 4.0 2.2 1.0
assign (resid  125 and  name HA   )(resid  127 and  name HN   ) 4.0 2.2 1.0
!K127
assign (resid  127 and  name HA   )(resid  130 and  name HB#  ) 4.0 3.2 2.0 !#
!S129
assign (resid  129 and  name HN   )(resid  131 and  name HN   ) 4.0 2.2 1.0





!!Long range NOEs |i-j > 5
!T10
assign (resid   10 and  name HG2# )(resid   97 and  name HD*  ) 3.0 5.1 4.2 ! !#
assign (resid   10 and  name HB   )(resid   97 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   10 and  name HA   )(resid   97 and  name HD*  ) 4.0 4.6 2.7 !#
assign (resid   10 and  name HG2# )(resid   93 and  name HA   ) 3.0 2.7 1.8 !
assign (resid   10 and  name HG2# )(resid   93 and  name HB#  ) 3.0 3.7 2.8 ! !#
!L11
assign (resid   11 and  name HD*  )(resid   46 and  name HB#  ) 4.0 5.6 4.4 ! !#
assign (resid   11 and  name HD*  )(resid  124 and  name HE#  ) 3.0 5.1 4.2 ! !#
assign (resid   11 and  name HG   )(resid  128 and  name HD#  ) 3.0 3.2 2.3 !#
assign (resid   11 and  name HB#  )(resid  128 and  name HD#  ) 3.0 4.2 3.3 ! !#
assign (resid   11 and  name HD*  )(resid  128 and  name HD#  ) 3.0 5.6 4.7 ! !#
assign (resid   11 and  name HD*  )(resid  128 and  name HA   ) 4.0 4.6 3.4 !
assign (resid   11 and  name HD*  )(resid  128 and  name HB#  ) 3.0 4.6 3.7 ! !#
assign (resid   11 and  name HD*  )(resid  128 and  name HE#  ) 4.0 6.6 5.4 ! !#
!I14
assign (resid   14 and  name HA   )(resid   90 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   14 and  name HG11 )(resid   90 and  name HA   ) 4.0 3.2 2.0 !
assign (resid   14 and  name HG11 )(resid   93 and  name HB#  ) 4.0 4.2 3.0 ! !#
assign (resid   14 and  name HG12 )(resid   93 and  name HB#  ) 4.0 4.2 3.0 ! !#
assign (resid   14 and  name HD#  )(resid   93 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   14 and  name HD#  )(resid   97 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   14 and  name HG2# )(resid  124 and  name HE#  ) 3.0 4.2 3.3 ! !#
assign (resid   14 and  name HG2# )(resid  124 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   14 and  name HG2# )(resid  124 and  name HG#  ) 3.0 3.7 2.8 ! !#
!I15
assign (resid   15 and  name HG1# )(resid  124 and  name HA   ) 3.0 2.2 1.3 !
assign (resid   15 and  name HD#  )(resid  124 and  name HB#  ) 4.0 4.7 3.5 ! !#
assign (resid   15 and  name HG2# )(resid  124 and  name HB#  ) 4.0 4.7 3.5 ! !#
assign (resid   15 and  name HG1# )(resid  124 and  name HG#  ) 3.0 3.2 2.3 ! !#
assign (resid   15 and  name HG1# )(resid  124 and  name HE#  ) 3.0 3.7 2.8 ! !#
assign (resid   15 and  name HD#  )(resid  124 and  name HE#  ) 3.0 4.2 3.3 ! !#
assign (resid   15 and  name HD#  )(resid  128 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   15 and  name HD#  )(resid  128 and  name HD#  ) 3.0 4.7 3.8 ! !#
assign (resid   15 and  name HG1# )(resid  128 and  name HD#  ) 4.0 5.2 4.0 ! !#
assign (resid   15 and  name HG2# )(resid  128 and  name HD#  ) 3.0 4.7 3.8 ! !#
assign (resid   15 and  name HG1# )(resid  128 and  name HE#  ) 4.0 5.2 4.0 ! !#
assign (resid   15 and  name HG2# )(resid  128 and  name HE#  ) 4.0 5.7 4.5 ! !#
!T17
assign (resid   17 and  name HA   )(resid   86 and  name HD#  ) 3.0 3.2 2.3 !#
assign (resid   17 and  name HA   )(resid   86 and  name HE#  ) 3.0 3.2 2.3 !#
assign (resid   17 and  name HG2# )(resid   89 and  name HE   ) 3.0 3.7 2.8 ! !#
assign (resid   17 and  name HG2# )(resid   89 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   17 and  name HG2# )(resid   89 and  name HG1# ) 3.0 3.7 2.8 ! !#
assign (resid   17 and  name HG2# )(resid   86 and  name HA   ) 3.0 2.7 1.8 !
assign (resid   17 and  name HG2# )(resid   86 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   17 and  name HG2# )(resid   90 and  name HA   ) 4.0 3.7 2.5 !
assign (resid   17 and  name HB   )(resid   90 and  name HD*  ) 2.5 3.1 2.6 !#
!L18
assign (resid   18 and  name HA   )(resid   86 and  name HE#  ) 4.0 4.2 4.0 !#
assign (resid   18 and  name HD*  )(resid  120 and  name HA   ) 3.0 3.6 2.7 !
assign (resid   18 and  name HD*  )(resid  120 and  name HG   ) 3.0 3.6 2.7 !
assign (resid   18 and  name HD*  )(resid  120 and  name HD*  ) 3.0 6.0 5.1 ! !#
assign (resid   18 and  name HD*  )(resid  124 and  name HA   ) 4.0 4.6 3.4 !
assign (resid   18 and  name HD*  )(resid  124 and  name HB#  ) 4.0 5.6 4.4 ! !#
assign (resid   18 and  name HD*  )(resid  124 and  name HG#  ) 3.0 4.6 3.7 ! !#
assign (resid   18 and  name HG   )(resid  124 and  name HG#  ) 3.0 2.2 1.3 !#
assign (resid   18 and  name HA   )(resid  124 and  name HE#  ) 3.0 2.7 1.8 !#
assign (resid   18 and  name HD*  )(resid  124 and  name HE#  ) 3.0 5.1 4.2 ! !#
assign (resid   18 and  name HD*  )(resid  121 and  name HA   ) 3.0 3.6 2.7 !
!L21
assign (resid   21 and  name HB#  )(resid   59 and  name HD*  ) 4.0 5.2 4.0 ! !#
assign (resid   21 and  name HA   )(resid   83 and  name HD*  ) 4.0 4.6 3.4 !#
assign (resid   21 and  name HD*  )(resid   86 and  name HD#  ) 4.0 6.6 5.4 ! !#
assign (resid   21 and  name HD*  )(resid   86 and  name HA   ) 4.0 4.6 3.4 !
assign (resid   21 and  name HD1# )(resid   86 and  name HB#  ) 4.0 4.7 3.5 ! !#
assign (resid   21 and  name HD2# )(resid   86 and  name HB#  ) 4.0 4.7 3.5 ! !#
!L27
assign (resid   27 and  name HD*  )(resid   71 and  name HA#  ) 4.0 5.6 5.4 ! !#
!C28
assign (resid   28 and  name HB#  )(resid   80 and  name HE1  ) 4.0 3.2 2.0 !
assign (resid   28 and  name HB#  )(resid   83 and  name HD*  ) 3.0 4.6 3.7 ! !#
!T29
assign (resid   29 and  name HA   )(resid  113 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   29 and  name HA   )(resid  113 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   29 and  name HB   )(resid  114 and  name HA   ) 3.0 1.2 0.3
assign (resid   29 and  name HB   )(resid  114 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   29 and  name HB   )(resid  114 and  name HG#  ) 3.0 2.2 1.3 !#
assign (resid   29 and  name HB   )(resid  113 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   29 and  name HB   )(resid  113 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   29 and  name HG2# )(resid  113 and  name HD*  ) 3.0 5.1 4.2 ! !#
assign (resid   29 and  name HG2# )(resid   83 and  name HD1# ) 4.0 5.2 4.0 ! !#
assign (resid   29 and  name HG2# )(resid   83 and  name HD2# ) 4.0 5.2 4.0 ! !#
!L31
assign (resid   31 and  name HD*  )(resid   63 and  name HD2  ) 4.0 4.6 3.4 !
assign (resid   31 and  name HD1# )(resid   63 and  name HE1  ) 4.0 3.7 2.5 !
assign (resid   31 and  name HD2# )(resid   63 and  name HE1  ) 4.0 3.7 2.5 !
!T32
assign (resid   32 and  name HA   )(resid  112 and  name HB   ) 4.0 2.2 1.0
assign (resid   32 and  name HA   )(resid  112 and  name HA   ) 2.5 0.7 0.2
assign (resid   32 and  name HA   )(resid  112 and  name HG2# ) 3.0 2.7 1.8 !#
assign (resid   32 and  name HA   )(resid  110 and  name HG#  ) 4.0 3.2 2.0 !#
assign (resid   32 and  name HB   )(resid  110 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   32 and  name HB   )(resid  110 and  name HG#  ) 3.0 2.2 1.3 !#
assign (resid   32 and  name HG2# )(resid  112 and  name HB   ) 3.0 2.7 1.8 !
assign (resid   32 and  name HG2# )(resid  112 and  name HA   ) 3.0 2.7 1.8 !
assign (resid   32 and  name HG2# )(resid  110 and  name HG#  ) 3.0 3.7 2.8 ! !#
assign (resid   32 and  name HG2# )(resid  110 and  name HB#  ) 3.0 3.7 2.8 ! !#
!V33
assign (resid   33 and  name HN   )(resid  112 and  name HA   ) 3.3 0.8 0.2
assign (resid   33 and  name HN   )(resid  111 and  name HN   ) 3.3 0.8 0.2
assign (resid   33 and  name HG1# )(resid  113 and  name HA   ) 3.0 2.7 1.8 !
assign (resid   33 and  name HG2# )(resid  113 and  name HA   ) 3.0 2.7 1.8 !
assign (resid   33 and  name HG*  )(resid  111 and  name HB#  ) 4.0 5.6 4.4 ! !#
assign (resid   33 and  name HG*  )(resid  116 and  name HB#  ) 3.0 4.6 3.7 ! !#
assign (resid   33 and  name HA   )(resid   55 and  name HG*  ) 3.0 3.6 2.7 !#
assign (resid   33 and  name HB   )(resid   55 and  name HG*  ) 2.5 3.1 2.6 !#
assign (resid   33 and  name HG*  )(resid   55 and  name HG1# ) 3.0 5.1 4.2 ! !#
assign (resid   33 and  name HG*  )(resid   55 and  name HG2# ) 3.0 5.1 4.2 ! !#
assign (resid   33 and  name HG*  )(resid   59 and  name HB#  ) 4.0 5.6 4.4 ! !#
assign (resid   33 and  name HG*  )(resid  116 and  name HD#  ) 3.0 5.6 4.7 ! !#
!T34
assign (resid   34 and  name HA   )(resid  111 and  name HN   ) 3.3 0.8 0.2
assign (resid   34 and  name HA   )(resid  110 and  name HA   ) 3.0 1.2 0.3
assign (resid   34 and  name HA   )(resid  110 and  name HG#  ) 4.0 3.2 2.0 !#
assign (resid   34 and  name HA   )(resid  110 and  name HB#  ) 4.0 3.2 2.0 !#
!D35
assign (resid   35 and  name HA   )(resid  116 and  name HD#  ) 3.0 3.2 2.3 !#
assign (resid   35 and  name HA   )(resid  111 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   35 and  name HB1  )(resid  111 and  name HB#  ) 3.0 2.2 1.3 !#
assign (resid   35 and  name HB2  )(resid  111 and  name HB#  ) 3.0 2.2 1.3 !#
!I36
assign (resid   36 and  name HA   )(resid  107 and  name HG#  ) 4.0 3.2 2.0 !#
assign (resid   36 and  name HA   )(resid  108 and  name HB#  ) 3.0 2.7 1.8 !#
assign (resid   36 and  name HD#  )(resid   48 and  name HA   ) 3.0 2.7 1.8 !
assign (resid   36 and  name HG1# )(resid   48 and  name HG2# ) 3.0 3.7 2.8 ! !#
assign (resid   36 and  name HD#  )(resid   48 and  name HG2# ) 3.0 4.2 3.3 ! !#
assign (resid   36 and  name HG2# )(resid   51 and  name HB#  ) 4.0 4.7 3.5 ! !#
assign (resid   36 and  name HG2# )(resid   52 and  name HA   ) 4.0 3.7 2.5 !
assign (resid   36 and  name HG2# )(resid   52 and  name HB#  ) 3.0 4.2 3.3 ! !#
assign (resid   36 and  name HG1# )(resid   52 and  name HA   ) 4.0 3.2 2.0 !
assign (resid   36 and  name HD#  )(resid   52 and  name HA#  ) 3.0 2.7 1.8 !
assign (resid   36 and  name HD#  )(resid   52 and  name HB#  ) 3.0 4.2 3.3 ! !#
assign (resid   36 and  name HG1# )(resid   52 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   36 and  name HG1# )(resid   37 and  name HA   ) 4.0 3.2 2.0 !
!F37
assign (resid   37 and  name HZ   )(resid  123 and  name HD#  ) 4.0 3.7 2.5 !#
assign (resid   37 and  name HZ   )(resid  123 and  name HG1# ) 3.0 2.2 1.3 !#
assign (resid   37 and  name HZ   )(resid  123 and  name HG2# ) 4.0 3.7 2.5 !#
assign (resid   37 and  name HZ   )(resid   48 and  name HG2# ) 4.0 3.7 2.5 !#
assign (resid   37 and  name HZ   )(resid  120 and  name HA   ) 4.0 2.2 1.0
assign (resid   37 and  name HZ   )(resid  120 and  name HG   ) 4.0 2.2 1.0
assign (resid   37 and  name HZ   )(resid  120 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   37 and  name HZ   )(resid  120 and  name HD*  ) 4.0 4.6 3.4 !#
assign (resid   37 and  name HZ   )(resid  123 and  name HD#  ) 4.0 3.7 2.5 !#
assign (resid   37 and  name HE#  )(resid  123 and  name HD#  ) 4.0 5.7 4.5 ! !#
assign (resid   37 and  name HE#  )(resid  116 and  name HA   ) 3.0 3.2 2.3 !
assign (resid   37 and  name HE#  )(resid  120 and  name HA   ) 3.0 3.2 2.3 !
assign (resid   37 and  name HE#  )(resid  123 and  name HG1# ) 4.0 5.2 4.0 ! !#
assign (resid   37 and  name HE#  )(resid  123 and  name HG2# ) 4.0 5.7 4.5 ! !#
assign (resid   37 and  name HE#  )(resid   48 and  name HB   ) 4.0 4.2 3.0 !
assign (resid   37 and  name HE#  )(resid   48 and  name HG2# ) 3.0 4.7 3.8 ! !#
assign (resid   37 and  name HE#  )(resid  120 and  name HB#  ) 4.0 5.2 4.0 ! !#
assign (resid   37 and  name HD#  )(resid  116 and  name HA   ) 4.0 4.2 3.0 !
assign (resid   37 and  name HD#  )(resid  123 and  name HG1# ) 3.0 4.2 3.3 ! !#
assign (resid   37 and  name HD#  )(resid   48 and  name HG2# ) 4.0 5.7 4.5 ! !#
assign (resid   37 and  name HD#  )(resid  120 and  name HB#  ) 4.0 5.2 4.0 ! !#
assign (resid   37 and  name HD#  )(resid  120 and  name HG   ) 4.0 4.2 3.0 !
assign (resid   37 and  name HD#  )(resid  120 and  name HD*  ) 4.0 6.6 5.4 ! !#
!T43
assign (resid   43 and  name HG2# )(resid   51 and  name HD#  ) 3.0 3.7 2.8 ! !#
!E45
assign (resid   45 and  name HG#  )(resid   98 and  name HA   ) 4.0 3.2 2.0 !
!K46
assign (resid   46 and  name HA   )(resid   98 and  name HA   ) 4.0 2.2 1.0
assign (resid   46 and  name HG#  )(resid   98 and  name HA   ) 4.0 3.2 2.0 !
!F49
assign (resid   49 and  name HD#  )(resid   95 and  name HA   ) 3.0 3.2 2.3 !
assign (resid   49 and  name HD#  )(resid   94 and  name HD*  ) 4.0 6.6 5.4 ! !#
assign (resid   49 and  name HD#  )(resid  124 and  name HE#  ) 3.0 4.7 3.8 ! !#
assign (resid   49 and  name HD#  )(resid   97 and  name HD*  ) 3.0 5.6 4.7 ! !#
assign (resid   49 and  name HA   )(resid   94 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   49 and  name HD#  )(resid   94 and  name HG   ) 3.0 3.2 2.3 !
assign (resid   49 and  name HB#  )(resid   98 and  name HB#  ) 3.0 3.7 2.8 ! !#
assign (resid   49 and  name HB#  )(resid   94 and  name HD*  ) 4.0 5.6 4.4 ! !#
assign (resid   49 and  name HZ   )(resid  124 and  name HE#  ) 4.0 3.7 2.5 !#
assign (resid   49 and  name HE#  )(resid  124 and  name HE#  ) 3.0 4.7 3.8 ! !#
!C50
assign (resid   50 and  name HA   )(resid   95 and  name HE3  ) 4.0 2.2 1.0
assign (resid   50 and  name HA   )(resid   95 and  name HD1  ) 4.0 2.2 1.0
assign (resid   50 and  name HB#  )(resid   98 and  name HB#  ) 3.0 3.7 2.8 ! !#
!R51
assign (resid   51 and  name HA   )(resid  105 and  name HG*  ) 3.0 3.6 2.7 !#
assign (resid   51 and  name HB#  )(resid  105 and  name HG*  ) 4.0 5.6 4.4 ! !#
assign (resid   51 and  name HG#  )(resid  105 and  name HG*  ) 4.0 5.6 4.4 ! !#
!A52
assign (resid   52 and  name HA   )(resid  116 and  name HD#  ) 4.0 4.2 3.0 !#
assign (resid   52 and  name HB#  )(resid  116 and  name HD#  ) 3.0 4.7 3.8 ! !#
assign (resid   52 and  name HA   )(resid  116 and  name HZ   ) 4.0 2.2 1.0
assign (resid   52 and  name HB#  )(resid  116 and  name HZ   ) 3.0 2.7 1.8 !
!A53
assign (resid   53 and  name HA   )(resid   91 and  name HA   ) 4.0 2.2 1.0
assign (resid   53 and  name HB#  )(resid   91 and  name HA   ) 4.0 3.7 2.5 !
assign (resid   53 and  name HB#  )(resid   95 and  name HB#  ) 4.0 4.7 3.5 ! !#
assign (resid   53 and  name HB#  )(resid   95 and  name HE3  ) 4.0 3.7 2.5 !
!T54
assign (resid   54 and  name HB   )(resid  105 and  name HG1# ) 4.0 3.7 2.5 !#
assign (resid   54 and  name HB   )(resid  105 and  name HG2# ) 4.0 3.7 2.5 !#
assign (resid   54 and  name HB   )(resid  105 and  name HB   ) 4.0 2.2 1.0
assign (resid   54 and  name HG2# )(resid  105 and  name HG1# ) 3.0 4.2 3.3 ! !#
assign (resid   54 and  name HG2# )(resid  105 and  name HG2# ) 3.0 4.2 3.3 ! !#
assign (resid   54 and  name HG2# )(resid  105 and  name HB   ) 3.0 2.7 1.8 !
!V55
assign (resid   55 and  name HB#  )(resid  116 and  name HD#  ) 4.0 4.2 3.0 !#
assign (resid   55 and  name HG*  )(resid  116 and  name HD#  ) 3.0 5.6 4.7 ! !#
assign (resid   55 and  name HA   )(resid  105 and  name HG*  ) 4.0 4.6 3.4 !#
assign (resid   55 and  name HG*  )(resid  105 and  name HB   ) 3.0 3.6 2.7 !
!L56
assign (resid   56 and  name HD*  )(resid  116 and  name HZ   ) 2.5 3.1 2.6 !
assign (resid   56 and  name HD*  )(resid  116 and  name HD#  ) 4.0 6.6 5.4 ! !#
assign (resid   56 and  name HD*  )(resid  113 and  name HD1# ) 4.0 6.1 4.9 ! !#
assign (resid   56 and  name HD*  )(resid  113 and  name HD2# ) 4.0 6.1 4.9 ! !#
assign (resid   56 and  name HD*  )(resid   91 and  name HA   ) 4.0 4.6 3.4 !
assign (resid   56 and  name HD*  )(resid   90 and  name HG   ) 3.0 3.6 2.7 !
assign (resid   56 and  name HD*  )(resid   90 and  name HB#  ) 3.0 4.6 3.7 ! !#
!F59
assign (resid   59 and  name HD#  )(resid   87 and  name HD*  ) 3.0 5.6 4.7 ! !#
assign (resid   59 and  name HD#  )(resid  113 and  name HD1# ) 3.0 4.7 3.8 ! !#
assign (resid   59 and  name HD#  )(resid  113 and  name HD2# ) 3.0 4.7 3.7 ! !#
assign (resid   59 and  name HD#  )(resid   87 and  name HB#  ) 4.0 5.2 4.0 ! !#
!Y60
assign (resid   60 and  name HD#  )(resid   88 and  name HA   ) 3.0 3.2 2.3 !
assign (resid   60 and  name HD#  )(resid   88 and  name HE#  ) 3.0 4.2 3.3 ! !#
assign (resid   60 and  name HD#  )(resid   88 and  name HB#  ) 3.0 4.2 3.3 ! !#
assign (resid   60 and  name HD#  )(resid   91 and  name HB#  ) 4.0 5.2 4.0 ! !#
assign (resid   60 and  name HE#  )(resid   91 and  name HB#  ) 3.0 4.2 3.3 ! !#
assign (resid   60 and  name HE#  )(resid   88 and  name HE#  ) 4.0 5.2 4.0 ! !#
assign (resid   60 and  name HE#  )(resid   88 and  name HA   ) 3.0 3.2 2.3 !
assign (resid   60 and  name HE#  )(resid   91 and  name HB#  ) 3.0 4.2 3.3 ! !#
assign (resid   60 and  name HD#  )(resid   87 and  name HB#  ) 3.0 4.2 3.3 ! !#
assign (resid   60 and  name HD#  )(resid   84 and  name HG2# ) 3.0 4.7 3.8 ! !#
assign (resid   60 and  name HD#  )(resid   87 and  name HD*  ) 4.0 6.6 5.4 ! !#
assign (resid   60 and  name HA   )(resid   87 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   60 and  name HA   )(resid   87 and  name HD*  ) 3.0 3.6 2.7 !#
assign (resid   60 and  name HA   )(resid   84 and  name HG2# ) 4.0 3.7 2.5 !#
assign (resid   60 and  name HA   )(resid   84 and  name HD#  ) 3.0 2.7 1.8 !#
assign (resid   60 and  name HB#  )(resid   87 and  name HD*  ) 3.0 4.6 3.7 ! !#
assign (resid   60 and  name HB#  )(resid   84 and  name HG2# ) 4.0 4.7 3.5 ! !#
assign (resid   60 and  name HB#  )(resid   84 and  name HD#  ) 4.0 4.7 3.5 ! !#
!E64
assign (resid   64 and  name HB#  )(resid   80 and  name HE1  ) 4.0 3.2 2.0 !
assign (resid   64 and  name HG#  )(resid   80 and  name HE1  ) 4.0 3.2 2.0 !
assign (resid   64 and  name HA   )(resid   84 and  name HG1# ) 3.0 2.2 1.3 !#
assign (resid   64 and  name HA   )(resid   84 and  name HG2# ) 3.0 2.7 1.8 !#
assign (resid   64 and  name HA   )(resid   84 and  name HD#  ) 3.0 2.7 1.8 !#
assign (resid   64 and  name HB1  )(resid   84 and  name HG1# ) 4.0 3.2 2.0 !#
assign (resid   64 and  name HB1  )(resid   84 and  name HG2# ) 3.0 2.7 1.8 !#
assign (resid   64 and  name HB2  )(resid   84 and  name HG1# ) 4.0 3.2 2.0 !#
assign (resid   64 and  name HB2  )(resid   84 and  name HG2# ) 3.0 2.7 1.8 !#
assign (resid   64 and  name HB#  )(resid   83 and  name HD#  ) 4.0 5.6 4.4 ! !#
assign (resid   64 and  name HG#  )(resid   84 and  name HG1# ) 3.0 3.2 2.3 ! !#
assign (resid   64 and  name HG#  )(resid   84 and  name HG2# ) 3.0 3.7 2.8 ! !#
!C69
assign (resid   69 and  name HB#  )(resid   80 and  name HE1  ) 3.0 2.2 1.3 !
!L70
assign (resid   70 and  name HA   )(resid   77 and  name HA   ) 4.0 2.2 1.0
assign (resid   70 and  name HA   )(resid   80 and  name HB#  ) 4.0 3.2 2.0 !#
assign (resid   70 and  name HD*  )(resid   77 and  name HA   ) 3.0 3.6 2.7 !
assign (resid   70 and  name HD*  )(resid   80 and  name HB#  ) 3.0 4.6 3.7 ! !#
assign (resid   70 and  name HD#  )(resid   80 and  name HD2  ) 3.0 3.6 2.7 !
assign (resid   70 and  name HA   )(resid   80 and  name HD2  ) 4.0 2.2 1.0
!L94
assign (resid   94 and  name HD*  )(resid  124 and  name HE*  ) 4.0 6.1 4.9 ! !#
!W95
assign (resid   95 and  name HZ2  )(resid  101 and  name HA   ) 4.0 2.2 1.0
assign (resid   95 and  name HH2  )(resid  101 and  name HA   ) 4.0 2.2 1.0


!!h-bond restraints

!I9

assign (resid 9 and name o)  (resid 13 and name hn) 1.8 0.3 0.5
assign (resid 9 and name o)  (resid 13 and name n) 2.8 0.4 0.5

!T10

assign (resid 10 and name o)  (resid 14 and name hn) 1.8 0.3 0.5
assign (resid 10 and name o)  (resid 14 and name n) 2.8 0.4 0.5

!L11

assign (resid 11 and name o)  (resid 15 and name hn) 1.8 0.3 0.5
assign (resid 11 and name o)  (resid 15 and name n) 2.8 0.4 0.5

!Q12
assign (resid 12 and name o)  (resid 16 and name hn) 1.8 0.3 0.5
assign (resid 12 and name o)  (resid 16 and name n) 2.8 0.4 0.5

!E13

assign (resid 13 and name o)  (resid 17 and name hn) 1.8 0.3 0.5
assign (resid 13 and name o)  (resid 17 and name n) 2.8 0.4 0.5

!I14

assign (resid 14 and name o)  (resid 18 and name hn) 1.8 0.3 0.5
assign (resid 14 and name o)  (resid 18 and name n) 2.8 0.4 0.5

!I15

assign (resid 15 and name o)  (resid 19 and name hn) 1.8 0.3 0.5
assign (resid 15 and name o)  (resid 19 and name n) 2.8 0.4 0.5

!K16

assign (resid 16 and name o)  (resid 20 and name hn) 1.8 0.3 0.5
assign (resid 16 and name o)  (resid 20 and name n) 2.8 0.4 0.5

!T17

assign (resid 17 and name o)  (resid 21 and name hn) 1.8 0.3 0.5
assign (resid 17 and name o)  (resid 21 and name n) 2.8 0.4 0.5


!V33

assign (resid 33 and name o) (resid 111 and name n) 2.8 0.4 0.5
assign (resid 33 and name o) (resid 111 and name hn) 1.8 0.3 0.5


!E45

assign (resid 45 and name o)  (resid 49 and name hn) 1.8 0.3 0.5
assign (resid 45 and name o)  (resid 49 and name n) 2.8 0.4 0.5

!K46

assign (resid 46 and name o)  (resid 50 and name hn) 1.8 0.3 0.5
assign (resid 46 and name o)  (resid 50 and name n) 2.8 0.4 0.5

!E47

assign (resid 47 and name o)  (resid 51 and name hn) 1.8 0.3 0.5
assign (resid 47 and name o)  (resid 51 and name n) 2.8 0.4 0.5

!T48

assign (resid 48 and name o)  (resid 52 and name hn) 1.8 0.3 0.5
assign (resid 48 and name o)  (resid 52 and name n) 2.8 0.4 0.5

!F49

assign (resid 49 and name o)  (resid 53 and name hn) 1.8 0.3 0.5
assign (resid 49 and name o)  (resid 53 and name n) 2.8 0.4 0.5

!C50

assign (resid 50 and name o)  (resid 54 and name hn) 1.8 0.3 0.5
assign (resid 50 and name o)  (resid 54 and name n) 2.8 0.4 0.5

!R51

assign (resid 51 and name o)  (resid 55 and name hn) 1.8 0.3 0.5
assign (resid 51 and name o)  (resid 55 and name n) 2.8 0.4 0.5

!A52

assign (resid 52 and name o)  (resid 56 and name hn) 1.8 0.3 0.5
assign (resid 52 and name o)  (resid 56 and name n) 2.8 0.4 0.5

!A53

assign (resid 53 and name o)  (resid 57 and name hn) 1.8 0.3 0.5
assign (resid 53 and name o)  (resid 57 and name n) 2.8 0.4 0.5

!T54

assign (resid 54 and name o)  (resid 58 and name hn) 1.8 0.3 0.5
assign (resid 54 and name o)  (resid 58 and name n) 2.8 0.4 0.5

!V55

assign (resid 55 and name o)  (resid 59 and name hn) 1.8 0.3 0.5
assign (resid 55 and name o)  (resid 59 and name n) 2.8 0.4 0.5

!L56

assign (resid 56 and name o)  (resid 60 and name hn) 1.8 0.3 0.5
assign (resid 56 and name o)  (resid 60 and name n) 2.8 0.4 0.5

!R57

assign (resid 57 and name o)  (resid 61 and name hn) 1.8 0.3 0.5
assign (resid 57 and name o)  (resid 61 and name n) 2.8 0.4 0.5

!Q75

assign (resid 75 and name o)  (resid 79 and name hn) 1.8 0.3 0.5
assign (resid 75 and name o)  (resid 79 and name n) 2.8 0.4 0.5

!Q76

assign (resid 76 and name o)  (resid 80 and name hn) 1.8 0.3 0.5
assign (resid 76 and name o)  (resid 80 and name n) 2.8 0.4 0.5

!F77

assign (resid 77 and name o)  (resid 81 and name hn) 1.8 0.3 0.5
assign (resid 77 and name o)  (resid 81 and name n) 2.8 0.4 0.5


!H80

assign (resid 80 and name o)  (resid 84 and name hn) 1.8 0.3 0.5
assign (resid 80 and name o)  (resid 84 and name n) 2.8 0.4 0.5


!Q82

assign (resid 82 and name o)  (resid 86 and name hn) 1.8 0.3 0.5
assign (resid 82 and name o)  (resid 86 and name n) 2.8 0.4 0.5

!L83

assign (resid 83 and name o)  (resid 87 and name hn) 1.8 0.3 0.5
assign (resid 83 and name o)  (resid 87 and name n) 2.8 0.4 0.5

!I84

assign (resid 84 and name o)  (resid 88 and name hn) 1.8 0.3 0.5
assign (resid 84 and name o)  (resid 88 and name n) 2.8 0.4 0.5

!R85

assign (resid 85 and name o)  (resid 89 and name hn) 1.8 0.3 0.5
assign (resid 85 and name o)  (resid 89 and name n) 2.8 0.4 0.5

!F86

assign (resid 86 and name o)  (resid 90 and name hn) 1.8 0.3 0.5
assign (resid 86 and name o)  (resid 90 and name n) 2.8 0.4 0.5

!L87

assign (resid 87 and name o)  (resid 91 and name hn) 1.8 0.3 0.5
assign (resid 87 and name o)  (resid 91 and name n) 2.8 0.4 0.5

!R89

assign (resid 89 and name o)  (resid 93 and name hn) 1.8 0.3 0.5
assign (resid 89 and name o)  (resid 93 and name n) 2.8 0.4 0.5

!L90

assign (resid 90 and name o)  (resid 94 and name hn) 1.8 0.3 0.5
assign (resid 90 and name o)  (resid 94 and name n) 2.8 0.4 0.5

!R92

assign (resid 92 and name o)  (resid 96 and name hn) 1.8 0.3 0.5
assign (resid 92 and name o)  (resid 96 and name n) 2.8 0.4 0.5

!S111

assign (resid 111 and name o) (resid 33 and name n) 2.8 0.4 0.5
assign (resid 111 and name o) (resid 33 and name hn) 1.8 0.3 0.5

!L113

assign (resid 113 and name o)  (resid 117 and name hn) 1.8 0.3 0.5
assign (resid 113 and name o)  (resid 117 and name n) 2.8 0.4 0.5`

!E114

assign (resid 114 and name o)  (resid 118 and name hn) 1.8 0.3 0.5
assign (resid 114 and name o)  (resid 118 and name n) 2.8 0.4 0.5

!N115

assign (resid 115 and name o)  (resid 119 and name hn) 1.8 0.3 0.5
assign (resid 115 and name o)  (resid 119 and name n) 2.8 0.4 0.5

!F116

assign (resid 116 and name o)  (resid 120 and name hn) 1.8 0.3 0.5
assign (resid 116 and name o)  (resid 120 and name n) 2.8 0.4 0.5

!L117

assign (resid 117 and name o)  (resid 121 and name hn) 1.8 0.3 0.5
assign (resid 117 and name o)  (resid 121 and name n) 2.8 0.4 0.5

!E118

assign (resid 118 and name o)  (resid 122 and name hn) 1.8 0.3 0.5
assign (resid 118 and name o)  (resid 122 and name n) 2.8 0.4 0.5

!R119

assign (resid 119 and name o)  (resid 123 and name hn) 1.8 0.3 0.5
assign (resid 119 and name o)  (resid 123 and name n) 2.8 0.4 0.5

!L120

assign (resid 120 and name o)  (resid 124 and name hn) 1.8 0.3 0.5
assign (resid 120 and name o)  (resid 124 and name n) 2.8 0.4 0.5

!K121

assign (resid 121 and name o)  (resid 125 and name hn) 1.8 0.3 0.5
assign (resid 121 and name o)  (resid 125 and name n) 2.8 0.4 0.5

!T122

assign (resid 122 and name o)  (resid 126 and name hn) 1.8 0.3 0.5
assign (resid 122 and name o)  (resid 126 and name n) 2.8 0.4 0.5

!I123

assign (resid 123 and name o)  (resid 127 and name hn) 1.8 0.3 0.5
assign (resid 123 and name o)  (resid 127 and name n) 2.8 0.4 0.5

!M124

assign (resid 124 and name o)  (resid 128 and name hn) 1.8 0.3 0.5
assign (resid 124 and name o)  (resid 128 and name n) 2.8 0.4 0.5





B. Torsion angle restraints

The torsion angle restraints are derived from coupling constant and NOE data
using the conformational grid search program STEREOSEARCH [Nilges, M.,
Clore, G.M. & Gronenborn, A.M. (1990) Biopolymers 29, 813-822].
They are represented by a square well potential
[Clore et al. (1986) EMBO J. 5, 2729-2735].  The upper and lower limits are 
given by i+j and i-j respectively, where the numbers are entered in the order
x,i,j,m.  x is the force constant and m the exponent used to compute the
torsion angle restraints target function.


!! Phi restraints:

  !!    8
 assign (resid   7 and name c )   (resid   8 and name n ) 
        (resid   8 and name ca)   (resid   8 and name c )  1.0 -50.0 40.0 2
  !!    9
 assign (resid   8 and name c )   (resid   9 and name n ) 
        (resid   9 and name ca)   (resid   9 and name c )  1.0 -50.0 40.0 2
  !!    10
 assign (resid   9 and name c )   (resid   10 and name n ) 
        (resid   10 and name ca)   (resid   10 and name c )  1.0 -50.0 40.0 2
  !!    11
 assign (resid   10 and name c )   (resid   11 and name n ) 
        (resid   11 and name ca)   (resid   11 and name c )  1.0 -50.0 40.0 2
  !!    12
 assign (resid   11 and name c )   (resid   12 and name n ) 
        (resid   12 and name ca)   (resid   12 and name c )  1.0 -50.0 40.0 2
  !!    13
 assign (resid   12 and name c )   (resid   13 and name n ) 
        (resid   13 and name ca)   (resid   13 and name c )  1.0 -50.0 40.0 2
  !!    14
 assign (resid   13 and name c )   (resid   14 and name n ) 
        (resid   14 and name ca)   (resid   14 and name c )  1.0 -50.0 40.0 2
  !!    15
 assign (resid   14 and name c )   (resid   15 and name n ) 
        (resid   15 and name ca)   (resid   15 and name c )  1.0 -50.0 40.0 2
  !!    16
 assign (resid   15 and name c )   (resid   16 and name n ) 
        (resid   16 and name ca)   (resid   16 and name c )  1.0 -50.0 40.0 2
  !!    17
 assign (resid   16 and name c )   (resid   17 and name n ) 
        (resid   17 and name ca)   (resid   17 and name c )  1.0 -50.0 40.0 2
  !!    18
 assign (resid   17 and name c )   (resid   18 and name n ) 
        (resid   18 and name ca)   (resid   18 and name c )  1.0 -50.0 40.0 2
  !!    19
 assign (resid   18 and name c )   (resid   19 and name n ) 
        (resid   19 and name ca)   (resid   19 and name c )  1.0 -50.0 40.0 2
  !!    20
 assign (resid   19 and name c )   (resid   20 and name n ) 
        (resid   20 and name ca)   (resid   20 and name c )  1.0 -50.0 40.0 2
  !!    21
 assign (resid   20 and name c )   (resid   21 and name n ) 
        (resid   21 and name ca)   (resid   21 and name c )  1.0 -50.0 40.0 2

  !!    22
 assign (resid   21 and name c )   (resid   22 and name n ) 
        (resid   22 and name ca)   (resid   22 and name c )  1.0 -50.0 40.0 2
  !!    23
 assign (resid   22 and name c )   (resid   23 and name n ) 
        (resid   23 and name ca)   (resid   23 and name c )  1.0 -50.0 40.0 2
  !!    24
 assign (resid   23 and name c )   (resid   24 and name n ) 
        (resid   24 and name ca)   (resid   24 and name c )  1.0 -125.0 50.0 2

  !!    26
 assign (resid   25 and name c )   (resid   26 and name n ) 
        (resid   26 and name ca)   (resid   26 and name c )  1.0 -125.0 50.0 2
 
  !!    27
 assign (resid   26 and name c )   (resid   27 and name n ) 
        (resid   27 and name ca)   (resid   27 and name c )  1.0 -50.0 40.0 2
  !!    28
 assign (resid   27 and name c )   (resid   28 and name n ) 
        (resid   28 and name ca)   (resid   28 and name c )  1.0 -50.0 40.0 2
  !!    29
 assign (resid   28 and name c )   (resid   29 and name n ) 
        (resid   29 and name ca)   (resid   29 and name c )  1.0 -50.0 40.0 2

  !!    33
 assign (resid   32 and name c )   (resid   33 and name n ) 
        (resid   33 and name ca)   (resid   33 and name c )  1.0 -125.0 50.0 2
  !!    34
 assign (resid   36 and name c )   (resid   37 and name n ) 
        (resid   37 and name ca)   (resid   37 and name c )  1.0 -125.0 50.0 2
  !!    39
 assign (resid   38 and name c )   (resid   39 and name n ) 
        (resid   39 and name ca)   (resid   39 and name c )  1.0 -125.0 40.0 2

 assign (resid   42 and name c )   (resid   43 and name n ) 
        (resid   43 and name ca)   (resid   43 and name c )  1.0 -125.0 40.0 2
  !!    44
 assign (resid   43 and name c )   (resid   44 and name n ) 
        (resid   44 and name ca)   (resid   44 and name c )  1.0 -125.0 40.0 2


  !!    46
 assign (resid   45 and name c )   (resid   46 and name n ) 
        (resid   46 and name ca)   (resid   46 and name c )  1.0 -50.0 40.0 2
  !!    47
 assign (resid   46 and name c )   (resid   47 and name n ) 
        (resid   47 and name ca)   (resid   47 and name c )  1.0 -50.0 40.0 2
  !!    48
 assign (resid   47 and name c )   (resid   48 and name n ) 
        (resid   48 and name ca)   (resid   48 and name c )  1.0 -50.0 40.0 2
  !!    49
 assign (resid   48 and name c )   (resid   49 and name n ) 
        (resid   49 and name ca)   (resid   49 and name c )  1.0 -50.0 40.0 2
  !!    50
 assign (resid   49 and name c )   (resid   50 and name n ) 
        (resid   50 and name ca)   (resid   50 and name c )  1.0 -50.0 40.0 2
  !!    51
 assign (resid   50 and name c )   (resid   51 and name n ) 
        (resid   51 and name ca)   (resid   51 and name c )  1.0 -50.0 40.0 2
  !!    52
 assign (resid   51 and name c )   (resid   52 and name n ) 
        (resid   52 and name ca)   (resid   52 and name c )  1.0 -50.0 40.0 2
  !!    53
 assign (resid   52 and name c )   (resid   53 and name n ) 
        (resid   53 and name ca)   (resid   53 and name c )  1.0 -50.0 40.0 2
  !!    54
 assign (resid   53 and name c )   (resid   54 and name n ) 
        (resid   54 and name ca)   (resid   54 and name c )  1.0 -50.0 40.0 2
  !!    55
 assign (resid   54 and name c )   (resid   55 and name n ) 
        (resid   55 and name ca)   (resid   55 and name c )  1.0 -50.0 40.0 2
  !!    56
 assign (resid   55 and name c )   (resid   56 and name n ) 
        (resid   56 and name ca)   (resid   56 and name c )  1.0 -50.0 40.0 2
  !!    57
 assign (resid   56 and name c )   (resid   57 and name n ) 
        (resid   57 and name ca)   (resid   57 and name c )  1.0 -50.0 40.0 2
  !!    58
 assign (resid   57 and name c )   (resid   58 and name n ) 
        (resid   58 and name ca)   (resid   58 and name c )  1.0 -50.0 40.0 2
  !!    59
 assign (resid   58 and name c )   (resid   59 and name n ) 
        (resid   59 and name ca)   (resid   59 and name c )  1.0 -50.0 40.0 2
  !!    60
 assign (resid   59 and name c )   (resid   60 and name n ) 
        (resid   60 and name ca)   (resid   60 and name c )  1.0 -50.0 40.0 2
  !!    61
 assign (resid   60 and name c )   (resid   61 and name n ) 
        (resid   61 and name ca)   (resid   61 and name c )  1.0 -50.0 40.0 2
  !!    62
 assign (resid   61 and name c )   (resid   62 and name n ) 
        (resid   62 and name ca)   (resid   62 and name c )  1.0 -50.0 40.0 2
  !!    63
 assign (resid   62 and name c )   (resid   63 and name n ) 
        (resid   63 and name ca)   (resid  63 and name c )  1.0 -50.0 40.0 2
  !!    64
 assign (resid   63 and name c )   (resid   64 and name n ) 
        (resid   64 and name ca)   (resid   64 and name c )  1.0 -50.0 40.0 2

  !!    66
 assign (resid   65 and name c )   (resid   66 and name n ) 
        (resid   66 and name ca)   (resid   66 and name c )  1.0 -125.0 50.0 2

  !!    67
 assign (resid   66 and name c )   (resid   67 and name n ) 
        (resid   67 and name ca)   (resid   67 and name c )  1.0 -50.0 40.0 2
  !!    68
 assign (resid   67 and name c )   (resid   68 and name n ) 
        (resid   68 and name ca)   (resid   68 and name c )  1.0 -50.0 40.0 2
  !!    69
 assign (resid   68 and name c )   (resid   69 and name n ) 
        (resid   69 and name ca)   (resid   69 and name c )  1.0 -50.0 40.0 2
  !!    70
 assign (resid   69 and name c )   (resid   70 and name n ) 
        (resid   70 and name ca)   (resid   70 and name c )  1.0 -50.0 40.0 2

  !!    72
 assign (resid   71 and name c )   (resid   72 and name n ) 
        (resid   72 and name ca)   (resid   72 and name c )  1.0 -125.0 50.0 2
  !!    73
 assign (resid   72 and name c )   (resid   73 and name n ) 
        (resid   73 and name ca)   (resid   73 and name c )  1.0 -125.0 50.0 2
  !!    74
 assign (resid   73 and name c )   (resid   74 and name n ) 
        (resid   74 and name ca)   (resid   74 and name c )  1.0 -50.0 40.0 2
  !!    75
 assign (resid   74 and name c )   (resid   75 and name n ) 
        (resid   75 and name ca)   (resid   75 and name c )  1.0 -50.0 40.0 2
  !!    76
 assign (resid   75 and name c )   (resid   76 and name n ) 
        (resid   76 and name ca)   (resid   76 and name c )  1.0 -50.0 40.0 2
  !!    77
 assign (resid   76 and name c )   (resid   77 and name n ) 
        (resid   77 and name ca)   (resid   77 and name c )  1.0 -50.0 40.0 2
  !!    78
 assign (resid   77 and name c )   (resid   78 and name n ) 
        (resid   78 and name ca)   (resid   78 and name c )  1.0 -50.0 40.0 2
  !!    79
 assign (resid   78 and name c )   (resid   79 and name n ) 
        (resid   79 and name ca)   (resid   79 and name c )  1.0 -50.0 40.0 2
  !!    80
 assign (resid   79 and name c )   (resid   80 and name n ) 
        (resid   80 and name ca)   (resid   80 and name c )  1.0 -50.0 40.0 2
  !!    81
 assign (resid   80 and name c )   (resid   81 and name n ) 
        (resid   81 and name ca)   (resid   81 and name c )  1.0 -50.0 40.0 2
  !!    82
 assign (resid   81 and name c )   (resid   82 and name n ) 
        (resid   82 and name ca)   (resid   82 and name c )  1.0 -50.0 40.0 2
  !!    83
 assign (resid   82 and name c )   (resid   83 and name n ) 
        (resid   83 and name ca)   (resid   83 and name c )  1.0 -50.0 40.0 2
  !!    84
 assign (resid   83 and name c )   (resid   84 and name n ) 
        (resid   84 and name ca)   (resid   84 and name c )  1.0 -50.0 40.0 2
  !!    85
 assign (resid   84 and name c )   (resid   85 and name n ) 
        (resid   85 and name ca)   (resid   85 and name c )  1.0 -50.0 40.0 2
  !!    86
 assign (resid   85 and name c )   (resid   86 and name n ) 
        (resid   86 and name ca)   (resid   86 and name c )  1.0 -50.0 40.0 2
  !!    87
 assign (resid   86 and name c )   (resid   87 and name n ) 
        (resid   87 and name ca)   (resid   87 and name c )  1.0 -50.0 40.0 2
  !!    88
 assign (resid   87 and name c )   (resid   88 and name n ) 
        (resid   88 and name ca)   (resid   88 and name c )  1.0 -50.0 40.0 2
  !!    89
 assign (resid   88 and name c )   (resid   89 and name n ) 
        (resid   89 and name ca)   (resid   89 and name c )  1.0 -50.0 40.0 2
  !!    90
 assign (resid   89 and name c )   (resid   90 and name n ) 
        (resid   90 and name ca)   (resid   90 and name c )  1.0 -50.0 40.0 2
  !!    91
 assign (resid   90 and name c )   (resid   91 and name n ) 
        (resid   91 and name ca)   (resid   91 and name c )  1.0 -50.0 40.0 2
  !!    92
 assign (resid   91 and name c )   (resid   92 and name n ) 
        (resid   92 and name ca)   (resid   92 and name c )  1.0 -50.0 40.0 2
  !!    93
 assign (resid   92 and name c )   (resid   93 and name n ) 
        (resid   93 and name ca)   (resid   93 and name c )  1.0 -50.0 40.0 2
  !!    94
 assign (resid   93 and name c )   (resid   94 and name n ) 
        (resid   94 and name ca)   (resid   94 and name c )  1.0 -50.0 40.0 2
  !!    95
 assign (resid   94 and name c )   (resid   95 and name n ) 
        (resid   95 and name ca)   (resid   95 and name c )  1.0 -50.0 40.0 2
  !!    96
 assign (resid   95 and name c )   (resid   96 and name n ) 
        (resid   96 and name ca)   (resid   96 and name c )  1.0 -50.0 40.0 2
  !!    97
 assign (resid   96 and name c )   (resid   97 and name n ) 
        (resid   97 and name ca)   (resid   97 and name c )  1.0 -50.0 40.0 2
  !!    98
 assign (resid   97 and name c )   (resid   98 and name n ) 
        (resid   98 and name ca)   (resid   98 and name c )  1.0 -50.0 40.0 2
  !!    100
 assign (resid   99 and name c )   (resid    100 and name n ) 
        (resid   100 and name ca)   (resid   100 and name c )  1.0 -125.0 40.0 2
   !!    102
 assign (resid   101 and name c )   (resid   102 and name n ) 
        (resid   102 and name ca)   (resid   102 and name c )  1.0 -50.0 40.0 2
   !!    103
 assign (resid   102 and name c )   (resid   103 and name n ) 
        (resid   103 and name ca)   (resid   103 and name c )  1.0 -125.0 40.0 2
   !!    104
 assign (resid   103 and name c )   (resid   104 and name n ) 
        (resid   104 and name ca)   (resid   104 and name c )  1.0 -50.0 40.0 2
 assign (resid   107 and name c )   (resid   108 and name n ) 
        (resid   108 and name ca)   (resid   108 and name c )  1.0 -125.0 50.0 2
  !!    111
 assign (resid   110 and name c )   (resid   111 and name n ) 
        (resid   111 and name ca)   (resid   111 and name c )  1.0 -125.0 50.0 2
 
  !!    113
 assign (resid   112 and name c )   (resid   113 and name n ) 
        (resid   113 and name ca)   (resid   113 and name c )  1.0 -50.0 40.0 2
  !!    114
 assign (resid   113 and name c )   (resid   114 and name n ) 
        (resid   114 and name ca)   (resid   114 and name c )  1.0 -50.0 40.0 2
  !!    115
 assign (resid   114 and name c )   (resid   115 and name n ) 
        (resid   115 and name ca)   (resid   115 and name c )  1.0 -50.0 40.0 2
  !!    116
 assign (resid   115 and name c )   (resid   116 and name n ) 
        (resid   116 and name ca)   (resid   116 and name c )  1.0 -50.0 40.0 2
  !!    117
 assign (resid   116 and name c )   (resid   117 and name n ) 
        (resid   117 and name ca)   (resid   117 and name c )  1.0 -50.0 40.0 2
  !!    118
 assign (resid   117 and name c )   (resid   118 and name n ) 
        (resid   118 and name ca)   (resid   118 and name c )  1.0 -50.0 40.0 2
  !!    119
 assign (resid   118 and name c )   (resid   119 and name n ) 
        (resid   119 and name ca)   (resid   119 and name c )  1.0 -50.0 40.0 2
  !!    120
 assign (resid   119 and name c )   (resid   120 and name n ) 
        (resid   120 and name ca)   (resid   120 and name c )  1.0 -50.0 40.0 2
  !!    121
 assign (resid   120 and name c )   (resid   121 and name n ) 
        (resid   121 and name ca)   (resid   121 and name c )  1.0 -50.0 40.0 2
  !!    122
 assign (resid   121 and name c )   (resid   122 and name n ) 
        (resid   122 and name ca)   (resid   122 and name c )  1.0 -50.0 40.0 2
  !!    123
 assign (resid   122 and name c )   (resid   123 and name n ) 
        (resid   123 and name ca)   (resid   123 and name c )  1.0 -50.0 40.0 2
  !!    124
 assign (resid   123 and name c )   (resid   124 and name n ) 
        (resid   124 and name ca)   (resid   124 and name c )  1.0 -50.0 40.0 2
  !!    125
 assign (resid   124 and name c )   (resid   125 and name n ) 
        (resid   125 and name ca)   (resid   125 and name c )  1.0 -50.0 40.0 2
  !!    126
 assign (resid   125 and name c )   (resid   126 and name n ) 
        (resid   126 and name ca)   (resid   126 and name c )  1.0 -50.0 40.0 2
  !!    127
 assign (resid   126 and name c )   (resid   127 and name n ) 
        (resid   127 and name ca)   (resid   127 and name c )  1.0 -50.0 40.0 2
  !!    128
 assign (resid   127 and name c )   (resid   128 and name n ) 
        (resid   128 and name ca)   (resid   128 and name c )  1.0 -50.0 40.0 2
  !!    129
 assign (resid   128 and name c )   (resid   129 and name n ) 
        (resid   129 and name ca)   (resid   129 and name c )  1.0 -50.0 40.0 2

 !!    133
 assign (resid   132 and name c )   (resid   133 and name n ) 
        (resid   133 and name ca)   (resid   133 and name c )  1.0 -125.0 50.0 2
 


!!psi restraints
!!9
assign  (resid 9 and name n)   (resid 9 and name ca)
        (resid 9 and name c)   (resid 10 and name n)    1.0 -50.0 60.0 2
!!10
assign  (resid 10 and name n)   (resid 10 and name ca)
        (resid 10 and name c)   (resid 11 and name n)    1.0 -50.0 60.0 2
!!11
assign  (resid 11 and name n)   (resid 11 and name ca)
        (resid 11 and name c)   (resid 12 and name n)    1.0 -50.0 60.0 2
!!12
assign  (resid 12 and name n)   (resid 12 and name ca)
        (resid 12 and name c)   (resid 13 and name n)    1.0 -50.0 60.0 2
!!13
assign  (resid 13 and name n)   (resid 13 and name ca)
        (resid 13 and name c)   (resid 14 and name n)    1.0 -50.0 60.0 2
!!14
assign  (resid 14 and name n)   (resid 14 and name ca)
        (resid 14 and name c)   (resid 15 and name n)    1.0 -50.0 60.0 2
!!15
assign  (resid 15 and name n)   (resid 15 and name ca)
        (resid 15 and name c)   (resid 16 and name n)    1.0 -50.0 60.0 2
!!16
assign  (resid 16 and name n)   (resid 16 and name ca)
        (resid 16 and name c)   (resid 17 and name n)    1.0 -50.0 60.0 2
!!17
assign  (resid 17 and name n)   (resid 17 and name ca)
        (resid 17 and name c)   (resid 18 and name n)    1.0 -50.0 60.0 2
!!18
assign  (resid 18 and name n)   (resid 18 and name ca)
        (resid 18 and name c)   (resid 19 and name n)    1.0 -50.0 60.0 2
!!19
assign  (resid 19 and name n)   (resid 19 and name ca)
        (resid 19 and name c)   (resid 20 and name n)    1.0 -50.0 60.0 2
!!20
assign  (resid 20 and name n)   (resid 20 and name ca)
        (resid 20 and name c)   (resid 21 and name n)    1.0 -50.0 60.0 2
!!21
assign  (resid 21 and name n)   (resid 21 and name ca)
        (resid 21 and name c)   (resid 22 and name n)    1.0 -50.0 60.0 2
!!27
assign  (resid 27 and name n)   (resid 27 and name ca)
        (resid 27 and name c)   (resid 28 and name n)    1.0 -50.0 60.0 2
!!28
assign  (resid 28 and name n)   (resid 28 and name ca)
        (resid 28 and name c)   (resid 29 and name n)    1.0 -50.0 60.0 2
!!29
assign  (resid 29 and name n)   (resid 29 and name ca)
        (resid 29 and name c)   (resid 30 and name n)    1.0 -50.0 60.0 2
!!45
!assign  (resid 45 and name n)   (resid 45 and name ca)
!        (resid 45 and name c)   (resid 46 and name n)    1.0 -50.0 60.0 2
!!46
assign  (resid 46 and name n)   (resid 46 and name ca)
        (resid 46 and name c)   (resid 47 and name n)    1.0 -50.0 60.0 2
!!47
assign  (resid 47 and name n)   (resid 47 and name ca)
        (resid 47 and name c)   (resid 48 and name n)    1.0 -50.0 60.0 2
!!48
assign  (resid 48 and name n)   (resid 48 and name ca)
        (resid 48 and name c)   (resid 49 and name n)    1.0 -50.0 60.0 2
!!49
assign  (resid 49 and name n)   (resid 49 and name ca)
        (resid 49 and name c)   (resid 50 and name n)    1.0 -50.0 60.0 2
!!50
assign  (resid 50 and name n)   (resid 50 and name ca)
        (resid 50 and name c)   (resid 51 and name n)    1.0 -50.0 60.0 2
!!51
assign  (resid 51 and name n)   (resid 51 and name ca)
        (resid 51 and name c)   (resid 52 and name n)    1.0 -50.0 60.0 2
!!52
assign  (resid 52 and name n)   (resid 52 and name ca)
        (resid 52 and name c)   (resid 53 and name n)    1.0 -50.0 60.0 2
!!53
assign  (resid 53 and name n)   (resid 53 and name ca)
        (resid 53 and name c)   (resid 54 and name n)    1.0 -50.0 60.0 2
!!54
assign  (resid 54 and name n)   (resid 54 and name ca)
        (resid 54 and name c)   (resid 55 and name n)    1.0 -50.0 60.0 2
!!55
assign  (resid 55 and name n)   (resid 55 and name ca)
        (resid 55 and name c)   (resid 56 and name n)    1.0 -50.0 60.0 2
!!56
assign  (resid 56 and name n)   (resid 56 and name ca)
        (resid 56 and name c)   (resid 57 and name n)    1.0 -50.0 60.0 2
!!57
assign  (resid 57 and name n)   (resid 57 and name ca)
        (resid 57 and name c)   (resid 58 and name n)    1.0 -50.0 60.0 2
!!58
assign  (resid 58 and name n)   (resid 58 and name ca)
        (resid 58 and name c)   (resid 59 and name n)    1.0 -50.0 60.0 2
!!59
assign  (resid 59 and name n)   (resid 59 and name ca)
        (resid 59 and name c)   (resid 60 and name n)    1.0 -50.0 60.0 2
!!60
assign  (resid 60 and name n)   (resid 60 and name ca)
        (resid 60 and name c)   (resid 61 and name n)    1.0 -50.0 60.0 2
!!61
assign  (resid 61 and name n)   (resid 61 and name ca)
        (resid 61 and name c)   (resid 62 and name n)    1.0 -50.0 60.0 2
!!62
assign  (resid 62 and name n)   (resid 62 and name ca)
        (resid 62 and name c)   (resid 63 and name n)    1.0 -50.0 60.0 2

!!74
assign  (resid 74 and name n)   (resid 74 and name ca)
        (resid 74 and name c)   (resid 75 and name n)    1.0 -50.0 60.0 2
!!75
assign  (resid 75 and name n)   (resid 75 and name ca)
        (resid 75 and name c)   (resid 76 and name n)    1.0 -50.0 60.0 2
!!76
assign  (resid 76 and name n)   (resid 76 and name ca)
        (resid 76 and name c)   (resid 77 and name n)    1.0 -50.0 60.0 2
!!77
assign  (resid 77 and name n)   (resid 77 and name ca)
        (resid 77 and name c)   (resid 78 and name n)    1.0 -50.0 60.0 2
!!78
assign  (resid 78 and name n)   (resid 78 and name ca)
        (resid 78 and name c)   (resid 79 and name n)    1.0 -50.0 60.0 2
!!79
assign  (resid 79 and name n)   (resid 79 and name ca)
        (resid 79 and name c)   (resid 80 and name n)    1.0 -50.0 60.0 2
!!80
assign  (resid 80 and name n)   (resid 80 and name ca)
        (resid 80 and name c)   (resid 81 and name n)    1.0 -50.0 60.0 2
!!81
assign  (resid 81 and name n)   (resid 81 and name ca)
        (resid 81 and name c)   (resid 82 and name n)    1.0 -50.0 60.0 2
!!82
assign  (resid 82 and name n)   (resid 82 and name ca)
        (resid 82 and name c)   (resid 83 and name n)    1.0 -50.0 60.0 2
!!83
assign  (resid 83 and name n)   (resid 83 and name ca)
        (resid 83 and name c)   (resid 84 and name n)    1.0 -50.0 60.0 2
!!84
assign  (resid 84 and name n)   (resid 84 and name ca)
        (resid 84 and name c)   (resid 85 and name n)    1.0 -50.0 60.0 2
!!85
assign  (resid 85 and name n)   (resid 85 and name ca)
        (resid 85 and name c)   (resid 86 and name n)    1.0 -50.0 60.0 2
!!86
assign  (resid 86 and name n)   (resid 86 and name ca)
        (resid 86 and name c)   (resid 87 and name n)    1.0 -50.0 60.0 2
!!87
assign  (resid 87 and name n)   (resid 87 and name ca)
        (resid 87 and name c)   (resid 88 and name n)    1.0 -50.0 60.0 2
!!88
assign  (resid 88 and name n)   (resid 88 and name ca)
        (resid 88 and name c)   (resid 89 and name n)    1.0 -50.0 60.0 2
!!89
assign  (resid 89 and name n)   (resid 89 and name ca)
        (resid 89 and name c)   (resid 90 and name n)    1.0 -50.0 60.0 2
!!90
assign  (resid 90 and name n)   (resid 90 and name ca)
        (resid 90 and name c)   (resid 91 and name n)    1.0 -50.0 60.0 2
!!91
assign  (resid 91 and name n)   (resid 91 and name ca)
        (resid 91 and name c)   (resid 92 and name n)    1.0 -50.0 60.0 2
!!92
assign  (resid 92 and name n)   (resid 92 and name ca)
        (resid 92 and name c)   (resid 93 and name n)    1.0 -50.0 60.0 2
!!93
assign  (resid 93 and name n)   (resid 93 and name ca)
        (resid 93 and name c)   (resid 94 and name n)    1.0 -50.0 60.0 2
!!94
assign  (resid 94 and name n)   (resid 94 and name ca)
        (resid 94 and name c)   (resid 95 and name n)    1.0 -50.0 60.0 2
!!95
assign  (resid 95 and name n)   (resid 95 and name ca)
        (resid 95 and name c)   (resid 96 and name n)    1.0 -50.0 60.0 2
!!96
assign  (resid 96 and name n)   (resid 96 and name ca)
        (resid 96 and name c)   (resid 97 and name n)    1.0 -50.0 60.0 2
!!97
assign  (resid 97 and name n)   (resid 97 and name ca)
        (resid 97 and name c)   (resid 98 and name n)    1.0 -50.0 60.0 2

!!113
assign  (resid 113 and name n)   (resid 113 and name ca)
        (resid 113 and name c)   (resid 114 and name n)    1.0 -50.0 60.0 2
!!114
assign  (resid 114 and name n)   (resid 114 and name ca)
        (resid 114 and name c)   (resid 115 and name n)    1.0 -50.0 60.0 2
!!115
assign  (resid 115 and name n)   (resid 115 and name ca)
        (resid 115 and name c)   (resid 116 and name n)    1.0 -50.0 60.0 2
!!116
assign  (resid 116 and name n)   (resid 116 and name ca)
        (resid 116 and name c)   (resid 117 and name n)    1.0 -50.0 60.0 2
!!117
assign  (resid 117 and name n)   (resid 117 and name ca)
        (resid 117 and name c)   (resid 118 and name n)    1.0 -50.0 60.0 2
!!118
assign  (resid 118 and name n)   (resid 118 and name ca)
        (resid 118 and name c)   (resid 119 and name n)    1.0 -50.0 60.0 2
!!119
assign  (resid 119 and name n)   (resid 119 and name ca)
        (resid 119 and name c)   (resid 120 and name n)    1.0 -50.0 60.0 2
!!120
assign  (resid 120 and name n)   (resid 120 and name ca)
        (resid 120 and name c)   (resid 121 and name n)    1.0 -50.0 60.0 2
!!121
assign  (resid 121 and name n)   (resid 121 and name ca)
        (resid 121 and name c)   (resid 122 and name n)    1.0 -50.0 60.0 2
!!122
assign  (resid 122 and name n)   (resid 122 and name ca)
        (resid 122 and name c)   (resid 123 and name n)    1.0 -50.0 60.0 2
!!123
assign  (resid 123 and name n)   (resid 123 and name ca)
        (resid 123 and name c)   (resid 124 and name n)    1.0 -50.0 60.0 2
!!124
assign  (resid 124 and name n)   (resid 124 and name ca)
        (resid 124 and name c)   (resid 125 and name n)    1.0 -50.0 60.0 2
!!125
assign  (resid 125 and name n)   (resid 125 and name ca)
        (resid 125 and name c)   (resid 126 and name n)    1.0 -50.0 60.0 2
!!126
assign  (resid 126 and name n)   (resid 126 and name ca)
        (resid 126 and name c)   (resid 127 and name n)    1.0 -50.0 60.0 2
!!127
assign  (resid 127 and name n)   (resid 127 and name ca)
        (resid 127 and name c)   (resid 128 and name n)    1.0 -50.0 60.0 2


  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had 1102 H/Q atoms
  Start of MODEL    1
    1   1H    GLU   1           HT2      GLU   1 -20.354  15.600  10.333
    2   2H    GLU   1           HT1      GLU   1 -19.206  14.744  11.248
    3   3H    GLU   1           HT3      GLU   1 -19.624  16.330  11.682
    4    HA   GLU   1           HA       GLU   1 -18.447  17.285   9.975
    5   1HB   GLU   1           HB2      GLU   1 -16.289  16.534  10.326
    6   2HB   GLU   1           HB1      GLU   1 -17.100  15.705  11.654
    7   1HG   GLU   1           HG2      GLU   1 -17.464  13.766  10.009
    8   2HG   GLU   1           HG1      GLU   1 -16.287  14.574   8.973
    9    H    ALA   2           HN       ALA   2 -19.392  13.975   9.274
   10    HA   ALA   2           HA       ALA   2 -18.386  14.028   6.538
   11   1HB   ALA   2           HB1      ALA   2 -18.825  11.946   7.985
   12   2HB   ALA   2           HB3      ALA   2 -20.531  12.185   7.603
   13   3HB   ALA   2           HB2      ALA   2 -19.371  11.878   6.310
   14    H    GLU   3           HN       GLU   3 -19.636  14.329   4.642
   15    HA   GLU   3           HA       GLU   3 -22.364  15.472   5.096
   16   1HB   GLU   3           HB2      GLU   3 -20.132  16.416   3.292
   17   2HB   GLU   3           HB1      GLU   3 -21.812  16.862   2.993
   18   1HG   GLU   3           HG2      GLU   3 -21.991  17.920   5.157
   19   2HG   GLU   3           HG1      GLU   3 -20.408  17.309   5.640
   20    H    ALA   4           HN       ALA   4 -20.411  14.530   2.243
   21    HA   ALA   4           HA       ALA   4 -22.783  13.182   1.125
   22   1HB   ALA   4           HB3      ALA   4 -21.136  14.626  -0.221
   23   2HB   ALA   4           HB2      ALA   4 -20.020  13.266  -0.095
   24   3HB   ALA   4           HB1      ALA   4 -21.567  13.064  -0.917
   25    H    HIS   5           HN       HIS   5 -19.381  12.267   1.750
   26    HA   HIS   5           HA       HIS   5 -20.030   9.816   3.059
   27   1HB   HIS   5           HB2      HIS   5 -20.465   9.677   0.300
   28   2HB   HIS   5           HB1      HIS   5 -18.888   8.923   0.533
   29    HD1  HIS   5           HD1      HIS   5 -22.516   8.453   1.221
   30    HD2  HIS   5           HD2      HIS   5 -18.927   6.599   2.249
   31    HE1  HIS   5           HE1      HIS   5 -23.130   6.210   2.225
   32    H    LYS   6           HN       LYS   6 -18.018   8.408   3.268
   33    HA   LYS   6           HA       LYS   6 -15.599  10.150   3.093
   34   1HB   LYS   6           HB2      LYS   6 -14.696   8.601   4.882
   35   2HB   LYS   6           HB1      LYS   6 -16.081   9.571   5.381
   36   1HG   LYS   6           HG2      LYS   6 -17.545   7.758   5.329
   37   2HG   LYS   6           HG1      LYS   6 -16.542   6.853   4.194
   38   1HD   LYS   6           HD2      LYS   6 -16.595   6.166   6.741
   39   2HD   LYS   6           HD1      LYS   6 -15.071   6.140   5.853
   40   1HE   LYS   6           HE2      LYS   6 -14.314   8.128   6.836
   41   2HE   LYS   6           HE1      LYS   6 -15.942   8.642   7.277
   42   1HZ   LYS   6           HZ2      LYS   6 -15.890   6.504   8.712
   43   2HZ   LYS   6           HZ1      LYS   6 -14.204   6.660   8.578
   44   3HZ   LYS   6           HZ3      LYS   6 -15.117   7.909   9.273
   45    H    CYS   7           HN       CYS   7 -16.619   8.529   0.927
   46    HA   CYS   7           HA       CYS   7 -14.278   6.698   0.601
   47   1HB   CYS   7           HB2      CYS   7 -17.144   6.108   0.410
   48   2HB   CYS   7           HB1      CYS   7 -16.231   5.592  -1.007
   49    H    ASP   8           HN       ASP   8 -16.154   9.269  -0.750
   50    HA   ASP   8           HA       ASP   8 -15.224   8.737  -3.490
   51   1HB   ASP   8           HB2      ASP   8 -17.378  10.182  -2.320
   52   2HB   ASP   8           HB1      ASP   8 -16.387  11.336  -3.213
   53    H    ILE   9           HN       ILE   9 -14.722  11.210  -0.961
   54    HA   ILE   9           HA       ILE   9 -12.613  12.456  -2.616
   55    HB   ILE   9           HB       ILE   9 -13.581  13.176   0.168
   56   1HG1  ILE   9          HG12      ILE   9 -14.277  14.354  -2.543
   57   2HG1  ILE   9          HG11      ILE   9 -15.351  13.359  -1.559
   58   1HG2  ILE   9          HG22      ILE   9 -11.274  13.963  -1.204
   59   2HG2  ILE   9          HG21      ILE   9 -12.414  15.278  -1.481
   60   3HG2  ILE   9          HG23      ILE   9 -12.007  14.797   0.166
   61   1HD1  ILE   9          HD11      ILE   9 -14.136  15.973  -0.624
   62   2HD1  ILE   9          HD13      ILE   9 -15.758  15.826  -1.302
   63   3HD1  ILE   9          HD12      ILE   9 -15.358  15.015   0.212
   64    H    THR  10           HN       THR  10 -12.745  11.207   0.766
   65    HA   THR  10           HA       THR  10  -9.964  11.227   1.212
   66    HB   THR  10           HB       THR  10 -12.128   9.409   2.277
   67    HG1  THR  10           HG1      THR  10 -11.899  10.702   4.052
   68   1HG2  THR  10          HG23      THR  10  -9.173   9.234   2.552
   69   2HG2  THR  10          HG22      THR  10 -10.103   9.082   4.043
   70   3HG2  THR  10          HG21      THR  10 -10.394   7.970   2.706
   71    H    LEU  11           HN       LEU  11 -11.799   8.250   0.440
   72    HA   LEU  11           HA       LEU  11  -9.564   6.670  -0.172
   73   1HB   LEU  11           HB2      LEU  11 -12.433   6.503  -0.561
   74   2HB   LEU  11           HB1      LEU  11 -11.566   5.790  -1.923
   75    HG   LEU  11           HG       LEU  11 -10.164   4.509  -0.265
   76   1HD1  LEU  11          HD11      LEU  11 -12.214   5.619   1.671
   77   2HD1  LEU  11          HD13      LEU  11 -11.076   4.325   2.045
   78   3HD1  LEU  11          HD12      LEU  11 -10.480   5.944   1.679
   79   1HD2  LEU  11          HD22      LEU  11 -13.163   4.140  -0.371
   80   2HD2  LEU  11          HD21      LEU  11 -11.927   3.274  -1.282
   81   3HD2  LEU  11          HD23      LEU  11 -12.113   2.983   0.447
   82    H    GLN  12           HN       GLN  12 -11.203   9.041  -2.224
   83    HA   GLN  12           HA       GLN  12 -10.098   8.268  -4.729
   84   1HB   GLN  12           HB2      GLN  12 -11.685   9.933  -4.972
   85   2HB   GLN  12           HB1      GLN  12 -11.118  10.825  -3.562
   86   1HG   GLN  12           HG2      GLN  12  -9.404  11.864  -4.739
   87   2HG   GLN  12           HG1      GLN  12  -9.325  10.585  -5.953
   88   1HE2  GLN  12          HE22      GLN  12 -12.149  11.869  -7.812
   89   2HE2  GLN  12          HE21      GLN  12 -11.410  10.407  -7.365
   90    H    GLU  13           HN       GLU  13  -8.813  10.655  -2.390
   91    HA   GLU  13           HA       GLU  13  -6.365  11.082  -3.813
   92   1HB   GLU  13           HB2      GLU  13  -7.518  11.861  -1.259
   93   2HB   GLU  13           HB1      GLU  13  -5.803  11.483  -1.095
   94   1HG   GLU  13           HG2      GLU  13  -5.769  13.751  -1.702
   95   2HG   GLU  13           HG1      GLU  13  -5.525  12.936  -3.247
   96    H    ILE  14           HN       ILE  14  -7.447   8.564  -1.646
   97    HA   ILE  14           HA       ILE  14  -4.828   7.548  -0.959
   98    HB   ILE  14           HB       ILE  14  -7.649   6.679  -0.676
   99   1HG1  ILE  14          HG12      ILE  14  -5.638   5.910   1.317
  100   2HG1  ILE  14          HG11      ILE  14  -5.641   7.637   0.960
  101   1HG2  ILE  14          HG21      ILE  14  -5.343   4.739  -0.919
  102   2HG2  ILE  14          HG23      ILE  14  -6.792   4.356   0.010
  103   3HG2  ILE  14          HG22      ILE  14  -6.912   4.672  -1.720
  104   1HD1  ILE  14          HD12      ILE  14  -8.146   6.062   1.604
  105   2HD1  ILE  14          HD11      ILE  14  -7.222   6.958   2.808
  106   3HD1  ILE  14          HD13      ILE  14  -7.992   7.814   1.472
  107    H    ILE  15           HN       ILE  15  -7.020   7.116  -3.659
  108    HA   ILE  15           HA       ILE  15  -5.716   4.771  -4.750
  109    HB   ILE  15           HB       ILE  15  -7.877   6.631  -5.509
  110   1HG1  ILE  15          HG12      ILE  15  -7.529   3.741  -6.313
  111   2HG1  ILE  15          HG11      ILE  15  -7.955   4.172  -4.655
  112   1HG2  ILE  15          HG21      ILE  15  -6.099   5.344  -7.589
  113   2HG2  ILE  15          HG23      ILE  15  -7.752   5.863  -7.921
  114   3HG2  ILE  15          HG22      ILE  15  -6.534   7.048  -7.448
  115   1HD1  ILE  15          HD12      ILE  15  -9.491   5.021  -7.129
  116   2HD1  ILE  15          HD11      ILE  15  -9.972   3.733  -6.025
  117   3HD1  ILE  15          HD13      ILE  15  -9.923   5.404  -5.462
  118    H    LYS  16           HN       LYS  16  -5.617   8.263  -5.489
  119    HA   LYS  16           HA       LYS  16  -3.721   8.162  -7.595
  120   1HB   LYS  16           HB2      LYS  16  -4.469  10.321  -7.382
  121   2HB   LYS  16           HB1      LYS  16  -4.608  10.204  -5.627
  122   1HG   LYS  16           HG2      LYS  16  -2.275  10.555  -5.314
  123   2HG   LYS  16           HG1      LYS  16  -1.927  10.277  -7.020
  124   1HD   LYS  16           HD2      LYS  16  -2.042  12.516  -7.286
  125   2HD   LYS  16           HD1      LYS  16  -3.783  12.354  -7.054
  126   1HE   LYS  16           HE2      LYS  16  -3.710  13.233  -4.959
  127   2HE   LYS  16           HE1      LYS  16  -2.222  12.378  -4.550
  128   1HZ   LYS  16           HZ1      LYS  16  -1.209  14.049  -6.255
  129   2HZ   LYS  16           HZ3      LYS  16  -2.573  14.977  -5.862
  130   3HZ   LYS  16           HZ2      LYS  16  -1.480  14.519  -4.645
  131    H    THR  17           HN       THR  17  -3.222   8.410  -4.081
  132    HA   THR  17           HA       THR  17  -0.381   8.490  -4.122
  133    HB   THR  17           HB       THR  17  -2.019   7.078  -2.008
  134    HG1  THR  17           HG1      THR  17  -2.781   8.936  -1.393
  135   1HG2  THR  17          HG21      THR  17   0.629   7.293  -2.149
  136   2HG2  THR  17          HG23      THR  17   0.295   8.893  -1.485
  137   3HG2  THR  17          HG22      THR  17  -0.220   7.450  -0.611
  138    H    LEU  18           HN       LEU  18  -2.675   5.827  -4.300
  139    HA   LEU  18           HA       LEU  18  -0.939   3.644  -3.923
  140   1HB   LEU  18           HB2      LEU  18  -3.547   3.817  -4.463
  141   2HB   LEU  18           HB1      LEU  18  -2.986   3.500  -6.103
  142    HG   LEU  18           HG       LEU  18  -3.519   1.385  -5.012
  143   1HD1  LEU  18          HD13      LEU  18  -1.334   1.792  -6.438
  144   2HD1  LEU  18          HD12      LEU  18  -0.524   1.454  -4.911
  145   3HD1  LEU  18          HD11      LEU  18  -1.590   0.249  -5.630
  146   1HD2  LEU  18          HD23      LEU  18  -2.578   2.669  -2.717
  147   2HD2  LEU  18          HD22      LEU  18  -3.070   0.979  -2.837
  148   3HD2  LEU  18          HD21      LEU  18  -1.374   1.420  -3.036
  149    H    ASN  19           HN       ASN  19  -1.776   5.291  -6.992
  150    HA   ASN  19           HA       ASN  19   0.006   3.793  -8.637
  151   1HB   ASN  19           HB2      ASN  19  -1.142   6.578  -8.907
  152   2HB   ASN  19           HB1      ASN  19  -0.152   5.830 -10.161
  153   1HD2  ASN  19          HD22      ASN  19  -2.894   4.058 -11.451
  154   2HD2  ASN  19          HD21      ASN  19  -1.387   4.792 -11.722
  155    H    SER  20           HN       SER  20   0.546   6.630  -6.607
  156    HA   SER  20           HA       SER  20   3.121   7.306  -7.711
  157   1HB   SER  20           HB2      SER  20   1.508   8.073  -5.367
  158   2HB   SER  20           HB1      SER  20   3.249   8.197  -5.130
  159    HG   SER  20           HG       SER  20   3.301   9.807  -6.486
  160    H    LEU  21           HN       LEU  21   2.068   4.981  -5.292
  161    HA   LEU  21           HA       LEU  21   4.672   4.520  -4.144
  162   1HB   LEU  21           HB2      LEU  21   2.002   3.287  -4.005
  163   2HB   LEU  21           HB1      LEU  21   3.329   2.140  -3.819
  164    HG   LEU  21           HG       LEU  21   4.098   4.340  -2.271
  165   1HD1  LEU  21          HD13      LEU  21   1.129   3.885  -2.217
  166   2HD1  LEU  21          HD12      LEU  21   1.968   4.344  -0.735
  167   3HD1  LEU  21          HD11      LEU  21   2.023   5.403  -2.144
  168   1HD2  LEU  21          HD22      LEU  21   3.146   1.560  -1.863
  169   2HD2  LEU  21          HD21      LEU  21   4.610   2.345  -1.272
  170   3HD2  LEU  21          HD23      LEU  21   3.075   2.604  -0.443
  171    H    THR  22           HN       THR  22   3.352   3.704  -7.203
  172    HA   THR  22           HA       THR  22   5.078   1.337  -7.538
  173    HB   THR  22           HB       THR  22   3.538   2.626  -9.770
  174    HG1  THR  22           HG1      THR  22   1.819   1.125  -8.892
  175   1HG2  THR  22          HG23      THR  22   5.009   0.266  -9.431
  176   2HG2  THR  22          HG22      THR  22   3.321  -0.244  -9.388
  177   3HG2  THR  22          HG21      THR  22   3.936   0.652 -10.776
  178    H    GLU  23           HN       GLU  23   6.046   4.308  -7.266
  179    HA   GLU  23           HA       GLU  23   7.274   4.839  -9.853
  180   1HB   GLU  23           HB2      GLU  23   6.746   6.707  -8.372
  181   2HB   GLU  23           HB1      GLU  23   7.768   6.026  -7.106
  182   1HG   GLU  23           HG2      GLU  23   9.661   6.826  -8.056
  183   2HG   GLU  23           HG1      GLU  23   9.162   6.314  -9.669
  184    H    GLN  24           HN       GLN  24   8.353   3.548  -6.724
  185    HA   GLN  24           HA       GLN  24  11.031   2.992  -7.862
  186   1HB   GLN  24           HB2      GLN  24  10.431   3.820  -5.416
  187   2HB   GLN  24           HB1      GLN  24  10.206   2.094  -5.130
  188   1HG   GLN  24           HG2      GLN  24  12.446   1.587  -5.657
  189   2HG   GLN  24           HG1      GLN  24  12.685   3.115  -6.505
  190   1HE2  GLN  24          HE22      GLN  24  14.331   3.543  -3.223
  191   2HE2  GLN  24          HE21      GLN  24  14.589   2.634  -4.633
  192    H    LYS  25           HN       LYS  25   9.479   1.534  -9.346
  193    HA   LYS  25           HA       LYS  25   9.048  -1.118  -8.091
  194   1HB   LYS  25           HB2      LYS  25   7.253  -0.156  -9.514
  195   2HB   LYS  25           HB1      LYS  25   8.366  -0.149 -10.883
  196   1HG   LYS  25           HG2      LYS  25   8.570  -2.743  -9.917
  197   2HG   LYS  25           HG1      LYS  25   6.855  -2.377  -9.730
  198   1HD   LYS  25           HD2      LYS  25   8.298  -1.727 -12.296
  199   2HD   LYS  25           HD1      LYS  25   7.655  -3.344 -12.006
  200   1HE   LYS  25           HE2      LYS  25   5.657  -1.419 -11.276
  201   2HE   LYS  25           HE1      LYS  25   6.241  -1.042 -12.897
  202   1HZ   LYS  25           HZ2      LYS  25   5.360  -3.734 -12.002
  203   2HZ   LYS  25           HZ1      LYS  25   4.398  -2.648 -12.887
  204   3HZ   LYS  25           HZ3      LYS  25   5.808  -3.287 -13.579
  205    H    THR  26           HN       THR  26  11.651  -0.934  -8.045
  206    HA   THR  26           HA       THR  26  12.550  -2.787 -10.111
  207    HB   THR  26           HB       THR  26  14.003  -0.143  -9.973
  208    HG1  THR  26           HG1      THR  26  12.889   0.379 -11.873
  209   1HG2  THR  26          HG21      THR  26  15.083  -2.299 -10.837
  210   2HG2  THR  26          HG23      THR  26  13.936  -2.211 -12.174
  211   3HG2  THR  26          HG22      THR  26  15.110  -0.917 -11.933
  212    H    LEU  27           HN       LEU  27  14.029  -0.390  -7.874
  213    HA   LEU  27           HA       LEU  27  15.913  -2.476  -6.981
  214   1HB   LEU  27           HB2      LEU  27  15.919   0.388  -7.124
  215   2HB   LEU  27           HB1      LEU  27  16.234  -0.104  -5.459
  216    HG   LEU  27           HG       LEU  27  17.831  -1.865  -6.670
  217   1HD1  LEU  27          HD13      LEU  27  17.570   0.448  -8.606
  218   2HD1  LEU  27          HD12      LEU  27  18.949  -0.650  -8.598
  219   3HD1  LEU  27          HD11      LEU  27  17.332  -1.267  -8.943
  220   1HD2  LEU  27          HD22      LEU  27  18.341   0.072  -5.034
  221   2HD2  LEU  27          HD21      LEU  27  19.648  -0.453  -6.095
  222   3HD2  LEU  27          HD23      LEU  27  18.739   1.010  -6.474
  223    H    CYS  28           HN       CYS  28  13.166  -0.667  -5.675
  224    HA   CYS  28           HA       CYS  28  13.610  -1.845  -3.005
  225   1HB   CYS  28           HB2      CYS  28  12.440   0.518  -3.909
  226   2HB   CYS  28           HB1      CYS  28  11.076  -0.456  -3.358
  227    H    THR  29           HN       THR  29  11.605  -2.404  -5.814
  228    HA   THR  29           HA       THR  29   9.805  -4.188  -4.298
  229    HB   THR  29           HB       THR  29   8.793  -4.576  -6.599
  230    HG1  THR  29           HG1      THR  29  10.364  -2.359  -7.328
  231   1HG2  THR  29          HG22      THR  29   8.251  -2.698  -4.814
  232   2HG2  THR  29          HG21      THR  29   8.885  -1.632  -6.068
  233   3HG2  THR  29          HG23      THR  29   7.497  -2.667  -6.408
  234    H    GLU  30           HN       GLU  30  12.875  -4.640  -5.163
  235    HA   GLU  30           HA       GLU  30  12.606  -7.152  -6.648
  236   1HB   GLU  30           HB2      GLU  30  15.059  -7.287  -6.392
  237   2HB   GLU  30           HB1      GLU  30  14.570  -5.705  -7.001
  238   1HG   GLU  30           HG2      GLU  30  15.691  -4.782  -5.280
  239   2HG   GLU  30           HG1      GLU  30  14.480  -5.475  -4.201
  240    H    LEU  31           HN       LEU  31  12.402  -6.275  -3.332
  241    HA   LEU  31           HA       LEU  31  13.491  -8.765  -2.312
  242   1HB   LEU  31           HB2      LEU  31  11.681  -6.709  -0.998
  243   2HB   LEU  31           HB1      LEU  31  12.509  -8.023  -0.162
  244    HG   LEU  31           HG       LEU  31  14.374  -6.536  -1.807
  245   1HD1  LEU  31          HD13      LEU  31  12.408  -4.859  -0.926
  246   2HD1  LEU  31          HD12      LEU  31  13.515  -4.823   0.447
  247   3HD1  LEU  31          HD11      LEU  31  14.086  -4.369  -1.158
  248   1HD2  LEU  31          HD22      LEU  31  14.913  -8.040   0.104
  249   2HD2  LEU  31          HD21      LEU  31  15.597  -6.428   0.313
  250   3HD2  LEU  31          HD23      LEU  31  14.143  -6.891   1.197
  251    H    THR  32           HN       THR  32  10.377  -8.235  -0.948
  252    HA   THR  32           HA       THR  32   8.798  -9.651  -2.873
  253    HB   THR  32           HB       THR  32   8.664 -11.681  -1.040
  254    HG1  THR  32           HG1      THR  32  10.697 -12.145  -0.369
  255   1HG2  THR  32          HG21      THR  32   9.217 -11.416  -3.691
  256   2HG2  THR  32          HG23      THR  32  10.775 -11.990  -3.097
  257   3HG2  THR  32          HG22      THR  32   9.319 -12.948  -2.824
  258    H    VAL  33           HN       VAL  33   6.870 -10.808  -1.392
  259    HA   VAL  33           HA       VAL  33   6.183  -9.509   1.061
  260    HB   VAL  33           HB       VAL  33   5.822  -7.462  -0.019
  261   1HG1  VAL  33          HG13      VAL  33   4.968  -9.181  -2.342
  262   2HG1  VAL  33          HG12      VAL  33   4.513  -7.478  -2.274
  263   3HG1  VAL  33          HG11      VAL  33   6.216  -7.935  -2.290
  264   1HG2  VAL  33          HG22      VAL  33   3.740  -8.514   1.116
  265   2HG2  VAL  33          HG21      VAL  33   3.484  -7.120   0.067
  266   3HG2  VAL  33          HG23      VAL  33   3.137  -8.744  -0.526
  267    H    THR  34           HN       THR  34   4.220 -10.379   1.891
  268    HA   THR  34           HA       THR  34   3.436 -12.921   0.951
  269    HB   THR  34           HB       THR  34   2.637 -11.113   3.040
  270    HG1  THR  34           HG1      THR  34   2.785 -12.957   3.992
  271   1HG2  THR  34          HG23      THR  34   0.344 -12.491   1.606
  272   2HG2  THR  34          HG22      THR  34   0.240 -11.712   3.183
  273   3HG2  THR  34          HG21      THR  34   0.577 -10.747   1.748
  274    H    ASP  35           HN       ASP  35   1.719 -13.631  -0.357
  275    HA   ASP  35           HA       ASP  35   0.691 -11.601  -2.254
  276   1HB   ASP  35           HB2      ASP  35   1.648 -14.081  -2.727
  277   2HB   ASP  35           HB1      ASP  35  -0.048 -14.485  -2.496
  278    H    ILE  36           HN       ILE  36  -0.847 -10.610  -0.734
  279    HA   ILE  36           HA       ILE  36  -2.883 -12.191   0.553
  280    HB   ILE  36           HB       ILE  36  -4.012 -10.063   0.984
  281   1HG1  ILE  36          HG12      ILE  36  -1.896  -8.738  -0.731
  282   2HG1  ILE  36          HG11      ILE  36  -3.501  -9.135  -1.347
  283   1HG2  ILE  36          HG21      ILE  36  -1.827 -10.785   2.161
  284   2HG2  ILE  36          HG23      ILE  36  -1.053  -9.526   1.198
  285   3HG2  ILE  36          HG22      ILE  36  -2.333  -9.104   2.336
  286   1HD1  ILE  36          HD13      ILE  36  -3.474  -7.727   1.253
  287   2HD1  ILE  36          HD12      ILE  36  -2.898  -6.778  -0.117
  288   3HD1  ILE  36          HD11      ILE  36  -4.514  -7.482  -0.150
  289    H    PHE  37           HN       PHE  37  -2.493 -11.071  -2.708
  290    HA   PHE  37           HA       PHE  37  -5.379 -11.517  -3.278
  291   1HB   PHE  37           HB2      PHE  37  -3.244 -10.635  -5.232
  292   2HB   PHE  37           HB1      PHE  37  -4.991 -10.466  -5.392
  293    HD1  PHE  37           HD2      PHE  37  -5.997  -9.320  -3.034
  294    HD2  PHE  37           HD1      PHE  37  -2.182  -8.607  -4.871
  295    HE1  PHE  37           HE2      PHE  37  -5.884  -7.096  -1.944
  296    HE2  PHE  37           HE1      PHE  37  -2.069  -6.384  -3.785
  297    HZ   PHE  37           HZ       PHE  37  -3.926  -5.626  -2.320
  298    H    ALA  38           HN       ALA  38  -3.502 -13.717  -2.600
  299    HA   ALA  38           HA       ALA  38  -3.269 -15.120  -5.210
  300   1HB   ALA  38           HB2      ALA  38  -1.901 -15.287  -2.601
  301   2HB   ALA  38           HB1      ALA  38  -2.240 -16.846  -3.352
  302   3HB   ALA  38           HB3      ALA  38  -1.288 -15.639  -4.217
  303    H    ALA  39           HN       ALA  39  -4.790 -15.421  -2.024
  304    HA   ALA  39           HA       ALA  39  -6.788 -17.238  -3.237
  305   1HB   ALA  39           HB3      ALA  39  -4.936 -17.959  -0.972
  306   2HB   ALA  39           HB2      ALA  39  -6.536 -18.691  -1.091
  307   3HB   ALA  39           HB1      ALA  39  -5.367 -18.911  -2.392
  308    H    SER  40           HN       SER  40  -7.799 -14.983  -2.825
  309    HA   SER  40           HA       SER  40  -8.491 -14.478  -0.002
  310   1HB   SER  40           HB2      SER  40  -9.726 -12.526  -0.932
  311   2HB   SER  40           HB1      SER  40  -8.042 -12.551  -1.445
  312    HG   SER  40           HG       SER  40  -9.507 -12.162  -3.178
  313    H    LYS  41           HN       LYS  41  -9.826 -16.229   0.582
  314    HA   LYS  41           HA       LYS  41 -11.863 -17.404  -0.965
  315   1HB   LYS  41           HB2      LYS  41 -10.919 -17.850   1.523
  316   2HB   LYS  41           HB1      LYS  41 -12.430 -17.037   1.932
  317   1HG   LYS  41           HG2      LYS  41 -12.328 -19.307  -0.059
  318   2HG   LYS  41           HG1      LYS  41 -12.539 -19.590   1.669
  319   1HD   LYS  41           HD2      LYS  41 -14.469 -17.895   1.541
  320   2HD   LYS  41           HD1      LYS  41 -14.362 -18.082  -0.210
  321   1HE   LYS  41           HE2      LYS  41 -14.352 -20.692   0.586
  322   2HE   LYS  41           HE1      LYS  41 -15.375 -19.969   1.828
  323   1HZ   LYS  41           HZ3      LYS  41 -15.774 -19.458  -1.062
  324   2HZ   LYS  41           HZ2      LYS  41 -16.530 -20.746  -0.251
  325   3HZ   LYS  41           HZ1      LYS  41 -16.847 -19.142   0.214
  326    H    ASP  42           HN       ASP  42 -12.513 -15.057   1.670
  327    HA   ASP  42           HA       ASP  42 -14.272 -13.490  -0.057
  328   1HB   ASP  42           HB2      ASP  42 -15.354 -15.513   1.865
  329   2HB   ASP  42           HB1      ASP  42 -16.204 -13.976   1.705
  330    H    THR  43           HN       THR  43 -12.344 -12.230   1.012
  331    HA   THR  43           HA       THR  43 -12.839 -11.443   3.803
  332    HB   THR  43           HB       THR  43 -10.958  -9.801   2.255
  333    HG1  THR  43           HG1      THR  43 -10.533 -12.592   2.522
  334   1HG2  THR  43          HG23      THR  43 -10.675 -11.595   4.682
  335   2HG2  THR  43          HG22      THR  43  -9.484 -10.417   4.132
  336   3HG2  THR  43          HG21      THR  43 -11.057  -9.874   4.718
  337    H    THR  44           HN       THR  44 -12.659  -8.853   4.068
  338    HA   THR  44           HA       THR  44 -14.835  -7.762   2.346
  339    HB   THR  44           HB       THR  44 -14.144  -6.195   4.714
  340    HG1  THR  44           HG1      THR  44 -15.151  -8.816   5.085
  341   1HG2  THR  44          HG21      THR  44 -16.257  -6.237   3.188
  342   2HG2  THR  44          HG23      THR  44 -16.734  -7.624   4.167
  343   3HG2  THR  44          HG22      THR  44 -16.477  -6.055   4.929
  344    H    GLU  45           HN       GLU  45 -14.656  -5.266   2.115
  345    HA   GLU  45           HA       GLU  45 -12.096  -4.724   0.847
  346   1HB   GLU  45           HB2      GLU  45 -13.068  -2.473   0.392
  347   2HB   GLU  45           HB1      GLU  45 -14.134  -3.780  -0.118
  348   1HG   GLU  45           HG2      GLU  45 -14.926  -3.367   2.494
  349   2HG   GLU  45           HG1      GLU  45 -14.541  -1.734   1.954
  350    H    LYS  46           HN       LYS  46 -13.638  -3.867   3.904
  351    HA   LYS  46           HA       LYS  46 -11.581  -1.928   4.614
  352   1HB   LYS  46           HB2      LYS  46 -12.625  -2.063   6.889
  353   2HB   LYS  46           HB1      LYS  46 -13.778  -1.684   5.612
  354   1HG   LYS  46           HG2      LYS  46 -15.002  -3.461   6.244
  355   2HG   LYS  46           HG1      LYS  46 -13.663  -4.513   5.788
  356   1HD   LYS  46           HD2      LYS  46 -14.195  -4.940   8.114
  357   2HD   LYS  46           HD1      LYS  46 -12.649  -4.093   8.050
  358   1HE   LYS  46           HE2      LYS  46 -13.608  -2.696   9.569
  359   2HE   LYS  46           HE1      LYS  46 -14.393  -1.991   8.156
  360   1HZ   LYS  46           HZ3      LYS  46 -15.518  -4.208   9.779
  361   2HZ   LYS  46           HZ2      LYS  46 -15.962  -2.576   9.935
  362   3HZ   LYS  46           HZ1      LYS  46 -16.281  -3.412   8.491
  363    H    GLU  47           HN       GLU  47 -12.082  -5.378   5.020
  364    HA   GLU  47           HA       GLU  47  -9.968  -5.710   6.993
  365   1HB   GLU  47           HB2      GLU  47 -11.994  -7.305   6.267
  366   2HB   GLU  47           HB1      GLU  47 -10.765  -7.947   5.177
  367   1HG   GLU  47           HG2      GLU  47  -9.307  -8.496   6.989
  368   2HG   GLU  47           HG1      GLU  47 -10.272  -7.565   8.136
  369    H    THR  48           HN       THR  48 -10.228  -5.707   3.488
  370    HA   THR  48           HA       THR  48  -7.568  -6.770   3.020
  371    HB   THR  48           HB       THR  48  -9.322  -5.107   1.187
  372    HG1  THR  48           HG1      THR  48 -10.126  -7.040   0.505
  373   1HG2  THR  48          HG21      THR  48  -6.929  -6.900   0.716
  374   2HG2  THR  48          HG23      THR  48  -7.994  -6.343  -0.575
  375   3HG2  THR  48          HG22      THR  48  -7.062  -5.177   0.364
  376    H    PHE  49           HN       PHE  49  -8.942  -3.564   3.516
  377    HA   PHE  49           HA       PHE  49  -6.628  -2.094   2.615
  378   1HB   PHE  49           HB2      PHE  49  -8.893  -1.382   4.495
  379   2HB   PHE  49           HB1      PHE  49  -7.622  -0.243   4.062
  380    HD1  PHE  49           HD2      PHE  49  -7.188  -0.939   1.178
  381    HD2  PHE  49           HD1      PHE  49 -10.811  -0.516   3.450
  382    HE1  PHE  49           HE2      PHE  49  -8.428  -0.401  -0.895
  383    HE2  PHE  49           HE1      PHE  49 -12.048   0.026   1.374
  384    HZ   PHE  49           HZ       PHE  49 -10.858   0.081  -0.799
  385    H    CYS  50           HN       CYS  50  -7.697  -3.214   5.831
  386    HA   CYS  50           HA       CYS  50  -5.466  -2.085   7.245
  387   1HB   CYS  50           HB2      CYS  50  -7.350  -2.711   8.555
  388   2HB   CYS  50           HB1      CYS  50  -7.378  -4.339   7.877
  389    NH1  ARG  51           NH2      ARG  51  -6.058 -12.175   5.478
  390    NH2  ARG  51           NH1      ARG  51  -5.919 -12.265   3.226
  391    H    ARG  51           HN       ARG  51  -5.982  -5.287   5.764
  392    HA   ARG  51           HA       ARG  51  -3.617  -6.529   6.734
  393   1HB   ARG  51           HB2      ARG  51  -5.629  -7.428   5.236
  394   2HB   ARG  51           HB1      ARG  51  -4.512  -7.054   3.923
  395   1HG   ARG  51           HG2      ARG  51  -3.219  -8.840   4.400
  396   2HG   ARG  51           HG1      ARG  51  -3.170  -8.428   6.114
  397   1HD   ARG  51           HD2      ARG  51  -4.368 -10.379   6.294
  398   2HD   ARG  51           HD1      ARG  51  -5.716  -9.294   5.957
  399    HE   ARG  51           HE       ARG  51  -4.823 -10.083   3.446
  400   1HH1  ARG  51          HH21      ARG  51  -5.890 -11.708   6.345
  401   2HH1  ARG  51          HH22      ARG  51  -6.513 -13.065   5.476
  402   1HH2  ARG  51          HH11      ARG  51  -5.641 -11.860   2.355
  403   2HH2  ARG  51          HH12      ARG  51  -6.376 -13.155   3.240
  404    H    ALA  52           HN       ALA  52  -4.110  -4.954   3.557
  405    HA   ALA  52           HA       ALA  52  -1.333  -4.931   2.874
  406   1HB   ALA  52           HB1      ALA  52  -3.800  -3.606   1.873
  407   2HB   ALA  52           HB3      ALA  52  -2.266  -2.848   1.446
  408   3HB   ALA  52           HB2      ALA  52  -2.578  -4.524   0.992
  409    H    ALA  53           HN       ALA  53  -3.140  -2.990   5.102
  410    HA   ALA  53           HA       ALA  53  -1.422  -0.647   4.948
  411   1HB   ALA  53           HB3      ALA  53  -3.754  -0.568   5.843
  412   2HB   ALA  53           HB2      ALA  53  -3.229  -1.548   7.213
  413   3HB   ALA  53           HB1      ALA  53  -2.568   0.071   6.982
  414    H    THR  54           HN       THR  54  -1.467  -3.652   6.781
  415    HA   THR  54           HA       THR  54   0.601  -2.847   8.654
  416    HB   THR  54           HB       THR  54  -0.699  -5.448   7.888
  417    HG1  THR  54           HG1      THR  54  -1.640  -5.091   9.720
  418   1HG2  THR  54          HG21      THR  54   1.908  -5.063   9.353
  419   2HG2  THR  54          HG23      THR  54   0.871  -6.450   9.686
  420   3HG2  THR  54          HG22      THR  54   1.527  -6.209   8.068
  421    H    VAL  55           HN       VAL  55   0.518  -4.766   5.653
  422    HA   VAL  55           HA       VAL  55   3.291  -5.399   5.553
  423    HB   VAL  55           HB       VAL  55   1.531  -4.787   3.158
  424   1HG1  VAL  55          HG11      VAL  55   4.160  -5.387   3.195
  425   2HG1  VAL  55          HG13      VAL  55   3.499  -7.021   3.258
  426   3HG1  VAL  55          HG12      VAL  55   3.079  -5.951   1.920
  427   1HG2  VAL  55          HG22      VAL  55   1.352  -6.893   5.205
  428   2HG2  VAL  55          HG21      VAL  55   0.165  -6.398   3.998
  429   3HG2  VAL  55          HG23      VAL  55   1.453  -7.520   3.560
  430    H    LEU  56           HN       LEU  56   1.488  -2.567   4.411
  431    HA   LEU  56           HA       LEU  56   3.738  -1.235   3.216
  432   1HB   LEU  56           HB2      LEU  56   0.947  -0.623   3.816
  433   2HB   LEU  56           HB1      LEU  56   1.999   0.765   4.097
  434    HG   LEU  56           HG       LEU  56   3.020   0.271   1.802
  435   1HD1  LEU  56          HD12      LEU  56   1.797  -2.069   1.886
  436   2HD1  LEU  56          HD11      LEU  56   0.444  -1.155   1.220
  437   3HD1  LEU  56          HD13      LEU  56   1.977  -1.222   0.350
  438   1HD2  LEU  56          HD21      LEU  56   0.831   1.789   2.585
  439   2HD2  LEU  56          HD23      LEU  56   1.652   1.905   1.028
  440   3HD2  LEU  56          HD22      LEU  56   0.219   0.891   1.196
  441    NH1  ARG  57           NH2      ARG  57   2.012  -2.270  13.399
  442    NH2  ARG  57           NH1      ARG  57   1.051  -0.307  13.970
  443    H    ARG  57           HN       ARG  57   2.494  -1.455   6.496
  444    HA   ARG  57           HA       ARG  57   3.852   0.762   7.644
  445   1HB   ARG  57           HB2      ARG  57   2.141  -0.622   8.826
  446   2HB   ARG  57           HB1      ARG  57   3.321  -1.929   8.938
  447   1HG   ARG  57           HG2      ARG  57   4.860  -0.132  10.036
  448   2HG   ARG  57           HG1      ARG  57   3.362   0.765  10.285
  449   1HD   ARG  57           HD2      ARG  57   3.018  -2.010  11.039
  450   2HD   ARG  57           HD1      ARG  57   4.379  -1.297  11.905
  451    HE   ARG  57           HE       ARG  57   2.390   0.609  12.133
  452   1HH1  ARG  57          HH21      ARG  57   2.630  -2.804  12.826
  453   2HH1  ARG  57          HH22      ARG  57   1.499  -2.722  14.128
  454   1HH2  ARG  57          HH11      ARG  57   0.932   0.676  13.830
  455   2HH2  ARG  57          HH12      ARG  57   0.546  -0.774  14.696
  456    H    GLN  58           HN       GLN  58   4.885  -2.673   7.597
  457    HA   GLN  58           HA       GLN  58   7.513  -2.177   8.569
  458   1HB   GLN  58           HB2      GLN  58   6.043  -4.409   7.546
  459   2HB   GLN  58           HB1      GLN  58   7.600  -4.350   6.717
  460   1HG   GLN  58           HG2      GLN  58   7.358  -4.087   9.719
  461   2HG   GLN  58           HG1      GLN  58   7.556  -5.648   8.921
  462   1HE2  GLN  58          HE22      GLN  58  10.976  -5.102   8.106
  463   2HE2  GLN  58          HE21      GLN  58   9.609  -6.066   7.815
  464    H    PHE  59           HN       PHE  59   6.098  -1.736   5.400
  465    HA   PHE  59           HA       PHE  59   8.584  -1.685   3.942
  466   1HB   PHE  59           HB2      PHE  59   6.411  -2.065   2.844
  467   2HB   PHE  59           HB1      PHE  59   5.906  -0.433   3.274
  468    HD1  PHE  59           HD1      PHE  59   9.298  -1.500   2.143
  469    HD2  PHE  59           HD2      PHE  59   5.671   0.568   1.132
  470    HE1  PHE  59           HE1      PHE  59  10.367  -0.632   0.087
  471    HE2  PHE  59           HE2      PHE  59   6.744   1.438  -0.926
  472    HZ   PHE  59           HZ       PHE  59   9.092   0.837  -1.449
  473    OH   TYR  60           OH       TYR  60   6.099   4.527  11.284
  474    H    TYR  60           HN       TYR  60   6.748   0.803   5.684
  475    HA   TYR  60           HA       TYR  60   8.590   2.880   4.672
  476   1HB   TYR  60           HB2      TYR  60   6.976   4.381   5.213
  477   2HB   TYR  60           HB1      TYR  60   5.932   2.969   5.356
  478    HD1  TYR  60           HD1      TYR  60   7.900   5.480   7.207
  479    HD2  TYR  60           HD2      TYR  60   5.323   2.064   7.531
  480    HE1  TYR  60           HE1      TYR  60   7.582   5.949   9.622
  481    HE2  TYR  60           HE2      TYR  60   5.008   2.527   9.946
  482    HH   TYR  60           HH       TYR  60   5.516   3.853  11.642
  483    H    SER  61           HN       SER  61   8.521   0.708   7.293
  484    HA   SER  61           HA       SER  61   9.912   2.553   9.122
  485   1HB   SER  61           HB2      SER  61   8.521   0.016   9.333
  486   2HB   SER  61           HB1      SER  61  10.077  -0.040  10.156
  487    HG   SER  61           HG       SER  61   7.865   1.647  10.585
  488    H    HIS  62           HN       HIS  62  10.728  -0.637   7.668
  489    HA   HIS  62           HA       HIS  62  13.560  -0.135   8.327
  490   1HB   HIS  62           HB2      HIS  62  11.903  -2.470   7.757
  491   2HB   HIS  62           HB1      HIS  62  13.470  -2.530   6.951
  492    HD1  HIS  62           HD1      HIS  62  12.033  -1.924  10.428
  493    HD2  HIS  62           HD2      HIS  62  15.572  -3.204   8.633
  494    HE1  HIS  62           HE1      HIS  62  13.562  -2.664  12.306
  495    H    HIS  63           HN       HIS  63  11.676  -0.733   5.324
  496    HA   HIS  63           HA       HIS  63  13.953  -0.675   3.610
  497   1HB   HIS  63           HB2      HIS  63  11.067  -0.004   3.030
  498   2HB   HIS  63           HB1      HIS  63  12.307  -0.141   1.791
  499    HD1  HIS  63           HD1      HIS  63  11.914  -2.342   0.677
  500    HD2  HIS  63           HD2      HIS  63  11.611  -2.645   4.824
  501    HE1  HIS  63           HE1      HIS  63  11.584  -4.799   1.194
  502    H    GLU  64           HN       GLU  64  12.354   1.949   5.225
  503    HA   GLU  64           HA       GLU  64  13.218   3.975   3.310
  504   1HB   GLU  64           HB2      GLU  64  12.549   5.594   5.063
  505   2HB   GLU  64           HB1      GLU  64  11.284   4.403   4.763
  506   1HG   GLU  64           HG2      GLU  64  11.739   3.238   6.757
  507   2HG   GLU  64           HG1      GLU  64  13.328   3.972   6.932
  508    H    LYS  65           HN       LYS  65  14.592   2.409   6.127
  509    HA   LYS  65           HA       LYS  65  16.960   4.224   5.924
  510   1HB   LYS  65           HB2      LYS  65  15.502   3.098   8.189
  511   2HB   LYS  65           HB1      LYS  65  17.230   2.755   8.275
  512   1HG   LYS  65           HG2      LYS  65  17.750   4.920   8.684
  513   2HG   LYS  65           HG1      LYS  65  16.648   5.505   7.437
  514   1HD   LYS  65           HD2      LYS  65  15.058   5.984   8.961
  515   2HD   LYS  65           HD1      LYS  65  15.184   4.380   9.683
  516   1HE   LYS  65           HE2      LYS  65  16.533   5.112  11.355
  517   2HE   LYS  65           HE1      LYS  65  17.480   6.125  10.265
  518   1HZ   LYS  65           HZ3      LYS  65  14.767   6.796  11.268
  519   2HZ   LYS  65           HZ2      LYS  65  16.215   7.413  11.908
  520   3HZ   LYS  65           HZ1      LYS  65  15.762   7.784  10.313
  521    H    ASP  66           HN       ASP  66  16.099   1.424   4.607
  522    HA   ASP  66           HA       ASP  66  18.430  -0.186   5.438
  523   1HB   ASP  66           HB2      ASP  66  15.961  -0.646   3.840
  524   2HB   ASP  66           HB1      ASP  66  17.380  -1.592   3.390
  525    H    THR  67           HN       THR  67  20.085  -0.815   3.920
  526    HA   THR  67           HA       THR  67  20.700   1.303   1.979
  527    HB   THR  67           HB       THR  67  22.873   0.333   1.858
  528    HG1  THR  67           HG1      THR  67  22.778  -1.756   1.624
  529   1HG2  THR  67          HG22      THR  67  22.283   1.372   4.051
  530   2HG2  THR  67          HG21      THR  67  21.849  -0.227   4.654
  531   3HG2  THR  67          HG23      THR  67  23.516   0.120   4.196
  532    NH1  ARG  68           NH2      ARG  68  21.722  -5.317  -0.171
  533    NH2  ARG  68           NH1      ARG  68  22.747  -6.774   1.215
  534    H    ARG  68           HN       ARG  68  19.518  -1.995   1.949
  535    HA   ARG  68           HA       ARG  68  20.143  -2.764  -0.691
  536   1HB   ARG  68           HB2      ARG  68  17.557  -3.316   0.797
  537   2HB   ARG  68           HB1      ARG  68  18.197  -4.244  -0.559
  538   1HG   ARG  68           HG2      ARG  68  20.317  -4.165   1.244
  539   2HG   ARG  68           HG1      ARG  68  18.903  -4.374   2.271
  540   1HD   ARG  68           HD2      ARG  68  18.422  -6.443   1.428
  541   2HD   ARG  68           HD1      ARG  68  18.978  -6.040  -0.193
  542    HE   ARG  68           HE       ARG  68  20.473  -7.416   1.832
  543   1HH1  ARG  68          HH21      ARG  68  20.892  -4.928  -0.565
  544   2HH1  ARG  68          HH22      ARG  68  22.617  -5.008  -0.495
  545   1HH2  ARG  68          HH11      ARG  68  22.700  -7.506   1.894
  546   2HH2  ARG  68          HH12      ARG  68  23.635  -6.456   0.883
  547    H    CYS  69           HN       CYS  69  17.544  -0.655   0.494
  548    HA   CYS  69           HA       CYS  69  16.493  -0.331  -2.247
  549   1HB   CYS  69           HB2      CYS  69  15.013  -0.454  -0.177
  550   2HB   CYS  69           HB1      CYS  69  15.618   1.149   0.244
  551    H    LEU  70           HN       LEU  70  18.646   1.311  -0.048
  552    HA   LEU  70           HA       LEU  70  18.469   3.975  -0.948
  553   1HB   LEU  70           HB2      LEU  70  20.595   2.283   0.253
  554   2HB   LEU  70           HB1      LEU  70  21.142   3.738  -0.578
  555    HG   LEU  70           HG       LEU  70  18.954   3.727   1.517
  556   1HD1  LEU  70          HD12      LEU  70  21.864   3.633   1.767
  557   2HD1  LEU  70          HD11      LEU  70  21.175   5.064   2.534
  558   3HD1  LEU  70          HD13      LEU  70  20.628   3.458   3.013
  559   1HD2  LEU  70          HD21      LEU  70  20.003   5.676  -0.357
  560   2HD2  LEU  70          HD23      LEU  70  18.628   5.819   0.738
  561   3HD2  LEU  70          HD22      LEU  70  20.250   6.220   1.302
  562    H    GLY  71           HN       GLY  71  21.153   1.883  -2.002
  563   1HA   GLY  71           HA2      GLY  71  21.417   1.335  -4.426
  564   2HA   GLY  71           HA1      GLY  71  20.738   2.925  -4.776
  565    H    ALA  72           HN       ALA  72  22.341   4.215  -5.543
  566    HA   ALA  72           HA       ALA  72  24.650   4.811  -3.892
  567   1HB   ALA  72           HB1      ALA  72  25.188   2.595  -5.157
  568   2HB   ALA  72           HB3      ALA  72  25.343   3.631  -6.576
  569   3HB   ALA  72           HB2      ALA  72  26.387   3.887  -5.177
  570    H    THR  73           HN       THR  73  23.020   6.691  -4.517
  571    HA   THR  73           HA       THR  73  24.431   8.311  -6.517
  572    HB   THR  73           HB       THR  73  21.472   8.178  -6.914
  573    HG1  THR  73           HG1      THR  73  22.051   6.020  -6.985
  574   1HG2  THR  73          HG22      THR  73  23.894   9.093  -8.317
  575   2HG2  THR  73          HG21      THR  73  22.723   8.275  -9.353
  576   3HG2  THR  73          HG23      THR  73  22.238   9.691  -8.420
  577    H    ALA  74           HN       ALA  74  23.879  10.575  -6.317
  578    HA   ALA  74           HA       ALA  74  23.027  11.289  -3.618
  579   1HB   ALA  74           HB2      ALA  74  24.302  12.625  -5.910
  580   2HB   ALA  74           HB1      ALA  74  23.191  13.659  -5.013
  581   3HB   ALA  74           HB3      ALA  74  24.540  12.886  -4.182
  582    H    GLN  75           HN       GLN  75  21.592  11.261  -6.824
  583    HA   GLN  75           HA       GLN  75  19.309  12.912  -6.027
  584   1HB   GLN  75           HB2      GLN  75  19.759  11.174  -8.473
  585   2HB   GLN  75           HB1      GLN  75  18.409  12.289  -8.256
  586   1HG   GLN  75           HG2      GLN  75  20.653  13.837  -7.673
  587   2HG   GLN  75           HG1      GLN  75  21.161  12.852  -9.046
  588   1HE2  GLN  75          HE22      GLN  75  19.311  14.786 -11.321
  589   2HE2  GLN  75          HE21      GLN  75  20.604  13.721 -11.045
  590    H    GLN  76           HN       GLN  76  20.073   9.480  -6.212
  591    HA   GLN  76           HA       GLN  76  17.402   8.474  -6.039
  592   1HB   GLN  76           HB2      GLN  76  19.770   7.278  -6.378
  593   2HB   GLN  76           HB1      GLN  76  19.608   7.029  -4.639
  594   1HG   GLN  76           HG2      GLN  76  17.766   5.657  -4.863
  595   2HG   GLN  76           HG1      GLN  76  17.232   6.441  -6.350
  596   1HE2  GLN  76          HE22      GLN  76  18.576   3.151  -7.387
  597   2HE2  GLN  76          HE21      GLN  76  17.242   3.721  -6.506
  598    H    PHE  77           HN       PHE  77  19.511   9.906  -3.645
  599    HA   PHE  77           HA       PHE  77  18.120   8.841  -1.336
  600   1HB   PHE  77           HB2      PHE  77  20.440   9.703  -1.215
  601   2HB   PHE  77           HB1      PHE  77  19.848  11.322  -1.586
  602    HD1  PHE  77           HD1      PHE  77  19.315   8.505   0.832
  603    HD2  PHE  77           HD2      PHE  77  19.210  12.747   0.159
  604    HE1  PHE  77           HE1      PHE  77  18.811   8.874   3.231
  605    HE2  PHE  77           HE2      PHE  77  18.706  13.114   2.560
  606    HZ   PHE  77           HZ       PHE  77  18.506  11.178   4.096
  607    H    HIS  78           HN       HIS  78  18.108  12.088  -2.861
  608    HA   HIS  78           HA       HIS  78  16.051  13.189  -1.257
  609   1HB   HIS  78           HB2      HIS  78  17.602  14.175  -3.233
  610   2HB   HIS  78           HB1      HIS  78  16.097  13.960  -4.128
  611    HD1  HIS  78           HD1      HIS  78  14.736  16.038  -4.078
  612    HD2  HIS  78           HD2      HIS  78  16.810  15.494  -0.503
  613    HE1  HIS  78           HE1      HIS  78  14.101  17.979  -2.578
  614    NH1  ARG  79           NH2      ARG  79  12.758   6.912  -8.869
  615    NH2  ARG  79           NH1      ARG  79  14.830   7.344  -9.662
  616    H    ARG  79           HN       ARG  79  15.864  11.149  -4.133
  617    HA   ARG  79           HA       ARG  79  12.986  11.462  -4.434
  618   1HB   ARG  79           HB2      ARG  79  15.070  10.385  -5.972
  619   2HB   ARG  79           HB1      ARG  79  14.047   9.006  -5.566
  620   1HG   ARG  79           HG2      ARG  79  12.185  10.937  -6.189
  621   2HG   ARG  79           HG1      ARG  79  13.487  11.298  -7.324
  622   1HD   ARG  79           HD2      ARG  79  12.300   8.538  -6.919
  623   2HD   ARG  79           HD1      ARG  79  11.831   9.638  -8.215
  624    HE   ARG  79           HE       ARG  79  14.584   9.466  -8.456
  625   1HH1  ARG  79          HH21      ARG  79  11.953   7.178  -8.341
  626   2HH1  ARG  79          HH22      ARG  79  12.777   6.025  -9.330
  627   1HH2  ARG  79          HH11      ARG  79  15.622   7.950  -9.741
  628   2HH2  ARG  79          HH12      ARG  79  14.834   6.454 -10.118
  629    H    HIS  80           HN       HIS  80  15.106   9.303  -2.663
  630    HA   HIS  80           HA       HIS  80  13.229   7.202  -2.163
  631   1HB   HIS  80           HB2      HIS  80  15.820   7.406  -1.674
  632   2HB   HIS  80           HB1      HIS  80  15.264   7.998  -0.109
  633    HD1  HIS  80           HD1      HIS  80  12.777   6.193   0.252
  634    HD2  HIS  80           HD2      HIS  80  16.496   4.788  -0.995
  635    HE1  HIS  80           HE1      HIS  80  12.835   3.727   0.822
  636    H    LYS  81           HN       LYS  81  14.158   9.984  -0.100
  637    HA   LYS  81           HA       LYS  81  12.328   9.534   1.988
  638   1HB   LYS  81           HB2      LYS  81  13.995  11.697   1.079
  639   2HB   LYS  81           HB1      LYS  81  12.430  12.334   1.586
  640   1HG   LYS  81           HG2      LYS  81  12.709  11.666   3.774
  641   2HG   LYS  81           HG1      LYS  81  13.706  10.279   3.334
  642   1HD   LYS  81           HD2      LYS  81  15.638  11.612   3.040
  643   2HD   LYS  81           HD1      LYS  81  14.698  13.103   2.953
  644   1HE   LYS  81           HE2      LYS  81  13.956  12.504   5.377
  645   2HE   LYS  81           HE1      LYS  81  15.355  11.430   5.370
  646   1HZ   LYS  81           HZ2      LYS  81  16.196  13.848   4.310
  647   2HZ   LYS  81           HZ1      LYS  81  15.281  14.233   5.689
  648   3HZ   LYS  81           HZ3      LYS  81  16.607  13.183   5.818
  649    H    GLN  82           HN       GLN  82  11.712  10.717  -1.245
  650    HA   GLN  82           HA       GLN  82   9.164  11.948  -0.676
  651   1HB   GLN  82           HB2      GLN  82  10.247  10.774  -3.255
  652   2HB   GLN  82           HB1      GLN  82   8.803  11.779  -3.129
  653   1HG   GLN  82           HG2      GLN  82  10.558  13.363  -1.825
  654   2HG   GLN  82           HG1      GLN  82  11.665  12.547  -2.929
  655   1HE2  GLN  82          HE22      GLN  82   9.578  13.750  -5.804
  656   2HE2  GLN  82          HE21      GLN  82   9.984  12.219  -5.193
  657    H    LEU  83           HN       LEU  83  10.094   8.698  -1.813
  658    HA   LEU  83           HA       LEU  83   7.354   7.769  -1.971
  659   1HB   LEU  83           HB2      LEU  83   9.174   6.715  -3.267
  660   2HB   LEU  83           HB1      LEU  83   9.930   6.180  -1.765
  661    HG   LEU  83           HG       LEU  83   7.087   5.462  -1.969
  662   1HD1  LEU  83          HD11      LEU  83   8.966   4.849  -4.167
  663   2HD1  LEU  83          HD13      LEU  83   8.106   3.453  -3.517
  664   3HD1  LEU  83          HD12      LEU  83   7.203   4.827  -4.154
  665   1HD2  LEU  83          HD22      LEU  83   9.690   4.308  -1.085
  666   2HD2  LEU  83          HD21      LEU  83   8.133   4.332  -0.257
  667   3HD2  LEU  83          HD23      LEU  83   8.428   3.166  -1.546
  668    H    ILE  84           HN       ILE  84   9.678   8.035   0.625
  669    HA   ILE  84           HA       ILE  84   8.394   6.051   2.328
  670    HB   ILE  84           HB       ILE  84  10.264   8.334   3.031
  671   1HG1  ILE  84          HG12      ILE  84  11.451   6.825   1.598
  672   2HG1  ILE  84          HG11      ILE  84  11.921   6.390   3.240
  673   1HG2  ILE  84          HG21      ILE  84   8.952   6.173   4.608
  674   2HG2  ILE  84          HG23      ILE  84  10.639   6.527   4.980
  675   3HG2  ILE  84          HG22      ILE  84   9.424   7.799   5.102
  676   1HD1  ILE  84          HD12      ILE  84   9.809   4.767   3.007
  677   2HD1  ILE  84          HD11      ILE  84  10.217   4.898   1.296
  678   3HD1  ILE  84          HD13      ILE  84  11.410   4.290   2.443
  679    NH1  ARG  85           NH2      ARG  85  10.217  15.008   2.409
  680    NH2  ARG  85           NH1      ARG  85   8.529  15.738   1.097
  681    H    ARG  85           HN       ARG  85   8.043   9.511   1.781
  682    HA   ARG  85           HA       ARG  85   6.316   9.894   4.108
  683   1HB   ARG  85           HB2      ARG  85   7.276  11.575   1.832
  684   2HB   ARG  85           HB1      ARG  85   5.788  12.072   2.639
  685   1HG   ARG  85           HG2      ARG  85   6.895  12.750   4.490
  686   2HG   ARG  85           HG1      ARG  85   7.884  11.290   4.527
  687   1HD   ARG  85           HD2      ARG  85   9.216  13.386   4.157
  688   2HD   ARG  85           HD1      ARG  85   9.395  12.204   2.860
  689    HE   ARG  85           HE       ARG  85   7.309  13.818   2.009
  690   1HH1  ARG  85          HH21      ARG  85  10.589  14.360   3.071
  691   2HH1  ARG  85          HH22      ARG  85  10.784  15.766   2.085
  692   1HH2  ARG  85          HH11      ARG  85   7.595  15.646   0.750
  693   2HH2  ARG  85          HH12      ARG  85   9.107  16.492   0.783
  694    H    PHE  86           HN       PHE  86   5.868   9.301   0.654
  695    HA   PHE  86           HA       PHE  86   3.001   9.725   0.679
  696   1HB   PHE  86           HB2      PHE  86   5.009   9.148  -1.250
  697   2HB   PHE  86           HB1      PHE  86   3.827   7.845  -1.349
  698    HD1  PHE  86           HD1      PHE  86   3.341  11.454  -0.468
  699    HD2  PHE  86           HD2      PHE  86   2.555   8.295  -3.268
  700    HE1  PHE  86           HE1      PHE  86   1.806  12.943  -1.720
  701    HE2  PHE  86           HE2      PHE  86   1.023   9.789  -4.521
  702    HZ   PHE  86           HZ       PHE  86   0.646  12.112  -3.745
  703    H    LEU  87           HN       LEU  87   5.119   6.964   1.178
  704    HA   LEU  87           HA       LEU  87   3.014   4.988   1.177
  705   1HB   LEU  87           HB2      LEU  87   4.951   3.858   0.858
  706   2HB   LEU  87           HB1      LEU  87   5.913   5.102   1.642
  707    HG   LEU  87           HG       LEU  87   5.209   4.204   3.863
  708   1HD1  LEU  87          HD12      LEU  87   3.269   2.864   2.276
  709   2HD1  LEU  87          HD11      LEU  87   4.327   1.619   2.937
  710   3HD1  LEU  87          HD13      LEU  87   3.498   2.737   4.020
  711   1HD2  LEU  87          HD22      LEU  87   6.674   2.620   1.804
  712   2HD2  LEU  87          HD21      LEU  87   7.269   3.346   3.292
  713   3HD2  LEU  87          HD23      LEU  87   6.347   1.845   3.354
  714    H    LYS  88           HN       LYS  88   4.818   6.593   3.840
  715    HA   LYS  88           HA       LYS  88   3.369   5.316   5.932
  716   1HB   LYS  88           HB2      LYS  88   4.184   7.111   7.384
  717   2HB   LYS  88           HB1      LYS  88   5.472   6.583   6.305
  718   1HG   LYS  88           HG2      LYS  88   5.694   8.687   5.568
  719   2HG   LYS  88           HG1      LYS  88   4.041   8.639   4.965
  720   1HD   LYS  88           HD2      LYS  88   4.219  10.497   6.511
  721   2HD   LYS  88           HD1      LYS  88   3.246   9.238   7.272
  722   1HE   LYS  88           HE2      LYS  88   5.772   8.509   8.046
  723   2HE   LYS  88           HE1      LYS  88   5.906  10.268   8.024
  724   1HZ   LYS  88           HZ2      LYS  88   3.544   9.048   9.264
  725   2HZ   LYS  88           HZ1      LYS  88   5.012   9.026  10.121
  726   3HZ   LYS  88           HZ3      LYS  88   4.334  10.505   9.641
  727    NH1  ARG  89           NH2      ARG  89  -1.884  13.105   0.425
  728    NH2  ARG  89           NH1      ARG  89  -3.163  11.681  -0.775
  729    H    ARG  89           HN       ARG  89   2.537   8.017   3.853
  730    HA   ARG  89           HA       ARG  89   0.387   9.054   5.468
  731   1HB   ARG  89           HB2      ARG  89   0.956  10.538   3.776
  732   2HB   ARG  89           HB1      ARG  89   1.205   9.253   2.595
  733   1HG   ARG  89           HG2      ARG  89  -1.140   8.947   2.284
  734   2HG   ARG  89           HG1      ARG  89  -1.527   9.923   3.703
  735   1HD   ARG  89           HD2      ARG  89  -1.190  11.906   2.600
  736   2HD   ARG  89           HD1      ARG  89   0.090  11.244   1.584
  737    HE   ARG  89           HE       ARG  89  -2.197   9.964   0.689
  738   1HH1  ARG  89          HH21      ARG  89  -1.227  13.284   1.154
  739   2HH1  ARG  89          HH22      ARG  89  -2.229  13.864  -0.128
  740   1HH2  ARG  89          HH11      ARG  89  -3.489  10.755  -0.966
  741   2HH2  ARG  89          HH12      ARG  89  -3.495  12.450  -1.321
  742    H    LEU  90           HN       LEU  90   0.443   6.783   2.722
  743    HA   LEU  90           HA       LEU  90  -2.354   6.162   2.805
  744   1HB   LEU  90           HB2      LEU  90  -0.810   5.664   0.890
  745   2HB   LEU  90           HB1      LEU  90  -0.089   4.381   1.862
  746    HG   LEU  90           HG       LEU  90  -2.422   3.402   2.098
  747   1HD1  LEU  90          HD12      LEU  90  -3.087   5.852   0.820
  748   2HD1  LEU  90          HD11      LEU  90  -3.454   4.559  -0.321
  749   3HD1  LEU  90          HD13      LEU  90  -4.179   4.549   1.287
  750   1HD2  LEU  90          HD22      LEU  90  -0.506   3.086   0.142
  751   2HD2  LEU  90          HD21      LEU  90  -1.926   2.058   0.334
  752   3HD2  LEU  90          HD23      LEU  90  -1.958   3.401  -0.809
  753    H    ASP  91           HN       ASP  91   0.287   5.175   4.836
  754    HA   ASP  91           HA       ASP  91  -0.619   2.634   5.694
  755   1HB   ASP  91           HB2      ASP  91   1.576   3.773   6.283
  756   2HB   ASP  91           HB1      ASP  91   0.676   4.696   7.487
  757    NH1  ARG  92           NH2      ARG  92  -3.072   6.122  14.128
  758    NH2  ARG  92           NH1      ARG  92  -0.893   5.873  14.671
  759    H    ARG  92           HN       ARG  92  -1.428   5.869   7.008
  760    HA   ARG  92           HA       ARG  92  -3.382   4.634   8.844
  761   1HB   ARG  92           HB2      ARG  92  -2.489   7.488   8.386
  762   2HB   ARG  92           HB1      ARG  92  -3.770   7.052   9.517
  763   1HG   ARG  92           HG2      ARG  92  -1.274   5.478   9.765
  764   2HG   ARG  92           HG1      ARG  92  -1.139   7.182  10.203
  765   1HD   ARG  92           HD2      ARG  92  -3.187   6.877  11.655
  766   2HD   ARG  92           HD1      ARG  92  -3.068   5.145  11.346
  767    HE   ARG  92           HE       ARG  92  -0.539   5.843  12.247
  768   1HH1  ARG  92          HH21      ARG  92  -3.797   6.207  13.447
  769   2HH1  ARG  92          HH22      ARG  92  -3.302   6.145  15.101
  770   1HH2  ARG  92          HH11      ARG  92   0.063   5.765  14.400
  771   2HH2  ARG  92          HH12      ARG  92  -1.139   5.897  15.640
  772    H    ASN  93           HN       ASN  93  -3.368   6.274   5.755
  773    HA   ASN  93           HA       ASN  93  -6.220   6.929   5.849
  774   1HB   ASN  93           HB2      ASN  93  -3.989   7.583   4.200
  775   2HB   ASN  93           HB1      ASN  93  -5.231   6.872   3.173
  776   1HD2  ASN  93          HD22      ASN  93  -7.641   9.447   4.504
  777   2HD2  ASN  93          HD21      ASN  93  -7.558   7.756   4.626
  778    H    LEU  94           HN       LEU  94  -4.470   4.051   5.227
  779    HA   LEU  94           HA       LEU  94  -6.525   2.978   3.397
  780   1HB   LEU  94           HB2      LEU  94  -3.926   2.505   3.383
  781   2HB   LEU  94           HB1      LEU  94  -4.350   1.300   4.598
  782    HG   LEU  94           HG       LEU  94  -6.106   0.440   2.991
  783   1HD1  LEU  94          HD11      LEU  94  -5.395   2.798   1.608
  784   2HD1  LEU  94          HD13      LEU  94  -4.809   1.459   0.621
  785   3HD1  LEU  94          HD12      LEU  94  -6.512   1.542   1.073
  786   1HD2  LEU  94          HD22      LEU  94  -3.680  -0.431   3.297
  787   2HD2  LEU  94          HD21      LEU  94  -4.561  -0.942   1.857
  788   3HD2  LEU  94          HD23      LEU  94  -3.360   0.344   1.746
  789    CH2  TRP  95           CH2      TRP  95  -6.393   0.818  13.757
  790    H    TRP  95           HN       TRP  95  -5.124   1.997   6.550
  791    HA   TRP  95           HA       TRP  95  -7.492   0.326   7.077
  792   1HB   TRP  95           HB2      TRP  95  -6.213  -0.724   8.634
  793   2HB   TRP  95           HB1      TRP  95  -4.879   0.071   7.797
  794    HD1  TRP  95           HD1      TRP  95  -4.197   2.537   8.784
  795    HE1  TRP  95           HE1      TRP  95  -4.082   3.324  11.239
  796    HE3  TRP  95           HE3      TRP  95  -7.178  -0.979  10.967
  797    HZ2  TRP  95           HZ2      TRP  95  -5.125   2.556  13.790
  798    HZ3  TRP  95           HZ3      TRP  95  -7.604  -0.925  13.408
  799    HH2  TRP  95           HH2      TRP  95  -6.583   0.836  14.820
  800    H    GLY  96           HN       GLY  96  -6.269   3.476   7.941
  801   1HA   GLY  96           HA2      GLY  96  -7.608   4.022  10.343
  802   2HA   GLY  96           HA1      GLY  96  -7.357   5.232   9.081
  803    H    LEU  97           HN       LEU  97  -8.891   3.664   7.101
  804    HA   LEU  97           HA       LEU  97 -11.591   4.537   7.920
  805   1HB   LEU  97           HB2      LEU  97 -10.160   4.080   5.403
  806   2HB   LEU  97           HB1      LEU  97 -11.783   3.390   5.396
  807    HG   LEU  97           HG       LEU  97 -12.431   5.723   6.461
  808   1HD1  LEU  97          HD12      LEU  97  -9.786   6.176   6.278
  809   2HD1  LEU  97          HD11      LEU  97 -10.269   6.734   4.676
  810   3HD1  LEU  97          HD13      LEU  97 -10.974   7.470   6.116
  811   1HD2  LEU  97          HD21      LEU  97 -12.410   4.600   3.844
  812   2HD2  LEU  97          HD23      LEU  97 -13.487   5.847   4.474
  813   3HD2  LEU  97          HD22      LEU  97 -11.978   6.302   3.683
  814    H    ALA  98           HN       ALA  98  -9.768   1.613   7.211
  815    HA   ALA  98           HA       ALA  98 -11.873  -0.250   6.995
  816   1HB   ALA  98           HB2      ALA  98  -9.084  -0.515   8.148
  817   2HB   ALA  98           HB1      ALA  98 -10.162  -1.890   7.912
  818   3HB   ALA  98           HB3      ALA  98  -9.618  -0.949   6.524
  819    H    GLY  99           HN       GLY  99  -9.912   0.239   9.925
  820   1HA   GLY  99           HA2      GLY  99 -10.818   0.674  12.129
  821   2HA   GLY  99           HA1      GLY  99 -12.391   0.117  11.556
  822    H    LEU 100           HN       LEU 100  -9.118  -1.345  11.530
  823    HA   LEU 100           HA       LEU 100 -10.048  -3.483  13.326
  824   1HB   LEU 100           HB2      LEU 100 -10.030  -3.802  10.451
  825   2HB   LEU 100           HB1      LEU 100  -8.865  -4.900  11.192
  826    HG   LEU 100           HG       LEU 100 -10.970  -5.183  12.898
  827   1HD1  LEU 100          HD13      LEU 100 -12.111  -3.697  10.917
  828   2HD1  LEU 100          HD12      LEU 100 -12.430  -5.329  10.328
  829   3HD1  LEU 100          HD11      LEU 100 -13.003  -4.839  11.922
  830   1HD2  LEU 100          HD21      LEU 100  -9.544  -6.816  11.340
  831   2HD2  LEU 100          HD23      LEU 100 -11.063  -7.340  12.067
  832   3HD2  LEU 100          HD22      LEU 100 -11.028  -6.806  10.386
  833    H    ASN 101           HN       ASN 101  -8.361  -3.059  14.742
  834    HA   ASN 101           HA       ASN 101  -5.677  -2.453  13.955
  835   1HB   ASN 101           HB2      ASN 101  -6.122  -1.882  16.170
  836   2HB   ASN 101           HB1      ASN 101  -6.985  -3.386  16.492
  837   1HD2  ASN 101          HD22      ASN 101  -4.109  -4.895  17.824
  838   2HD2  ASN 101          HD21      ASN 101  -5.803  -4.782  17.794
  839    H    SER 102           HN       SER 102  -6.889  -5.496  15.422
  840    HA   SER 102           HA       SER 102  -4.600  -7.054  14.879
  841   1HB   SER 102           HB2      SER 102  -7.394  -7.560  15.590
  842   2HB   SER 102           HB1      SER 102  -6.711  -8.836  14.587
  843    HG   SER 102           HG       SER 102  -6.188  -9.324  16.675
  844    H    CYS 103           HN       CYS 103  -3.740  -7.786  12.990
  845    HA   CYS 103           HA       CYS 103  -5.491  -8.385  10.702
  846   1HB   CYS 103           HB2      CYS 103  -3.873  -5.939  10.880
  847   2HB   CYS 103           HB1      CYS 103  -3.526  -6.897   9.441
  848    HA   PRO 104           HA       PRO 104  -1.858 -11.167  11.510
  849   1HB   PRO 104           HB2      PRO 104  -3.631 -13.301  10.720
  850   2HB   PRO 104           HB1      PRO 104  -2.925 -12.999  12.314
  851   1HG   PRO 104           HG2      PRO 104  -5.663 -12.604  11.505
  852   2HG   PRO 104           HG1      PRO 104  -4.946 -12.292  13.091
  853   1HD   PRO 104           HD2      PRO 104  -5.809 -10.356  11.143
  854   2HD   PRO 104           HD1      PRO 104  -5.058 -10.048  12.722
  855    H    VAL 105           HN       VAL 105  -0.933 -10.239   9.555
  856    HA   VAL 105           HA       VAL 105  -1.890 -11.402   6.988
  857    HB   VAL 105           HB       VAL 105  -1.494  -8.941   7.107
  858   1HG1  VAL 105          HG12      VAL 105   0.799  -9.748   8.532
  859   2HG1  VAL 105          HG11      VAL 105   1.397  -9.064   7.020
  860   3HG1  VAL 105          HG13      VAL 105   0.359  -8.103   8.074
  861   1HG2  VAL 105          HG21      VAL 105  -0.635 -10.756   5.145
  862   2HG2  VAL 105          HG23      VAL 105  -0.922  -9.030   4.927
  863   3HG2  VAL 105          HG22      VAL 105   0.696  -9.612   5.319
  864    H    LYS 106           HN       LYS 106  -0.790 -13.352   8.502
  865    HA   LYS 106           HA       LYS 106   1.943 -13.678   7.331
  866   1HB   LYS 106           HB2      LYS 106   1.153 -15.054   9.877
  867   2HB   LYS 106           HB1      LYS 106   2.758 -14.584   9.314
  868   1HG   LYS 106           HG2      LYS 106   2.446 -12.901  10.848
  869   2HG   LYS 106           HG1      LYS 106   1.642 -12.142   9.474
  870   1HD   LYS 106           HD2      LYS 106  -0.211 -12.018  10.750
  871   2HD   LYS 106           HD1      LYS 106  -0.322 -13.774  10.620
  872   1HE   LYS 106           HE2      LYS 106   1.300 -13.881  12.594
  873   2HE   LYS 106           HE1      LYS 106   1.000 -12.156  12.806
  874   1HZ   LYS 106           HZ1      LYS 106  -1.242 -14.061  12.600
  875   2HZ   LYS 106           HZ3      LYS 106  -0.451 -13.819  14.081
  876   3HZ   LYS 106           HZ2      LYS 106  -1.215 -12.515  13.305
  877    H    GLU 107           HN       GLU 107  -0.207 -14.543   5.863
  878    HA   GLU 107           HA       GLU 107   0.206 -17.468   5.929
  879   1HB   GLU 107           HB2      GLU 107  -2.252 -17.886   5.682
  880   2HB   GLU 107           HB1      GLU 107  -1.824 -17.231   7.262
  881   1HG   GLU 107           HG2      GLU 107  -2.248 -14.964   5.700
  882   2HG   GLU 107           HG1      GLU 107  -3.514 -16.078   5.181
  883    H    ALA 108           HN       ALA 108   1.433 -16.847   4.051
  884    HA   ALA 108           HA       ALA 108  -0.027 -17.193   1.612
  885   1HB   ALA 108           HB2      ALA 108  -0.068 -14.558   2.516
  886   2HB   ALA 108           HB1      ALA 108   1.255 -14.578   1.350
  887   3HB   ALA 108           HB3      ALA 108  -0.360 -15.085   0.858
  888    H    ASP 109           HN       ASP 109   1.453 -17.280  -0.219
  889    HA   ASP 109           HA       ASP 109   4.050 -18.306   0.504
  890   1HB   ASP 109           HB2      ASP 109   3.172 -17.428  -2.259
  891   2HB   ASP 109           HB1      ASP 109   4.393 -18.633  -1.851
  892    H    GLN 110           HN       GLN 110   5.842 -17.234  -1.291
  893    HA   GLN 110           HA       GLN 110   6.155 -14.493  -0.187
  894   1HB   GLN 110           HB2      GLN 110   7.962 -16.611  -0.580
  895   2HB   GLN 110           HB1      GLN 110   8.382 -15.411  -1.802
  896   1HG   GLN 110           HG2      GLN 110   8.979 -13.826  -0.245
  897   2HG   GLN 110           HG1      GLN 110   7.825 -14.416   0.952
  898   1HE2  GLN 110          HE22      GLN 110  11.051 -15.489   2.319
  899   2HE2  GLN 110          HE21      GLN 110  10.123 -14.074   2.185
  900    H    SER 111           HN       SER 111   4.640 -13.474  -1.607
  901    HA   SER 111           HA       SER 111   4.874 -13.685  -4.491
  902   1HB   SER 111           HB2      SER 111   2.974 -12.434  -4.485
  903   2HB   SER 111           HB1      SER 111   2.993 -12.675  -2.743
  904    HG   SER 111           HG       SER 111   3.153 -10.581  -2.692
  905    H    THR 112           HN       THR 112   4.952 -11.110  -5.435
  906    HA   THR 112           HA       THR 112   7.643 -10.156  -4.542
  907    HB   THR 112           HB       THR 112   8.087  -9.516  -6.859
  908    HG1  THR 112           HG1      THR 112   5.866 -10.835  -7.826
  909   1HG2  THR 112          HG22      THR 112   8.504 -11.876  -6.045
  910   2HG2  THR 112          HG21      THR 112   6.984 -12.334  -6.813
  911   3HG2  THR 112          HG23      THR 112   8.317 -11.720  -7.791
  912    H    LEU 113           HN       LEU 113   7.886  -7.928  -4.289
  913    HA   LEU 113           HA       LEU 113   5.603  -6.383  -3.629
  914   1HB   LEU 113           HB2      LEU 113   8.313  -6.066  -3.351
  915   2HB   LEU 113           HB1      LEU 113   7.932  -4.838  -4.559
  916    HG   LEU 113           HG       LEU 113   7.701  -3.847  -2.351
  917   1HD1  LEU 113          HD13      LEU 113   6.036  -3.248  -4.117
  918   2HD1  LEU 113          HD12      LEU 113   4.958  -4.489  -3.476
  919   3HD1  LEU 113          HD11      LEU 113   5.384  -3.093  -2.485
  920   1HD2  LEU 113          HD21      LEU 113   7.123  -6.291  -1.428
  921   2HD2  LEU 113          HD23      LEU 113   6.601  -4.839  -0.575
  922   3HD2  LEU 113          HD22      LEU 113   5.472  -5.702  -1.620
  923    H    GLU 114           HN       GLU 114   7.037  -7.027  -6.733
  924    HA   GLU 114           HA       GLU 114   5.981  -4.680  -8.066
  925   1HB   GLU 114           HB2      GLU 114   7.582  -6.980  -8.753
  926   2HB   GLU 114           HB1      GLU 114   6.308  -6.755  -9.952
  927   1HG   GLU 114           HG2      GLU 114   7.063  -4.638 -10.560
  928   2HG   GLU 114           HG1      GLU 114   7.866  -4.370  -9.013
  929    H    ASN 115           HN       ASN 115   5.095  -8.099  -8.603
  930    HA   ASN 115           HA       ASN 115   2.635  -7.601  -9.872
  931   1HB   ASN 115           HB2      ASN 115   4.026  -9.867  -8.895
  932   2HB   ASN 115           HB1      ASN 115   2.403  -9.945  -8.210
  933   1HD2  ASN 115          HD22      ASN 115   1.024  -9.688 -11.698
  934   2HD2  ASN 115          HD21      ASN 115   0.946  -8.690 -10.327
  935    H    PHE 116           HN       PHE 116   3.416  -7.402  -6.470
  936    HA   PHE 116           HA       PHE 116   0.635  -7.520  -5.580
  937   1HB   PHE 116           HB2      PHE 116   2.262  -8.193  -3.975
  938   2HB   PHE 116           HB1      PHE 116   3.242  -6.754  -4.251
  939    HD1  PHE 116           HD1      PHE 116  -0.292  -7.618  -3.304
  940    HD2  PHE 116           HD2      PHE 116   3.101  -5.062  -2.679
  941    HE1  PHE 116           HE1      PHE 116  -1.520  -6.426  -1.509
  942    HE2  PHE 116           HE2      PHE 116   1.875  -3.869  -0.884
  943    HZ   PHE 116           HZ       PHE 116  -0.436  -4.551  -0.297
  944    H    LEU 117           HN       LEU 117   2.988  -4.940  -6.282
  945    HA   LEU 117           HA       LEU 117   1.312  -2.781  -5.374
  946   1HB   LEU 117           HB2      LEU 117   3.783  -3.060  -6.995
  947   2HB   LEU 117           HB1      LEU 117   2.825  -1.613  -7.309
  948    HG   LEU 117           HG       LEU 117   3.562  -2.480  -4.509
  949   1HD1  LEU 117          HD12      LEU 117   5.550  -2.009  -6.112
  950   2HD1  LEU 117          HD11      LEU 117   5.000  -0.333  -6.063
  951   3HD1  LEU 117          HD13      LEU 117   5.502  -1.139  -4.578
  952   1HD2  LEU 117          HD22      LEU 117   1.665  -0.787  -5.138
  953   2HD2  LEU 117          HD21      LEU 117   2.810  -0.348  -3.870
  954   3HD2  LEU 117          HD23      LEU 117   2.998   0.310  -5.496
  955    H    GLU 118           HN       GLU 118   1.569  -4.580  -8.379
  956    HA   GLU 118           HA       GLU 118  -0.072  -2.820  -9.969
  957   1HB   GLU 118           HB2      GLU 118   1.227  -4.303 -11.246
  958   2HB   GLU 118           HB1      GLU 118   0.861  -5.672 -10.198
  959   1HG   GLU 118           HG2      GLU 118  -0.313  -5.744 -12.423
  960   2HG   GLU 118           HG1      GLU 118  -1.403  -5.798 -11.039
  961    NH1  ARG 119           NH2      ARG 119  -0.290 -11.815  -7.107
  962    NH2  ARG 119           NH1      ARG 119  -2.201 -12.834  -7.748
  963    H    ARG 119           HN       ARG 119  -0.723  -5.880  -8.271
  964    HA   ARG 119           HA       ARG 119  -3.561  -5.869  -8.771
  965   1HB   ARG 119           HB2      ARG 119  -2.071  -7.171  -6.462
  966   2HB   ARG 119           HB1      ARG 119  -3.669  -7.611  -7.066
  967   1HG   ARG 119           HG2      ARG 119  -2.819  -8.587  -9.001
  968   2HG   ARG 119           HG1      ARG 119  -1.343  -7.626  -8.964
  969   1HD   ARG 119           HD2      ARG 119  -0.330  -9.409  -8.028
  970   2HD   ARG 119           HD1      ARG 119  -1.280  -9.082  -6.579
  971    HE   ARG 119           HE       ARG 119  -2.992 -10.555  -8.180
  972   1HH1  ARG 119          HH21      ARG 119   0.251 -10.989  -6.960
  973   2HH1  ARG 119          HH22      ARG 119   0.107 -12.710  -6.905
  974   1HH2  ARG 119          HH11      ARG 119  -3.136 -12.787  -8.097
  975   2HH2  ARG 119          HH12      ARG 119  -1.788 -13.721  -7.540
  976    H    LEU 120           HN       LEU 120  -1.588  -4.009  -6.626
  977    HA   LEU 120           HA       LEU 120  -3.648  -3.555  -4.617
  978   1HB   LEU 120           HB2      LEU 120  -0.896  -2.703  -5.114
  979   2HB   LEU 120           HB1      LEU 120  -1.910  -1.373  -4.561
  980    HG   LEU 120           HG       LEU 120  -1.710  -4.065  -3.186
  981   1HD1  LEU 120          HD13      LEU 120  -0.424  -1.381  -2.627
  982   2HD1  LEU 120          HD12      LEU 120  -0.538  -2.659  -1.416
  983   3HD1  LEU 120          HD11      LEU 120   0.385  -2.925  -2.896
  984   1HD2  LEU 120          HD21      LEU 120  -3.500  -1.765  -2.965
  985   2HD2  LEU 120          HD23      LEU 120  -3.645  -3.365  -2.236
  986   3HD2  LEU 120          HD22      LEU 120  -2.687  -2.117  -1.440
  987    H    LYS 121           HN       LYS 121  -2.362  -1.783  -7.419
  988    HA   LYS 121           HA       LYS 121  -4.095   0.488  -7.283
  989   1HB   LYS 121           HB2      LYS 121  -2.644  -0.917  -9.520
  990   2HB   LYS 121           HB1      LYS 121  -3.686   0.466  -9.850
  991   1HG   LYS 121           HG2      LYS 121  -2.363   1.767  -8.146
  992   2HG   LYS 121           HG1      LYS 121  -1.245   0.406  -8.059
  993   1HD   LYS 121           HD2      LYS 121  -1.551   2.452 -10.159
  994   2HD   LYS 121           HD1      LYS 121  -0.149   1.471  -9.743
  995   1HE   LYS 121           HE2      LYS 121  -1.298  -0.486 -10.871
  996   2HE   LYS 121           HE1      LYS 121  -2.522   0.648 -11.445
  997   1HZ   LYS 121           HZ1      LYS 121   0.133   1.583 -11.926
  998   2HZ   LYS 121           HZ3      LYS 121  -0.147   0.081 -12.663
  999   3HZ   LYS 121           HZ2      LYS 121  -1.163   1.398 -13.010
 1000    H    THR 122           HN       THR 122  -4.286  -2.368  -9.352
 1001    HA   THR 122           HA       THR 122  -6.779  -1.995 -10.525
 1002    HB   THR 122           HB       THR 122  -6.681  -4.751  -9.984
 1003    HG1  THR 122           HG1      THR 122  -4.335  -4.940 -10.662
 1004   1HG2  THR 122          HG22      THR 122  -5.563  -3.060 -12.231
 1005   2HG2  THR 122          HG21      THR 122  -5.697  -4.817 -12.311
 1006   3HG2  THR 122          HG23      THR 122  -7.149  -3.827 -12.162
 1007    H    ILE 123           HN       ILE 123  -6.136  -3.677  -7.471
 1008    HA   ILE 123           HA       ILE 123  -8.810  -4.332  -6.806
 1009    HB   ILE 123           HB       ILE 123  -6.280  -3.925  -5.283
 1010   1HG1  ILE 123          HG12      ILE 123  -6.468  -6.220  -4.859
 1011   2HG1  ILE 123          HG11      ILE 123  -8.224  -6.203  -4.997
 1012   1HG2  ILE 123          HG21      ILE 123  -9.054  -3.968  -4.091
 1013   2HG2  ILE 123          HG23      ILE 123  -7.654  -4.543  -3.185
 1014   3HG2  ILE 123          HG22      ILE 123  -7.723  -2.867  -3.732
 1015   1HD1  ILE 123          HD13      ILE 123  -6.444  -5.641  -7.373
 1016   2HD1  ILE 123          HD12      ILE 123  -6.914  -7.279  -6.933
 1017   3HD1  ILE 123          HD11      ILE 123  -8.146  -6.098  -7.370
 1018    H    MET 124           HN       MET 124  -6.995  -1.351  -6.264
 1019    HA   MET 124           HA       MET 124  -9.026  -0.143  -4.587
 1020   1HB   MET 124           HB2      MET 124  -6.822   1.200  -6.168
 1021   2HB   MET 124           HB1      MET 124  -7.731   1.909  -4.835
 1022   1HG   MET 124           HG2      MET 124  -6.418  -0.703  -4.297
 1023   2HG   MET 124           HG1      MET 124  -5.353   0.692  -4.474
 1024   1HE   MET 124           HE1      MET 124  -4.835   2.194  -3.094
 1025   2HE   MET 124           HE3      MET 124  -6.264   3.221  -2.920
 1026   3HE   MET 124           HE2      MET 124  -5.453   2.584  -1.492
 1027    NH1  ARG 125           NH2      ARG 125  -4.725   2.043 -12.278
 1028    NH2  ARG 125           NH1      ARG 125  -5.391   3.876 -13.416
 1029    H    ARG 125           HN       ARG 125  -8.512  -0.268  -8.058
 1030    HA   ARG 125           HA       ARG 125 -10.315   1.965  -8.594
 1031   1HB   ARG 125           HB2      ARG 125  -8.760   0.017 -10.245
 1032   2HB   ARG 125           HB1      ARG 125 -10.087   0.900 -11.001
 1033   1HG   ARG 125           HG2      ARG 125  -9.004   2.912 -10.867
 1034   2HG   ARG 125           HG1      ARG 125  -8.237   2.513  -9.329
 1035   1HD   ARG 125           HD2      ARG 125  -6.386   1.670 -10.338
 1036   2HD   ARG 125           HD1      ARG 125  -7.329   0.845 -11.579
 1037    HE   ARG 125           HE       ARG 125  -7.526   3.520 -12.263
 1038   1HH1  ARG 125          HH21      ARG 125  -4.905   1.303 -11.633
 1039   2HH1  ARG 125          HH22      ARG 125  -3.825   2.117 -12.708
 1040   1HH2  ARG 125          HH11      ARG 125  -6.093   4.549 -13.645
 1041   2HH2  ARG 125          HH12      ARG 125  -4.485   3.935 -13.835
 1042    H    GLU 126           HN       GLU 126 -10.613  -1.575  -8.621
 1043    HA   GLU 126           HA       GLU 126 -13.346  -1.357  -9.713
 1044   1HB   GLU 126           HB2      GLU 126 -11.339  -3.400  -9.587
 1045   2HB   GLU 126           HB1      GLU 126 -12.813  -4.004  -8.828
 1046   1HG   GLU 126           HG2      GLU 126 -12.761  -2.639 -11.531
 1047   2HG   GLU 126           HG1      GLU 126 -12.703  -4.389 -11.321
 1048    H    LYS 127           HN       LYS 127 -11.771  -1.967  -6.632
 1049    HA   LYS 127           HA       LYS 127 -14.249  -2.801  -5.326
 1050   1HB   LYS 127           HB2      LYS 127 -11.846  -3.474  -4.676
 1051   2HB   LYS 127           HB1      LYS 127 -11.739  -1.880  -3.928
 1052   1HG   LYS 127           HG2      LYS 127 -12.539  -3.078  -2.126
 1053   2HG   LYS 127           HG1      LYS 127 -14.073  -2.627  -2.870
 1054   1HD   LYS 127           HD2      LYS 127 -14.541  -4.835  -2.955
 1055   2HD   LYS 127           HD1      LYS 127 -13.328  -4.942  -4.231
 1056   1HE   LYS 127           HE2      LYS 127 -11.697  -5.761  -2.806
 1057   2HE   LYS 127           HE1      LYS 127 -12.395  -4.977  -1.388
 1058   1HZ   LYS 127           HZ1      LYS 127 -14.052  -6.986  -2.668
 1059   2HZ   LYS 127           HZ3      LYS 127 -12.651  -7.571  -1.911
 1060   3HZ   LYS 127           HZ2      LYS 127 -13.789  -6.680  -1.018
 1061    OH   TYR 128           OH       TYR 128  -8.470   2.868  -1.220
 1062    H    TYR 128           HN       TYR 128 -12.423   0.205  -5.703
 1063    HA   TYR 128           HA       TYR 128 -13.771   1.653  -3.627
 1064   1HB   TYR 128           HB2      TYR 128 -12.227   2.442  -6.076
 1065   2HB   TYR 128           HB1      TYR 128 -13.098   3.665  -5.158
 1066    HD1  TYR 128           HD1      TYR 128 -11.351   0.583  -3.900
 1067    HD2  TYR 128           HD2      TYR 128 -11.433   4.877  -4.034
 1068    HE1  TYR 128           HE1      TYR 128  -9.548   0.667  -2.210
 1069    HE2  TYR 128           HE2      TYR 128  -9.626   4.951  -2.341
 1070    HH   TYR 128           HH       TYR 128  -8.872   2.742  -0.357
 1071    H    SER 129           HN       SER 129 -14.925   0.538  -6.667
 1072    HA   SER 129           HA       SER 129 -16.973   2.657  -6.864
 1073   1HB   SER 129           HB2      SER 129 -17.677   1.432  -8.904
 1074   2HB   SER 129           HB1      SER 129 -15.962   1.832  -8.940
 1075    HG   SER 129           HG       SER 129 -16.943  -0.501  -9.300
 1076    H    LYS 130           HN       LYS 130 -17.140   1.126  -4.468
 1077    HA   LYS 130           HA       LYS 130 -19.874   0.128  -4.734
 1078   1HB   LYS 130           HB2      LYS 130 -17.748  -1.714  -4.981
 1079   2HB   LYS 130           HB1      LYS 130 -18.394  -1.935  -3.355
 1080   1HG   LYS 130           HG2      LYS 130 -19.862  -3.295  -4.492
 1081   2HG   LYS 130           HG1      LYS 130 -20.717  -1.765  -4.687
 1082   1HD   LYS 130           HD2      LYS 130 -20.425  -1.812  -6.921
 1083   2HD   LYS 130           HD1      LYS 130 -18.689  -2.064  -6.736
 1084   1HE   LYS 130           HE2      LYS 130 -19.535  -4.522  -6.056
 1085   2HE   LYS 130           HE1      LYS 130 -20.864  -4.063  -7.121
 1086   1HZ   LYS 130           HZ1      LYS 130 -18.050  -3.682  -7.930
 1087   2HZ   LYS 130           HZ3      LYS 130 -18.831  -5.170  -8.157
 1088   3HZ   LYS 130           HZ2      LYS 130 -19.435  -3.771  -8.910
 1089    H    CYS 131           HN       CYS 131 -18.249   2.175  -3.209
 1090    HA   CYS 131           HA       CYS 131 -18.438   1.206  -0.427
 1091   1HB   CYS 131           HB2      CYS 131 -16.675   2.881  -1.498
 1092   2HB   CYS 131           HB1      CYS 131 -17.912   4.075  -1.104
 1093    H    SER 132           HN       SER 132 -20.212   3.255  -2.665
 1094    HA   SER 132           HA       SER 132 -21.910   4.482  -0.670
 1095   1HB   SER 132           HB2      SER 132 -23.396   4.936  -2.693
 1096   2HB   SER 132           HB1      SER 132 -21.757   5.571  -2.797
 1097    HG   SER 132           HG       SER 132 -22.384   4.446  -4.694
 1098    H    SER 133           HN       SER 133 -24.240   3.996  -0.419
 1099    HA   SER 133           HA       SER 133 -25.215   1.381  -1.302
 1100   1HB   SER 133           HB2      SER 133 -24.973   1.812   1.677
 1101   2HB   SER 133           HB1      SER 133 -25.370   0.325   0.821
 1102    HG   SER 133           HG       SER 133 -23.302  -0.030   0.966
   
  Start of MODEL           2
 Raw file had 1102 H/Q atoms
  Start of MODEL    2
    1   1H    GLU   1           HT3      GLU   1 -20.647  21.993   3.002
    2   2H    GLU   1           HT2      GLU   1 -20.633  22.286   4.675
    3   3H    GLU   1           HT1      GLU   1 -19.172  22.195   3.814
    4    HA   GLU   1           HA       GLU   1 -19.515  19.870   3.361
    5   1HB   GLU   1           HB2      GLU   1 -18.681  20.878   5.687
    6   2HB   GLU   1           HB1      GLU   1 -20.140  20.084   6.276
    7   1HG   GLU   1           HG2      GLU   1 -19.188  18.087   4.759
    8   2HG   GLU   1           HG1      GLU   1 -17.660  18.884   5.138
    9    H    ALA   2           HN       ALA   2 -21.724  20.037   2.222
   10    HA   ALA   2           HA       ALA   2 -23.631  18.393   3.749
   11   1HB   ALA   2           HB1      ALA   2 -23.995  21.158   3.695
   12   2HB   ALA   2           HB3      ALA   2 -25.062  20.564   2.423
   13   3HB   ALA   2           HB2      ALA   2 -25.230  19.957   4.070
   14    H    GLU   3           HN       GLU   3 -21.936  18.044   1.373
   15    HA   GLU   3           HA       GLU   3 -23.928  17.951  -0.830
   16   1HB   GLU   3           HB2      GLU   3 -21.459  18.784  -1.046
   17   2HB   GLU   3           HB1      GLU   3 -21.060  17.066  -1.067
   18   1HG   GLU   3           HG2      GLU   3 -21.489  17.151  -3.286
   19   2HG   GLU   3           HG1      GLU   3 -23.191  17.231  -2.829
   20    H    ALA   4           HN       ALA   4 -21.808  15.815   1.069
   21    HA   ALA   4           HA       ALA   4 -23.660  13.582   0.542
   22   1HB   ALA   4           HB2      ALA   4 -21.909  13.613  -1.318
   23   2HB   ALA   4           HB1      ALA   4 -20.715  13.250  -0.073
   24   3HB   ALA   4           HB3      ALA   4 -22.022  12.112  -0.401
   25    H    HIS   5           HN       HIS   5 -21.926  11.552   1.544
   26    HA   HIS   5           HA       HIS   5 -21.824  12.395   4.386
   27   1HB   HIS   5           HB2      HIS   5 -21.705   9.690   3.026
   28   2HB   HIS   5           HB1      HIS   5 -21.453   9.905   4.759
   29    HD1  HIS   5           HD1      HIS   5 -23.497  10.643   6.191
   30    HD2  HIS   5           HD2      HIS   5 -24.393  10.062   2.161
   31    HE1  HIS   5           HE1      HIS   5 -26.023  10.620   6.015
   32    H    LYS   6           HN       LYS   6 -19.757  10.036   2.695
   33    HA   LYS   6           HA       LYS   6 -17.380  11.623   2.697
   34   1HB   LYS   6           HB2      LYS   6 -17.956  11.183   5.240
   35   2HB   LYS   6           HB1      LYS   6 -17.248   9.603   4.903
   36   1HG   LYS   6           HG2      LYS   6 -15.143  10.447   4.700
   37   2HG   LYS   6           HG1      LYS   6 -15.704  11.894   3.858
   38   1HD   LYS   6           HD2      LYS   6 -15.871  13.096   5.779
   39   2HD   LYS   6           HD1      LYS   6 -16.540  11.735   6.680
   40   1HE   LYS   6           HE2      LYS   6 -13.734  11.347   5.910
   41   2HE   LYS   6           HE1      LYS   6 -13.981  12.730   6.977
   42   1HZ   LYS   6           HZ1      LYS   6 -15.297  11.233   8.428
   43   2HZ   LYS   6           HZ3      LYS   6 -14.825   9.927   7.456
   44   3HZ   LYS   6           HZ2      LYS   6 -13.656  10.808   8.316
   45    H    CYS   7           HN       CYS   7 -17.078  10.544   0.709
   46    HA   CYS   7           HA       CYS   7 -15.899   7.857   0.959
   47   1HB   CYS   7           HB2      CYS   7 -18.222   7.278   0.564
   48   2HB   CYS   7           HB1      CYS   7 -18.316   8.410  -0.784
   49    H    ASP   8           HN       ASP   8 -17.157   9.767  -1.796
   50    HA   ASP   8           HA       ASP   8 -14.938   9.309  -3.478
   51   1HB   ASP   8           HB2      ASP   8 -16.253  10.480  -4.870
   52   2HB   ASP   8           HB1      ASP   8 -17.286  10.925  -3.510
   53    H    ILE   9           HN       ILE   9 -15.244  11.483  -0.772
   54    HA   ILE   9           HA       ILE   9 -13.125  13.282  -1.523
   55    HB   ILE   9           HB       ILE   9 -14.404  12.623   1.133
   56   1HG1  ILE   9          HG12      ILE   9 -14.539  15.087  -0.632
   57   2HG1  ILE   9          HG11      ILE   9 -15.744  13.799  -0.638
   58   1HG2  ILE   9          HG22      ILE   9 -12.143  14.479   0.426
   59   2HG2  ILE   9          HG21      ILE   9 -13.249  14.890   1.737
   60   3HG2  ILE   9          HG23      ILE   9 -12.302  13.405   1.817
   61   1HD1  ILE   9          HD12      ILE   9 -15.004  15.035   1.985
   62   2HD1  ILE   9          HD11      ILE   9 -16.057  15.942   0.899
   63   3HD1  ILE   9          HD13      ILE   9 -16.541  14.343   1.467
   64    H    THR  10           HN       THR  10 -12.881  11.329   1.439
   65    HA   THR  10           HA       THR  10 -10.033  11.197   1.286
   66    HB   THR  10           HB       THR  10 -11.951   9.444   2.842
   67    HG1  THR  10           HG1      THR  10 -11.933  11.006   4.279
   68   1HG2  THR  10          HG23      THR  10  -8.969   9.928   3.085
   69   2HG2  THR  10          HG22      THR  10  -9.942   9.154   4.337
   70   3HG2  THR  10          HG21      THR  10  -9.775   8.394   2.755
   71    H    LEU  11           HN       LEU  11 -12.512   8.887   0.239
   72    HA   LEU  11           HA       LEU  11 -10.739   6.705  -0.215
   73   1HB   LEU  11           HB2      LEU  11 -13.282   6.616  -0.192
   74   2HB   LEU  11           HB1      LEU  11 -13.230   7.253  -1.836
   75    HG   LEU  11           HG       LEU  11 -11.827   5.356  -2.537
   76   1HD1  LEU  11          HD11      LEU  11 -11.995   4.734   0.395
   77   2HD1  LEU  11          HD13      LEU  11 -11.856   3.403  -0.754
   78   3HD1  LEU  11          HD12      LEU  11 -10.604   4.643  -0.685
   79   1HD2  LEU  11          HD21      LEU  11 -14.560   5.151  -1.530
   80   2HD2  LEU  11          HD23      LEU  11 -13.873   4.536  -3.032
   81   3HD2  LEU  11          HD22      LEU  11 -13.741   3.589  -1.551
   82    H    GLN  12           HN       GLN  12 -11.990   9.091  -2.615
   83    HA   GLN  12           HA       GLN  12 -10.435   8.081  -4.775
   84   1HB   GLN  12           HB2      GLN  12 -11.169   9.905  -5.976
   85   2HB   GLN  12           HB1      GLN  12 -12.328   9.967  -4.650
   86   1HG   GLN  12           HG2      GLN  12 -10.751  11.537  -3.455
   87   2HG   GLN  12           HG1      GLN  12  -9.782  11.586  -4.930
   88   1HE2  GLN  12          HE22      GLN  12 -11.944  14.440  -5.476
   89   2HE2  GLN  12          HE21      GLN  12 -10.490  14.013  -4.710
   90    H    GLU  13           HN       GLU  13  -9.635  10.421  -2.238
   91    HA   GLU  13           HA       GLU  13  -7.109  11.236  -3.329
   92   1HB   GLU  13           HB2      GLU  13  -8.557  11.518  -0.812
   93   2HB   GLU  13           HB1      GLU  13  -6.827  11.291  -0.546
   94   1HG   GLU  13           HG2      GLU  13  -6.333  13.341  -1.365
   95   2HG   GLU  13           HG1      GLU  13  -7.397  13.125  -2.756
   96    H    ILE  14           HN       ILE  14  -8.143   8.465  -1.440
   97    HA   ILE  14           HA       ILE  14  -5.505   7.498  -0.778
   98    HB   ILE  14           HB       ILE  14  -8.278   6.611  -0.482
   99   1HG1  ILE  14          HG12      ILE  14  -5.999   5.507   1.101
  100   2HG1  ILE  14          HG11      ILE  14  -6.283   7.247   1.188
  101   1HG2  ILE  14          HG21      ILE  14  -6.137   4.558  -1.128
  102   2HG2  ILE  14          HG23      ILE  14  -7.667   4.171  -0.344
  103   3HG2  ILE  14          HG22      ILE  14  -7.660   4.808  -1.986
  104   1HD1  ILE  14          HD13      ILE  14  -8.835   6.211   1.414
  105   2HD1  ILE  14          HD12      ILE  14  -7.864   5.041   2.307
  106   3HD1  ILE  14          HD11      ILE  14  -7.830   6.745   2.764
  107    H    ILE  15           HN       ILE  15  -7.680   7.123  -3.519
  108    HA   ILE  15           HA       ILE  15  -6.295   4.940  -4.782
  109    HB   ILE  15           HB       ILE  15  -8.215   7.063  -5.696
  110   1HG1  ILE  15          HG12      ILE  15  -8.350   4.060  -6.029
  111   2HG1  ILE  15          HG11      ILE  15  -8.843   4.849  -4.530
  112   1HG2  ILE  15          HG21      ILE  15  -6.569   5.220  -7.433
  113   2HG2  ILE  15          HG23      ILE  15  -8.122   5.866  -7.961
  114   3HG2  ILE  15          HG22      ILE  15  -6.789   6.963  -7.596
  115   1HD1  ILE  15          HD11      ILE  15  -9.920   6.006  -7.048
  116   2HD1  ILE  15          HD13      ILE  15 -10.552   4.428  -6.576
  117   3HD1  ILE  15          HD12      ILE  15 -10.701   5.802  -5.480
  118    H    LYS  16           HN       LYS  16  -5.993   8.469  -4.979
  119    HA   LYS  16           HA       LYS  16  -4.013   8.492  -7.063
  120   1HB   LYS  16           HB2      LYS  16  -5.346  10.407  -5.396
  121   2HB   LYS  16           HB1      LYS  16  -3.610  10.712  -5.320
  122   1HG   LYS  16           HG2      LYS  16  -4.454  11.959  -7.195
  123   2HG   LYS  16           HG1      LYS  16  -3.581  10.576  -7.852
  124   1HD   LYS  16           HD2      LYS  16  -5.465  10.152  -9.030
  125   2HD   LYS  16           HD1      LYS  16  -6.135   9.572  -7.505
  126   1HE   LYS  16           HE2      LYS  16  -7.725  11.158  -8.175
  127   2HE   LYS  16           HE1      LYS  16  -6.699  12.092  -7.084
  128   1HZ   LYS  16           HZ2      LYS  16  -5.437  12.849  -9.029
  129   2HZ   LYS  16           HZ1      LYS  16  -6.514  12.019 -10.048
  130   3HZ   LYS  16           HZ3      LYS  16  -7.068  13.316  -9.106
  131    H    THR  17           HN       THR  17  -3.834   8.205  -3.549
  132    HA   THR  17           HA       THR  17  -0.998   8.576  -3.312
  133    HB   THR  17           HB       THR  17  -2.469   6.692  -1.502
  134    HG1  THR  17           HG1      THR  17  -2.734   9.448  -1.143
  135   1HG2  THR  17          HG21      THR  17  -0.064   7.382  -1.176
  136   2HG2  THR  17          HG23      THR  17  -0.635   9.033  -0.928
  137   3HG2  THR  17          HG22      THR  17  -1.117   7.755   0.188
  138    H    LEU  18           HN       LEU  18  -3.007   5.704  -3.911
  139    HA   LEU  18           HA       LEU  18  -0.916   3.782  -3.713
  140   1HB   LEU  18           HB2      LEU  18  -3.575   3.581  -4.101
  141   2HB   LEU  18           HB1      LEU  18  -3.025   3.331  -5.758
  142    HG   LEU  18           HG       LEU  18  -2.399   1.697  -3.301
  143   1HD1  LEU  18          HD11      LEU  18  -3.976   1.423  -5.704
  144   2HD1  LEU  18          HD13      LEU  18  -2.751   0.157  -5.644
  145   3HD1  LEU  18          HD12      LEU  18  -3.888   0.346  -4.309
  146   1HD2  LEU  18          HD23      LEU  18  -0.802   1.914  -5.867
  147   2HD2  LEU  18          HD22      LEU  18  -0.210   2.036  -4.210
  148   3HD2  LEU  18          HD21      LEU  18  -0.746   0.482  -4.842
  149    H    ASN  19           HN       ASN  19  -2.265   5.405  -6.600
  150    HA   ASN  19           HA       ASN  19  -0.566   4.318  -8.547
  151   1HB   ASN  19           HB2      ASN  19  -2.421   5.742  -9.168
  152   2HB   ASN  19           HB1      ASN  19  -1.704   7.118  -8.330
  153   1HD2  ASN  19          HD22      ASN  19   0.080   8.083 -11.193
  154   2HD2  ASN  19          HD21      ASN  19  -0.690   8.530  -9.748
  155    H    SER  20           HN       SER  20   0.038   7.111  -6.421
  156    HA   SER  20           HA       SER  20   2.519   7.911  -7.543
  157   1HB   SER  20           HB2      SER  20   1.197   9.164  -5.798
  158   2HB   SER  20           HB1      SER  20   1.770   7.998  -4.608
  159    HG   SER  20           HG       SER  20   3.285   9.522  -4.511
  160    H    LEU  21           HN       LEU  21   1.825   5.526  -4.977
  161    HA   LEU  21           HA       LEU  21   4.623   4.881  -4.561
  162   1HB   LEU  21           HB2      LEU  21   2.139   3.302  -3.833
  163   2HB   LEU  21           HB1      LEU  21   3.763   3.020  -3.202
  164    HG   LEU  21           HG       LEU  21   2.417   5.710  -2.949
  165   1HD1  LEU  21          HD11      LEU  21   1.892   3.199  -1.477
  166   2HD1  LEU  21          HD13      LEU  21   2.209   4.606  -0.461
  167   3HD1  LEU  21          HD12      LEU  21   0.892   4.644  -1.634
  168   1HD2  LEU  21          HD21      LEU  21   4.798   4.302  -1.771
  169   2HD2  LEU  21          HD23      LEU  21   4.691   5.929  -2.442
  170   3HD2  LEU  21          HD22      LEU  21   4.005   5.582  -0.855
  171    H    THR  22           HN       THR  22   2.299   3.908  -6.937
  172    HA   THR  22           HA       THR  22   3.623   1.360  -7.529
  173    HB   THR  22           HB       THR  22   1.834   2.549  -9.560
  174    HG1  THR  22           HG1      THR  22   0.036   2.408  -8.271
  175   1HG2  THR  22          HG21      THR  22   2.038  -0.072  -8.059
  176   2HG2  THR  22          HG23      THR  22   0.754   0.272  -9.218
  177   3HG2  THR  22          HG22      THR  22   2.435   0.235  -9.750
  178    H    GLU  23           HN       GLU  23   4.448   4.558  -8.136
  179    HA   GLU  23           HA       GLU  23   5.359   4.257 -10.880
  180   1HB   GLU  23           HB2      GLU  23   5.331   6.354  -8.827
  181   2HB   GLU  23           HB1      GLU  23   6.793   6.366  -9.811
  182   1HG   GLU  23           HG2      GLU  23   5.660   7.290 -11.518
  183   2HG   GLU  23           HG1      GLU  23   4.539   5.929 -11.533
  184    H    GLN  24           HN       GLN  24   6.596   3.205  -7.856
  185    HA   GLN  24           HA       GLN  24   9.302   2.897  -9.087
  186   1HB   GLN  24           HB2      GLN  24   8.883   4.327  -6.879
  187   2HB   GLN  24           HB1      GLN  24   8.932   2.729  -6.130
  188   1HG   GLN  24           HG2      GLN  24  11.187   3.543  -6.121
  189   2HG   GLN  24           HG1      GLN  24  11.101   2.331  -7.400
  190   1HE2  GLN  24          HE22      GLN  24  12.664   4.881  -9.354
  191   2HE2  GLN  24          HE21      GLN  24  12.940   3.452  -8.480
  192    H    LYS  25           HN       LYS  25   8.337   0.920 -10.008
  193    HA   LYS  25           HA       LYS  25   8.252  -1.292  -7.999
  194   1HB   LYS  25           HB2      LYS  25   6.994  -2.354 -10.196
  195   2HB   LYS  25           HB1      LYS  25   6.159  -1.631  -8.827
  196   1HG   LYS  25           HG2      LYS  25   5.264  -0.632 -10.828
  197   2HG   LYS  25           HG1      LYS  25   6.258   0.589 -10.043
  198   1HD   LYS  25           HD2      LYS  25   8.146  -0.500 -11.601
  199   2HD   LYS  25           HD1      LYS  25   6.741  -0.916 -12.577
  200   1HE   LYS  25           HE2      LYS  25   6.786   1.858 -11.543
  201   2HE   LYS  25           HE1      LYS  25   8.035   1.478 -12.729
  202   1HZ   LYS  25           HZ2      LYS  25   5.813   0.338 -13.778
  203   2HZ   LYS  25           HZ1      LYS  25   5.199   1.760 -13.081
  204   3HZ   LYS  25           HZ3      LYS  25   6.447   1.848 -14.226
  205    H    THR  26           HN       THR  26  10.718  -0.859  -8.604
  206    HA   THR  26           HA       THR  26  11.487  -3.070 -10.357
  207    HB   THR  26           HB       THR  26  12.580  -0.364 -11.108
  208    HG1  THR  26           HG1      THR  26  10.464  -1.625 -12.473
  209   1HG2  THR  26          HG21      THR  26  12.722  -3.145 -12.077
  210   2HG2  THR  26          HG23      THR  26  12.480  -1.938 -13.340
  211   3HG2  THR  26          HG22      THR  26  13.875  -1.825 -12.267
  212    H    LEU  27           HN       LEU  27  12.792  -0.083  -8.853
  213    HA   LEU  27           HA       LEU  27  15.230  -1.563  -8.097
  214   1HB   LEU  27           HB2      LEU  27  14.548   1.188  -8.577
  215   2HB   LEU  27           HB1      LEU  27  15.243   1.036  -6.963
  216    HG   LEU  27           HG       LEU  27  17.139  -0.263  -7.956
  217   1HD1  LEU  27          HD12      LEU  27  15.409  -0.025 -10.304
  218   2HD1  LEU  27          HD11      LEU  27  17.066   0.483 -10.632
  219   3HD1  LEU  27          HD13      LEU  27  16.748  -1.135 -10.006
  220   1HD2  LEU  27          HD21      LEU  27  16.515   2.568  -8.739
  221   2HD2  LEU  27          HD23      LEU  27  17.743   1.963  -7.627
  222   3HD2  LEU  27          HD22      LEU  27  17.979   1.812  -9.368
  223    H    CYS  28           HN       CYS  28  12.447  -0.029  -6.513
  224    HA   CYS  28           HA       CYS  28  13.489  -0.809  -3.861
  225   1HB   CYS  28           HB2      CYS  28  11.790   1.233  -4.804
  226   2HB   CYS  28           HB1      CYS  28  10.775   0.180  -3.820
  227    H    THR  29           HN       THR  29  11.109  -1.897  -6.192
  228    HA   THR  29           HA       THR  29   9.833  -3.695  -4.238
  229    HB   THR  29           HB       THR  29   8.511  -4.432  -6.262
  230    HG1  THR  29           HG1      THR  29  10.465  -3.405  -7.543
  231   1HG2  THR  29          HG23      THR  29   7.914  -2.518  -4.677
  232   2HG2  THR  29          HG22      THR  29   8.542  -1.429  -5.914
  233   3HG2  THR  29          HG21      THR  29   7.160  -2.467  -6.270
  234    H    GLU  30           HN       GLU  30  12.768  -3.937  -5.533
  235    HA   GLU  30           HA       GLU  30  12.629  -6.558  -6.791
  236   1HB   GLU  30           HB2      GLU  30  15.079  -6.461  -6.756
  237   2HB   GLU  30           HB1      GLU  30  14.418  -4.929  -7.326
  238   1HG   GLU  30           HG2      GLU  30  15.422  -3.829  -5.642
  239   2HG   GLU  30           HG1      GLU  30  14.625  -4.861  -4.455
  240    H    LEU  31           HN       LEU  31  12.233  -5.716  -3.571
  241    HA   LEU  31           HA       LEU  31  13.773  -7.978  -2.512
  242   1HB   LEU  31           HB2      LEU  31  11.795  -6.187  -1.065
  243   2HB   LEU  31           HB1      LEU  31  13.042  -7.203  -0.341
  244    HG   LEU  31           HG       LEU  31  13.628  -4.910  -2.233
  245   1HD1  LEU  31          HD12      LEU  31  12.554  -4.186  -0.078
  246   2HD1  LEU  31          HD11      LEU  31  13.870  -4.977   0.789
  247   3HD1  LEU  31          HD13      LEU  31  14.209  -3.607  -0.268
  248   1HD2  LEU  31          HD23      LEU  31  15.178  -7.075  -1.201
  249   2HD2  LEU  31          HD22      LEU  31  15.734  -5.716  -2.177
  250   3HD2  LEU  31          HD21      LEU  31  15.739  -5.598  -0.418
  251    H    THR  32           HN       THR  32  10.961  -7.941  -0.738
  252    HA   THR  32           HA       THR  32   9.183  -9.398  -2.484
  253    HB   THR  32           HB       THR  32   9.452 -11.503  -0.856
  254    HG1  THR  32           HG1      THR  32  11.852 -11.720  -0.691
  255   1HG2  THR  32          HG21      THR  32   9.869 -11.102  -3.460
  256   2HG2  THR  32          HG23      THR  32  11.550 -11.325  -2.975
  257   3HG2  THR  32          HG22      THR  32  10.368 -12.597  -2.669
  258    H    VAL  33           HN       VAL  33   7.309 -10.312  -1.101
  259    HA   VAL  33           HA       VAL  33   7.135  -9.247   1.630
  260    HB   VAL  33           HB       VAL  33   4.958  -7.992   0.923
  261   1HG1  VAL  33          HG11      VAL  33   7.395  -7.130   1.578
  262   2HG1  VAL  33          HG13      VAL  33   7.403  -6.612  -0.108
  263   3HG1  VAL  33          HG12      VAL  33   6.160  -6.016   0.992
  264   1HG2  VAL  33          HG23      VAL  33   5.109  -8.945  -1.425
  265   2HG2  VAL  33          HG22      VAL  33   4.911  -7.195  -1.348
  266   3HG2  VAL  33          HG21      VAL  33   6.497  -7.889  -1.684
  267    H    THR  34           HN       THR  34   4.536  -9.465   2.185
  268    HA   THR  34           HA       THR  34   4.018 -12.324   1.814
  269    HB   THR  34           HB       THR  34   3.433 -10.413   3.788
  270    HG1  THR  34           HG1      THR  34   3.773 -12.429   4.423
  271   1HG2  THR  34          HG22      THR  34   1.396  -9.827   2.469
  272   2HG2  THR  34          HG21      THR  34   0.870 -11.508   2.594
  273   3HG2  THR  34          HG23      THR  34   1.017 -10.519   4.045
  274    H    ASP  35           HN       ASP  35   2.175 -13.199   0.781
  275    HA   ASP  35           HA       ASP  35   0.878 -11.352  -1.177
  276   1HB   ASP  35           HB2      ASP  35   2.222 -13.539  -1.836
  277   2HB   ASP  35           HB1      ASP  35   0.716 -14.342  -1.389
  278    H    ILE  36           HN       ILE  36  -0.891 -10.619   0.006
  279    HA   ILE  36           HA       ILE  36  -2.560 -12.585   1.455
  280    HB   ILE  36           HB       ILE  36  -3.565 -10.749   2.511
  281   1HG1  ILE  36          HG12      ILE  36  -2.803  -9.263  -0.005
  282   2HG1  ILE  36          HG11      ILE  36  -4.405  -9.476   0.703
  283   1HG2  ILE  36          HG21      ILE  36  -1.042 -10.924   2.865
  284   2HG2  ILE  36          HG23      ILE  36  -0.883  -9.580   1.734
  285   3HG2  ILE  36          HG22      ILE  36  -1.758  -9.358   3.249
  286   1HD1  ILE  36          HD12      ILE  36  -3.243  -8.210   2.755
  287   2HD1  ILE  36          HD11      ILE  36  -2.241  -7.566   1.453
  288   3HD1  ILE  36          HD13      ILE  36  -3.988  -7.329   1.422
  289    H    PHE  37           HN       PHE  37  -2.358 -12.253  -1.648
  290    HA   PHE  37           HA       PHE  37  -5.283 -11.856  -2.114
  291   1HB   PHE  37           HB2      PHE  37  -2.970 -11.666  -4.070
  292   2HB   PHE  37           HB1      PHE  37  -4.671 -11.431  -4.476
  293    HD1  PHE  37           HD1      PHE  37  -1.840 -10.096  -2.472
  294    HD2  PHE  37           HD2      PHE  37  -5.806  -9.385  -3.964
  295    HE1  PHE  37           HE1      PHE  37  -1.687  -7.728  -1.754
  296    HE2  PHE  37           HE2      PHE  37  -5.648  -7.018  -3.245
  297    HZ   PHE  37           HZ       PHE  37  -3.594  -6.190  -2.141
  298    H    ALA  38           HN       ALA  38  -2.525 -13.985  -2.662
  299    HA   ALA  38           HA       ALA  38  -3.731 -15.874  -4.389
  300   1HB   ALA  38           HB3      ALA  38  -1.290 -15.689  -3.321
  301   2HB   ALA  38           HB2      ALA  38  -1.966 -16.862  -2.191
  302   3HB   ALA  38           HB1      ALA  38  -1.919 -17.225  -3.915
  303    H    ALA  39           HN       ALA  39  -4.147 -15.345  -0.943
  304    HA   ALA  39           HA       ALA  39  -5.931 -17.742  -0.844
  305   1HB   ALA  39           HB2      ALA  39  -3.941 -17.513   0.782
  306   2HB   ALA  39           HB1      ALA  39  -4.880 -16.235   1.554
  307   3HB   ALA  39           HB3      ALA  39  -5.515 -17.879   1.488
  308    H    SER  40           HN       SER  40  -7.871 -16.821  -1.565
  309    HA   SER  40           HA       SER  40  -9.044 -14.786   0.268
  310   1HB   SER  40           HB2      SER  40  -9.683 -13.351  -1.437
  311   2HB   SER  40           HB1      SER  40  -8.155 -13.938  -2.086
  312    HG   SER  40           HG       SER  40  -9.723 -14.162  -3.659
  313    H    LYS  41           HN       LYS  41 -11.444 -14.800   0.188
  314    HA   LYS  41           HA       LYS  41 -12.809 -16.944  -1.230
  315   1HB   LYS  41           HB2      LYS  41 -11.579 -17.669   1.171
  316   2HB   LYS  41           HB1      LYS  41 -13.264 -17.396   1.614
  317   1HG   LYS  41           HG2      LYS  41 -14.040 -18.965  -0.029
  318   2HG   LYS  41           HG1      LYS  41 -12.440 -19.079  -0.763
  319   1HD   LYS  41           HD2      LYS  41 -11.713 -20.575   0.779
  320   2HD   LYS  41           HD1      LYS  41 -12.463 -19.695   2.111
  321   1HE   LYS  41           HE2      LYS  41 -13.525 -21.890   1.862
  322   2HE   LYS  41           HE1      LYS  41 -14.673 -20.616   1.448
  323   1HZ   LYS  41           HZ3      LYS  41 -13.000 -21.922  -0.607
  324   2HZ   LYS  41           HZ2      LYS  41 -14.491 -22.580  -0.126
  325   3HZ   LYS  41           HZ1      LYS  41 -14.426 -21.030  -0.818
  326    H    ASP  42           HN       ASP  42 -12.969 -14.764   1.601
  327    HA   ASP  42           HA       ASP  42 -15.446 -13.599   0.518
  328   1HB   ASP  42           HB2      ASP  42 -15.423 -15.540   2.719
  329   2HB   ASP  42           HB1      ASP  42 -16.209 -14.022   3.148
  330    H    THR  43           HN       THR  43 -12.743 -12.637   1.068
  331    HA   THR  43           HA       THR  43 -12.955 -10.995   3.497
  332    HB   THR  43           HB       THR  43 -10.764 -10.020   2.518
  333    HG1  THR  43           HG1      THR  43 -10.547 -12.341   1.048
  334   1HG2  THR  43          HG23      THR  43 -11.341 -12.666   3.678
  335   2HG2  THR  43          HG22      THR  43  -9.769 -12.549   2.886
  336   3HG2  THR  43          HG21      THR  43 -10.182 -11.439   4.192
  337    H    THR  44           HN       THR  44 -13.075  -8.676   3.468
  338    HA   THR  44           HA       THR  44 -14.470  -7.631   1.064
  339    HB   THR  44           HB       THR  44 -14.267  -5.775   3.293
  340    HG1  THR  44           HG1      THR  44 -14.358  -7.274   4.773
  341   1HG2  THR  44          HG23      THR  44 -16.367  -7.061   1.595
  342   2HG2  THR  44          HG22      THR  44 -16.865  -6.293   3.102
  343   3HG2  THR  44          HG21      THR  44 -16.036  -5.350   1.863
  344    H    GLU  45           HN       GLU  45 -13.957  -5.077   0.857
  345    HA   GLU  45           HA       GLU  45 -11.131  -4.975   0.115
  346   1HB   GLU  45           HB2      GLU  45 -11.649  -3.001  -1.030
  347   2HB   GLU  45           HB1      GLU  45 -13.181  -3.871  -1.091
  348   1HG   GLU  45           HG2      GLU  45 -13.841  -2.635   1.028
  349   2HG   GLU  45           HG1      GLU  45 -12.408  -1.631   0.792
  350    H    LYS  46           HN       LYS  46 -13.193  -3.590   2.643
  351    HA   LYS  46           HA       LYS  46 -11.183  -1.803   3.683
  352   1HB   LYS  46           HB2      LYS  46 -12.924  -1.132   4.939
  353   2HB   LYS  46           HB1      LYS  46 -13.888  -2.445   4.270
  354   1HG   LYS  46           HG2      LYS  46 -13.058  -3.962   6.036
  355   2HG   LYS  46           HG1      LYS  46 -12.081  -2.652   6.705
  356   1HD   LYS  46           HD2      LYS  46 -13.849  -1.912   7.873
  357   2HD   LYS  46           HD1      LYS  46 -14.768  -1.713   6.382
  358   1HE   LYS  46           HE2      LYS  46 -14.446  -4.412   7.697
  359   2HE   LYS  46           HE1      LYS  46 -15.749  -3.310   8.147
  360   1HZ   LYS  46           HZ2      LYS  46 -15.577  -3.469   5.341
  361   2HZ   LYS  46           HZ1      LYS  46 -15.661  -5.042   5.977
  362   3HZ   LYS  46           HZ3      LYS  46 -16.868  -3.911   6.353
  363    H    GLU  47           HN       GLU  47 -12.117  -5.151   4.418
  364    HA   GLU  47           HA       GLU  47 -10.258  -5.458   6.605
  365   1HB   GLU  47           HB2      GLU  47 -12.270  -7.014   5.433
  366   2HB   GLU  47           HB1      GLU  47 -10.786  -7.920   5.137
  367   1HG   GLU  47           HG2      GLU  47 -11.763  -6.902   7.822
  368   2HG   GLU  47           HG1      GLU  47 -11.711  -8.585   7.294
  369    H    THR  48           HN       THR  48 -10.087  -5.951   3.109
  370    HA   THR  48           HA       THR  48  -7.484  -7.202   3.126
  371    HB   THR  48           HB       THR  48  -8.821  -5.616   0.912
  372    HG1  THR  48           HG1      THR  48  -8.769  -8.413   1.322
  373   1HG2  THR  48          HG21      THR  48  -6.264  -6.972   1.156
  374   2HG2  THR  48          HG23      THR  48  -7.246  -7.686  -0.124
  375   3HG2  THR  48          HG22      THR  48  -6.871  -5.963  -0.158
  376    H    PHE  49           HN       PHE  49  -8.565  -3.877   3.338
  377    HA   PHE  49           HA       PHE  49  -6.000  -2.738   2.557
  378   1HB   PHE  49           HB2      PHE  49  -8.435  -1.583   3.940
  379   2HB   PHE  49           HB1      PHE  49  -6.981  -0.635   3.636
  380    HD1  PHE  49           HD2      PHE  49  -6.132  -1.632   0.975
  381    HD2  PHE  49           HD1      PHE  49 -10.054  -0.722   2.475
  382    HE1  PHE  49           HE2      PHE  49  -6.919  -1.212  -1.336
  383    HE2  PHE  49           HE1      PHE  49 -10.837  -0.299   0.162
  384    HZ   PHE  49           HZ       PHE  49  -9.272  -0.546  -1.743
  385    H    CYS  50           HN       CYS  50  -7.557  -3.697   5.575
  386    HA   CYS  50           HA       CYS  50  -5.634  -2.477   7.332
  387   1HB   CYS  50           HB2      CYS  50  -7.791  -3.248   8.181
  388   2HB   CYS  50           HB1      CYS  50  -7.403  -4.909   7.728
  389    NH1  ARG  51           NH2      ARG  51  -6.283 -12.703   5.812
  390    NH2  ARG  51           NH1      ARG  51  -4.837 -13.325   7.433
  391    H    ARG  51           HN       ARG  51  -5.912  -5.813   6.062
  392    HA   ARG  51           HA       ARG  51  -3.535  -6.813   7.274
  393   1HB   ARG  51           HB2      ARG  51  -5.091  -7.583   4.807
  394   2HB   ARG  51           HB1      ARG  51  -3.589  -8.411   5.222
  395   1HG   ARG  51           HG2      ARG  51  -4.538  -8.859   7.503
  396   2HG   ARG  51           HG1      ARG  51  -6.069  -8.182   6.947
  397   1HD   ARG  51           HD2      ARG  51  -6.618 -10.141   5.995
  398   2HD   ARG  51           HD1      ARG  51  -5.152 -10.097   5.017
  399    HE   ARG  51           HE       ARG  51  -4.277 -10.938   7.512
  400   1HH1  ARG  51          HH21      ARG  51  -6.698 -12.001   5.236
  401   2HH1  ARG  51          HH22      ARG  51  -6.569 -13.656   5.715
  402   1HH2  ARG  51          HH11      ARG  51  -4.136 -13.094   8.109
  403   2HH2  ARG  51          HH12      ARG  51  -5.134 -14.274   7.325
  404    H    ALA  52           HN       ALA  52  -4.022  -5.558   3.956
  405    HA   ALA  52           HA       ALA  52  -1.268  -5.623   3.228
  406   1HB   ALA  52           HB2      ALA  52  -3.731  -4.610   2.116
  407   2HB   ALA  52           HB1      ALA  52  -2.445  -3.420   1.910
  408   3HB   ALA  52           HB3      ALA  52  -2.243  -5.056   1.283
  409    H    ALA  53           HN       ALA  53  -3.006  -3.496   5.349
  410    HA   ALA  53           HA       ALA  53  -1.223  -1.228   5.098
  411   1HB   ALA  53           HB3      ALA  53  -3.552  -1.963   6.687
  412   2HB   ALA  53           HB2      ALA  53  -2.326  -1.163   7.671
  413   3HB   ALA  53           HB1      ALA  53  -2.969  -0.361   6.238
  414    H    THR  54           HN       THR  54  -1.372  -4.102   7.164
  415    HA   THR  54           HA       THR  54   0.780  -3.307   8.916
  416    HB   THR  54           HB       THR  54  -0.788  -5.755   8.383
  417    HG1  THR  54           HG1      THR  54   0.431  -4.947  10.784
  418   1HG2  THR  54          HG21      THR  54   2.086  -5.874   9.321
  419   2HG2  THR  54          HG23      THR  54   0.915  -7.152   9.648
  420   3HG2  THR  54          HG22      THR  54   1.351  -6.761   7.985
  421    H    VAL  55           HN       VAL  55   0.649  -5.430   6.047
  422    HA   VAL  55           HA       VAL  55   3.421  -6.050   5.938
  423    HB   VAL  55           HB       VAL  55   1.461  -5.709   3.642
  424   1HG1  VAL  55          HG13      VAL  55   4.276  -6.647   3.851
  425   2HG1  VAL  55          HG12      VAL  55   3.200  -7.623   2.851
  426   3HG1  VAL  55          HG11      VAL  55   3.433  -5.914   2.486
  427   1HG2  VAL  55          HG21      VAL  55   1.682  -7.654   5.773
  428   2HG2  VAL  55          HG23      VAL  55   0.479  -7.557   4.488
  429   3HG2  VAL  55          HG22      VAL  55   1.989  -8.428   4.219
  430    H    LEU  56           HN       LEU  56   1.609  -3.252   4.783
  431    HA   LEU  56           HA       LEU  56   3.777  -2.063   3.296
  432   1HB   LEU  56           HB2      LEU  56   1.057  -1.366   4.060
  433   2HB   LEU  56           HB1      LEU  56   2.139   0.019   4.204
  434    HG   LEU  56           HG       LEU  56   3.007  -0.667   1.866
  435   1HD1  LEU  56          HD12      LEU  56   1.866  -2.900   1.920
  436   2HD1  LEU  56          HD11      LEU  56   0.314  -2.063   1.842
  437   3HD1  LEU  56          HD13      LEU  56   1.451  -1.941   0.499
  438   1HD2  LEU  56          HD22      LEU  56   0.220   0.429   2.340
  439   2HD2  LEU  56          HD21      LEU  56   1.713   1.350   2.160
  440   3HD2  LEU  56          HD23      LEU  56   1.035   0.492   0.777
  441    NH1  ARG  57           NH2      ARG  57   0.370  -1.097  12.342
  442    NH2  ARG  57           NH1      ARG  57  -0.961  -0.470  10.628
  443    H    ARG  57           HN       ARG  57   2.747  -1.967   6.661
  444    HA   ARG  57           HA       ARG  57   4.308   0.249   7.525
  445   1HB   ARG  57           HB2      ARG  57   2.598  -1.493   8.754
  446   2HB   ARG  57           HB1      ARG  57   4.150  -2.049   9.382
  447   1HG   ARG  57           HG2      ARG  57   4.656   0.064  10.325
  448   2HG   ARG  57           HG1      ARG  57   3.417   0.879   9.369
  449   1HD   ARG  57           HD2      ARG  57   2.793  -1.226  11.453
  450   2HD   ARG  57           HD1      ARG  57   2.787   0.506  11.788
  451    HE   ARG  57           HE       ARG  57   1.136   0.251   9.580
  452   1HH1  ARG  57          HH21      ARG  57   1.273  -1.182  12.758
  453   2HH1  ARG  57          HH22      ARG  57  -0.436  -1.417  12.839
  454   1HH2  ARG  57          HH11      ARG  57  -1.079  -0.069   9.719
  455   2HH2  ARG  57          HH12      ARG  57  -1.759  -0.794  11.139
  456    H    GLN  58           HN       GLN  58   5.095  -3.229   7.371
  457    HA   GLN  58           HA       GLN  58   7.792  -2.953   8.307
  458   1HB   GLN  58           HB2      GLN  58   6.217  -5.031   6.866
  459   2HB   GLN  58           HB1      GLN  58   7.972  -5.128   6.717
  460   1HG   GLN  58           HG2      GLN  58   8.101  -4.941   9.239
  461   2HG   GLN  58           HG1      GLN  58   6.347  -5.131   9.272
  462   1HE2  GLN  58          HE22      GLN  58   8.721  -8.365   8.543
  463   2HE2  GLN  58          HE21      GLN  58   9.392  -6.811   8.665
  464    H    PHE  59           HN       PHE  59   6.297  -2.564   5.149
  465    HA   PHE  59           HA       PHE  59   8.631  -2.626   3.530
  466   1HB   PHE  59           HB2      PHE  59   6.326  -2.583   2.624
  467   2HB   PHE  59           HB1      PHE  59   6.147  -0.919   3.176
  468    HD1  PHE  59           HD1      PHE  59   8.734  -2.918   1.322
  469    HD2  PHE  59           HD2      PHE  59   6.412   0.690   1.522
  470    HE1  PHE  59           HE1      PHE  59   9.812  -2.110  -0.759
  471    HE2  PHE  59           HE2      PHE  59   7.491   1.499  -0.560
  472    HZ   PHE  59           HZ       PHE  59   9.191   0.100  -1.699
  473    OH   TYR  60           OH       TYR  60   5.648   4.129  10.043
  474    H    TYR  60           HN       TYR  60   6.960   0.309   4.749
  475    HA   TYR  60           HA       TYR  60   9.348   1.911   4.198
  476   1HB   TYR  60           HB2      TYR  60   7.960   3.710   4.376
  477   2HB   TYR  60           HB1      TYR  60   6.694   2.491   4.226
  478    HD1  TYR  60           HD2      TYR  60   5.813   1.402   6.394
  479    HD2  TYR  60           HD1      TYR  60   8.123   5.023   6.322
  480    HE1  TYR  60           HE2      TYR  60   4.996   1.969   8.666
  481    HE2  TYR  60           HE1      TYR  60   7.308   5.589   8.594
  482    HH   TYR  60           HH       TYR  60   6.290   3.799  10.677
  483    H    SER  61           HN       SER  61   8.661  -0.151   6.713
  484    HA   SER  61           HA       SER  61   9.647   1.640   8.841
  485   1HB   SER  61           HB2      SER  61   8.580  -1.169   8.764
  486   2HB   SER  61           HB1      SER  61   9.468  -0.597  10.173
  487    HG   SER  61           HG       SER  61   7.977   1.190  10.207
  488    H    HIS  62           HN       HIS  62  10.645  -1.570   7.573
  489    HA   HIS  62           HA       HIS  62  13.338  -1.127   8.693
  490   1HB   HIS  62           HB2      HIS  62  11.764  -3.429   7.748
  491   2HB   HIS  62           HB1      HIS  62  13.472  -3.500   7.317
  492    HD1  HIS  62           HD1      HIS  62  15.204  -3.341   9.334
  493    HD2  HIS  62           HD2      HIS  62  11.226  -3.853  10.469
  494    HE1  HIS  62           HE1      HIS  62  15.237  -4.024  11.772
  495    H    HIS  63           HN       HIS  63  11.774  -1.278   5.515
  496    HA   HIS  63           HA       HIS  63  14.401  -1.053   4.182
  497   1HB   HIS  63           HB2      HIS  63  11.669  -0.985   2.887
  498   2HB   HIS  63           HB1      HIS  63  13.214  -1.339   2.119
  499    HD1  HIS  63           HD1      HIS  63  14.370  -3.629   2.776
  500    HD2  HIS  63           HD2      HIS  63  10.467  -3.181   4.168
  501    HE1  HIS  63           HE1      HIS  63  13.596  -5.933   3.488
  502    H    GLU  64           HN       GLU  64  13.098   1.196   5.877
  503    HA   GLU  64           HA       GLU  64  12.750   3.270   3.801
  504   1HB   GLU  64           HB2      GLU  64  11.310   3.967   5.410
  505   2HB   GLU  64           HB1      GLU  64  12.105   3.009   6.660
  506   1HG   GLU  64           HG2      GLU  64  13.798   4.690   6.982
  507   2HG   GLU  64           HG1      GLU  64  13.259   5.588   5.561
  508    H    LYS  65           HN       LYS  65  15.064   2.270   6.271
  509    HA   LYS  65           HA       LYS  65  16.950   4.336   5.205
  510   1HB   LYS  65           HB2      LYS  65  16.095   4.004   7.840
  511   2HB   LYS  65           HB1      LYS  65  17.668   3.206   7.805
  512   1HG   LYS  65           HG2      LYS  65  17.536   5.815   6.403
  513   2HG   LYS  65           HG1      LYS  65  17.356   5.884   8.156
  514   1HD   LYS  65           HD2      LYS  65  19.441   4.617   8.442
  515   2HD   LYS  65           HD1      LYS  65  19.619   4.495   6.691
  516   1HE   LYS  65           HE2      LYS  65  19.550   7.053   6.651
  517   2HE   LYS  65           HE1      LYS  65  19.754   6.984   8.402
  518   1HZ   LYS  65           HZ2      LYS  65  21.577   5.399   6.758
  519   2HZ   LYS  65           HZ1      LYS  65  21.800   7.084   6.771
  520   3HZ   LYS  65           HZ3      LYS  65  21.864   6.211   8.224
  521    H    ASP  66           HN       ASP  66  16.515   1.684   4.099
  522    HA   ASP  66           HA       ASP  66  18.922   0.180   4.972
  523   1HB   ASP  66           HB2      ASP  66  16.378  -0.501   3.674
  524   2HB   ASP  66           HB1      ASP  66  17.774  -1.262   2.912
  525    H    THR  67           HN       THR  67  20.563  -0.393   3.455
  526    HA   THR  67           HA       THR  67  21.094   1.652   1.449
  527    HB   THR  67           HB       THR  67  23.136   0.239   1.006
  528    HG1  THR  67           HG1      THR  67  22.966  -1.746   1.623
  529   1HG2  THR  67          HG21      THR  67  22.706   1.982   2.974
  530   2HG2  THR  67          HG23      THR  67  22.924   0.543   3.969
  531   3HG2  THR  67          HG22      THR  67  24.207   1.062   2.878
  532    NH1  ARG  68           NH2      ARG  68  20.344  -7.024  -1.310
  533    NH2  ARG  68           NH1      ARG  68  19.220  -8.353   0.130
  534    H    ARG  68           HN       ARG  68  19.244  -1.195   1.378
  535    HA   ARG  68           HA       ARG  68  19.911  -2.242  -1.194
  536   1HB   ARG  68           HB2      ARG  68  17.219  -2.242   0.207
  537   2HB   ARG  68           HB1      ARG  68  17.704  -3.313  -1.107
  538   1HG   ARG  68           HG2      ARG  68  19.278  -3.165   1.466
  539   2HG   ARG  68           HG1      ARG  68  17.897  -4.245   1.290
  540   1HD   ARG  68           HD2      ARG  68  19.434  -4.617  -1.037
  541   2HD   ARG  68           HD1      ARG  68  20.597  -4.559   0.287
  542    HE   ARG  68           HE       ARG  68  18.601  -6.245   1.215
  543   1HH1  ARG  68          HH21      ARG  68  20.631  -6.119  -1.620
  544   2HH1  ARG  68          HH22      ARG  68  20.643  -7.836  -1.811
  545   1HH2  ARG  68          HH11      ARG  68  18.637  -8.465   0.934
  546   2HH2  ARG  68          HH12      ARG  68  19.527  -9.155  -0.382
  547    H    CYS  69           HN       CYS  69  17.247  -0.023  -0.261
  548    HA   CYS  69           HA       CYS  69  16.869   0.662  -3.111
  549   1HB   CYS  69           HB2      CYS  69  15.038   0.343  -1.203
  550   2HB   CYS  69           HB1      CYS  69  15.383   2.049  -0.917
  551    H    LEU  70           HN       LEU  70  18.182   2.045  -0.164
  552    HA   LEU  70           HA       LEU  70  18.332   4.769  -1.044
  553   1HB   LEU  70           HB2      LEU  70  18.680   4.426   1.267
  554   2HB   LEU  70           HB1      LEU  70  19.858   3.144   0.988
  555    HG   LEU  70           HG       LEU  70  21.495   4.714   0.185
  556   1HD1  LEU  70          HD11      LEU  70  19.096   6.444  -0.058
  557   2HD1  LEU  70          HD13      LEU  70  20.578   7.256   0.450
  558   3HD1  LEU  70          HD12      LEU  70  20.535   6.369  -1.075
  559   1HD2  LEU  70          HD22      LEU  70  21.265   4.563   2.640
  560   2HD2  LEU  70          HD21      LEU  70  21.752   6.186   2.152
  561   3HD2  LEU  70          HD23      LEU  70  20.078   5.868   2.609
  562    H    GLY  71           HN       GLY  71  20.944   2.320  -0.896
  563   1HA   GLY  71           HA2      GLY  71  22.505   1.872  -2.667
  564   2HA   GLY  71           HA1      GLY  71  21.993   3.361  -3.462
  565    H    ALA  72           HN       ALA  72  23.768   4.660  -3.557
  566    HA   ALA  72           HA       ALA  72  25.014   5.510  -1.039
  567   1HB   ALA  72           HB1      ALA  72  26.503   3.923  -3.136
  568   2HB   ALA  72           HB3      ALA  72  27.338   5.008  -2.023
  569   3HB   ALA  72           HB2      ALA  72  26.427   3.632  -1.398
  570    H    THR  73           HN       THR  73  23.504   7.056  -2.710
  571    HA   THR  73           HA       THR  73  25.538   8.936  -3.768
  572    HB   THR  73           HB       THR  73  23.773   9.219  -5.754
  573    HG1  THR  73           HG1      THR  73  23.685   6.440  -5.287
  574   1HG2  THR  73          HG21      THR  73  26.277   7.863  -5.386
  575   2HG2  THR  73          HG23      THR  73  25.297   6.953  -6.535
  576   3HG2  THR  73          HG22      THR  73  25.658   8.652  -6.836
  577    H    ALA  74           HN       ALA  74  24.387  11.076  -4.367
  578    HA   ALA  74           HA       ALA  74  22.530  11.710  -2.165
  579   1HB   ALA  74           HB2      ALA  74  23.904  13.437  -4.244
  580   2HB   ALA  74           HB1      ALA  74  22.834  14.068  -2.993
  581   3HB   ALA  74           HB3      ALA  74  24.344  13.274  -2.545
  582    H    GLN  75           HN       GLN  75  22.508  11.391  -5.666
  583    HA   GLN  75           HA       GLN  75  19.987  12.686  -6.129
  584   1HB   GLN  75           HB2      GLN  75  21.934  11.580  -7.725
  585   2HB   GLN  75           HB1      GLN  75  20.623  10.410  -7.886
  586   1HG   GLN  75           HG2      GLN  75  19.289  12.819  -8.055
  587   2HG   GLN  75           HG1      GLN  75  20.802  13.161  -8.896
  588   1HE2  GLN  75          HE22      GLN  75  20.142  10.869 -11.565
  589   2HE2  GLN  75          HE21      GLN  75  21.377  11.685 -10.735
  590    H    GLN  76           HN       GLN  76  20.764   9.190  -5.961
  591    HA   GLN  76           HA       GLN  76  18.038   8.338  -5.906
  592   1HB   GLN  76           HB2      GLN  76  20.674   7.131  -5.530
  593   2HB   GLN  76           HB1      GLN  76  19.449   6.408  -4.487
  594   1HG   GLN  76           HG2      GLN  76  17.968   6.255  -6.565
  595   2HG   GLN  76           HG1      GLN  76  19.413   6.641  -7.500
  596   1HE2  GLN  76          HE22      GLN  76  20.235   3.216  -7.531
  597   2HE2  GLN  76          HE21      GLN  76  19.998   4.642  -8.420
  598    H    PHE  77           HN       PHE  77  20.153   9.572  -3.402
  599    HA   PHE  77           HA       PHE  77  18.688   8.545  -1.152
  600   1HB   PHE  77           HB2      PHE  77  20.955   9.417  -0.883
  601   2HB   PHE  77           HB1      PHE  77  20.426  11.019  -1.402
  602    HD1  PHE  77           HD1      PHE  77  18.792   8.531   0.868
  603    HD2  PHE  77           HD2      PHE  77  20.574  12.419   0.479
  604    HE1  PHE  77           HE1      PHE  77  18.127   9.068   3.196
  605    HE2  PHE  77           HE2      PHE  77  19.909  12.957   2.807
  606    HZ   PHE  77           HZ       PHE  77  18.687  11.281   4.165
  607    H    HIS  78           HN       HIS  78  18.356  11.468  -3.129
  608    HA   HIS  78           HA       HIS  78  16.315  12.631  -1.408
  609   1HB   HIS  78           HB2      HIS  78  17.864  13.835  -3.117
  610   2HB   HIS  78           HB1      HIS  78  16.682  13.315  -4.319
  611    HD1  HIS  78           HD1      HIS  78  14.546  14.642  -4.483
  612    HD2  HIS  78           HD2      HIS  78  16.684  15.537  -1.019
  613    HE1  HIS  78           HE1      HIS  78  13.363  16.601  -3.398
  614    NH1  ARG  79           NH2      ARG  79  11.022   8.164  -8.998
  615    NH2  ARG  79           NH1      ARG  79  10.148   7.846  -6.940
  616    H    ARG  79           HN       ARG  79  16.327  10.705  -4.381
  617    HA   ARG  79           HA       ARG  79  13.487  10.845  -4.830
  618   1HB   ARG  79           HB2      ARG  79  15.776   9.352  -5.912
  619   2HB   ARG  79           HB1      ARG  79  14.273   8.432  -5.918
  620   1HG   ARG  79           HG2      ARG  79  13.665  11.085  -6.781
  621   2HG   ARG  79           HG1      ARG  79  15.067  10.528  -7.694
  622   1HD   ARG  79           HD2      ARG  79  12.920   9.905  -8.791
  623   2HD   ARG  79           HD1      ARG  79  13.881   8.495  -8.347
  624    HE   ARG  79           HE       ARG  79  12.227   8.892  -6.159
  625   1HH1  ARG  79          HH21      ARG  79  11.756   8.487  -9.594
  626   2HH1  ARG  79          HH22      ARG  79  10.205   7.750  -9.397
  627   1HH2  ARG  79          HH11      ARG  79  10.214   7.926  -5.945
  628   2HH2  ARG  79          HH12      ARG  79   9.337   7.435  -7.356
  629    H    HIS  80           HN       HIS  80  15.466   8.937  -2.679
  630    HA   HIS  80           HA       HIS  80  13.391   6.920  -2.224
  631   1HB   HIS  80           HB2      HIS  80  15.784   6.349  -2.002
  632   2HB   HIS  80           HB1      HIS  80  15.942   7.522  -0.694
  633    HD1  HIS  80           HD1      HIS  80  13.294   4.840  -1.339
  634    HD2  HIS  80           HD2      HIS  80  15.977   6.026   1.623
  635    HE1  HIS  80           HE1      HIS  80  12.891   3.318   0.644
  636    H    LYS  81           HN       LYS  81  14.667   9.774  -0.520
  637    HA   LYS  81           HA       LYS  81  13.176   9.501   1.878
  638   1HB   LYS  81           HB2      LYS  81  15.010  11.256   1.127
  639   2HB   LYS  81           HB1      LYS  81  13.600  12.215   0.679
  640   1HG   LYS  81           HG2      LYS  81  12.717  11.626   3.052
  641   2HG   LYS  81           HG1      LYS  81  14.392  11.200   3.404
  642   1HD   LYS  81           HD2      LYS  81  13.806  13.835   2.093
  643   2HD   LYS  81           HD1      LYS  81  13.541  13.663   3.828
  644   1HE   LYS  81           HE2      LYS  81  15.757  13.657   4.269
  645   2HE   LYS  81           HE1      LYS  81  16.091  12.518   2.964
  646   1HZ   LYS  81           HZ3      LYS  81  15.747  14.461   1.421
  647   2HZ   LYS  81           HZ2      LYS  81  15.814  15.460   2.794
  648   3HZ   LYS  81           HZ1      LYS  81  17.154  14.505   2.367
  649    H    GLN  82           HN       GLN  82  12.208  10.664  -1.300
  650    HA   GLN  82           HA       GLN  82   9.709  11.833  -0.394
  651   1HB   GLN  82           HB2      GLN  82  11.142  11.563  -2.879
  652   2HB   GLN  82           HB1      GLN  82   9.471  11.049  -3.111
  653   1HG   GLN  82           HG2      GLN  82   8.608  13.134  -2.604
  654   2HG   GLN  82           HG1      GLN  82   9.959  13.550  -1.549
  655   1HE2  GLN  82          HE22      GLN  82  10.210  15.396  -4.863
  656   2HE2  GLN  82          HE21      GLN  82   8.938  15.227  -3.752
  657    H    LEU  83           HN       LEU  83  10.711   8.651  -1.549
  658    HA   LEU  83           HA       LEU  83   8.061   7.582  -1.882
  659   1HB   LEU  83           HB2      LEU  83  10.134   6.556  -2.838
  660   2HB   LEU  83           HB1      LEU  83  10.615   6.092  -1.206
  661    HG   LEU  83           HG       LEU  83   7.864   5.315  -1.959
  662   1HD1  LEU  83          HD13      LEU  83  10.222   4.564  -3.583
  663   2HD1  LEU  83          HD12      LEU  83   9.211   3.218  -3.059
  664   3HD1  LEU  83          HD11      LEU  83   8.510   4.531  -4.004
  665   1HD2  LEU  83          HD23      LEU  83  10.199   4.271  -0.417
  666   2HD2  LEU  83          HD22      LEU  83   8.499   4.356   0.044
  667   3HD2  LEU  83          HD21      LEU  83   9.054   3.089  -1.050
  668    H    ILE  84           HN       ILE  84  10.247   7.818   0.891
  669    HA   ILE  84           HA       ILE  84   8.743   6.061   2.604
  670    HB   ILE  84           HB       ILE  84  10.479   8.395   3.451
  671   1HG1  ILE  84          HG12      ILE  84  11.800   7.078   1.937
  672   2HG1  ILE  84          HG11      ILE  84  12.267   6.576   3.563
  673   1HG2  ILE  84          HG21      ILE  84   8.938   7.008   5.071
  674   2HG2  ILE  84          HG23      ILE  84  10.175   5.766   4.874
  675   3HG2  ILE  84          HG22      ILE  84  10.608   7.344   5.532
  676   1HD1  ILE  84          HD13      ILE  84  10.455   4.753   3.317
  677   2HD1  ILE  84          HD12      ILE  84  10.494   5.130   1.596
  678   3HD1  ILE  84          HD11      ILE  84  11.947   4.538   2.400
  679    NH1  ARG  85           NH2      ARG  85  11.536  11.454   5.400
  680    NH2  ARG  85           NH1      ARG  85  11.090  12.839   7.128
  681    H    ARG  85           HN       ARG  85   8.738   9.621   2.249
  682    HA   ARG  85           HA       ARG  85   6.800  10.155   4.247
  683   1HB   ARG  85           HB2      ARG  85   7.932  11.570   1.935
  684   2HB   ARG  85           HB1      ARG  85   6.281  12.054   2.319
  685   1HG   ARG  85           HG2      ARG  85   7.568  13.471   3.683
  686   2HG   ARG  85           HG1      ARG  85   7.135  12.160   4.780
  687   1HD   ARG  85           HD2      ARG  85   9.326  11.045   4.126
  688   2HD   ARG  85           HD1      ARG  85   9.759  12.554   3.323
  689    HE   ARG  85           HE       ARG  85   9.036  13.338   5.882
  690   1HH1  ARG  85          HH21      ARG  85  11.290  11.048   4.522
  691   2HH1  ARG  85          HH22      ARG  85  12.395  11.196   5.842
  692   1HH2  ARG  85          HH11      ARG  85  10.493  13.503   7.579
  693   2HH2  ARG  85          HH12      ARG  85  11.952  12.570   7.557
  694    H    PHE  86           HN       PHE  86   6.394   9.263   0.835
  695    HA   PHE  86           HA       PHE  86   3.527   9.586   0.813
  696   1HB   PHE  86           HB2      PHE  86   5.571   8.773  -1.023
  697   2HB   PHE  86           HB1      PHE  86   4.294   7.557  -1.036
  698    HD1  PHE  86           HD2      PHE  86   1.863   8.370  -1.258
  699    HD2  PHE  86           HD1      PHE  86   5.269  10.836  -2.129
  700    HE1  PHE  86           HE2      PHE  86   0.424   9.888  -2.589
  701    HE2  PHE  86           HE1      PHE  86   3.829  12.356  -3.460
  702    HZ   PHE  86           HZ       PHE  86   1.406  11.881  -3.690
  703    H    LEU  87           HN       LEU  87   5.664   6.965   1.778
  704    HA   LEU  87           HA       LEU  87   3.633   4.909   1.836
  705   1HB   LEU  87           HB2      LEU  87   6.421   5.074   2.315
  706   2HB   LEU  87           HB1      LEU  87   5.697   4.457   3.800
  707    HG   LEU  87           HG       LEU  87   6.221   2.588   2.311
  708   1HD1  LEU  87          HD11      LEU  87   3.953   2.848   3.649
  709   2HD1  LEU  87          HD13      LEU  87   3.250   2.894   2.031
  710   3HD1  LEU  87          HD12      LEU  87   4.184   1.490   2.548
  711   1HD2  LEU  87          HD21      LEU  87   5.140   4.440   0.336
  712   2HD2  LEU  87          HD23      LEU  87   6.160   3.021   0.095
  713   3HD2  LEU  87          HD22      LEU  87   4.408   2.841   0.202
  714    H    LYS  88           HN       LYS  88   4.801   7.277   4.191
  715    HA   LYS  88           HA       LYS  88   3.372   6.173   6.436
  716   1HB   LYS  88           HB2      LYS  88   4.304   9.016   5.925
  717   2HB   LYS  88           HB1      LYS  88   3.785   8.375   7.485
  718   1HG   LYS  88           HG2      LYS  88   5.598   6.540   7.049
  719   2HG   LYS  88           HG1      LYS  88   6.252   7.706   5.899
  720   1HD   LYS  88           HD2      LYS  88   5.984   9.392   7.911
  721   2HD   LYS  88           HD1      LYS  88   6.012   7.922   8.883
  722   1HE   LYS  88           HE2      LYS  88   8.279   8.309   8.789
  723   2HE   LYS  88           HE1      LYS  88   8.108   7.390   7.294
  724   1HZ   LYS  88           HZ3      LYS  88   7.530   9.851   6.452
  725   2HZ   LYS  88           HZ2      LYS  88   8.642  10.212   7.686
  726   3HZ   LYS  88           HZ1      LYS  88   9.090   9.185   6.407
  727    NH1  ARG  89           NH2      ARG  89   2.472  14.557   4.090
  728    NH2  ARG  89           NH1      ARG  89   1.988  15.198   1.978
  729    H    ARG  89           HN       ARG  89   2.588   8.660   4.016
  730    HA   ARG  89           HA       ARG  89   0.103   9.479   5.144
  731   1HB   ARG  89           HB2      ARG  89   1.569  10.014   2.792
  732   2HB   ARG  89           HB1      ARG  89  -0.012   9.445   2.258
  733   1HG   ARG  89           HG2      ARG  89  -0.629  11.614   2.604
  734   2HG   ARG  89           HG1      ARG  89  -0.744  11.103   4.289
  735   1HD   ARG  89           HD2      ARG  89   0.779  12.704   4.748
  736   2HD   ARG  89           HD1      ARG  89   1.962  11.668   3.953
  737    HE   ARG  89           HE       ARG  89   0.766  13.072   1.873
  738   1HH1  ARG  89          HH21      ARG  89   2.405  13.901   4.839
  739   2HH1  ARG  89          HH22      ARG  89   2.993  15.401   4.215
  740   1HH2  ARG  89          HH11      ARG  89   1.543  15.030   1.099
  741   2HH2  ARG  89          HH12      ARG  89   2.514  16.038   2.120
  742    H    LEU  90           HN       LEU  90   0.840   6.948   2.750
  743    HA   LEU  90           HA       LEU  90  -1.912   6.050   2.566
  744   1HB   LEU  90           HB2      LEU  90  -0.178   5.716   0.778
  745   2HB   LEU  90           HB1      LEU  90   0.611   4.541   1.829
  746    HG   LEU  90           HG       LEU  90  -1.477   3.208   1.884
  747   1HD1  LEU  90          HD12      LEU  90  -2.490   5.629   0.591
  748   2HD1  LEU  90          HD11      LEU  90  -2.938   4.161  -0.277
  749   3HD1  LEU  90          HD13      LEU  90  -3.374   4.349   1.420
  750   1HD2  LEU  90          HD22      LEU  90   0.351   2.988   0.072
  751   2HD2  LEU  90          HD21      LEU  90  -1.214   2.248  -0.265
  752   3HD2  LEU  90          HD23      LEU  90  -0.797   3.796  -0.997
  753    H    ASP  91           HN       ASP  91   0.553   5.561   4.913
  754    HA   ASP  91           HA       ASP  91  -0.184   2.886   5.712
  755   1HB   ASP  91           HB2      ASP  91   1.395   5.123   6.944
  756   2HB   ASP  91           HB1      ASP  91   0.953   3.726   7.924
  757    NH1  ARG  92           NH2      ARG  92  -2.113   7.266  14.126
  758    NH2  ARG  92           NH1      ARG  92  -4.075   8.258  14.647
  759    H    ARG  92           HN       ARG  92  -1.090   6.130   6.927
  760    HA   ARG  92           HA       ARG  92  -2.987   4.882   8.815
  761   1HB   ARG  92           HB2      ARG  92  -1.531   6.956   9.307
  762   2HB   ARG  92           HB1      ARG  92  -2.690   7.841   8.315
  763   1HG   ARG  92           HG2      ARG  92  -4.187   7.883   9.996
  764   2HG   ARG  92           HG1      ARG  92  -4.079   6.133  10.192
  765   1HD   ARG  92           HD2      ARG  92  -2.321   6.290  11.748
  766   2HD   ARG  92           HD1      ARG  92  -1.906   7.931  11.251
  767    HE   ARG  92           HE       ARG  92  -4.482   8.175  12.230
  768   1HH1  ARG  92          HH21      ARG  92  -1.477   6.889  13.455
  769   2HH1  ARG  92          HH22      ARG  92  -1.870   7.260  15.096
  770   1HH2  ARG  92          HH11      ARG  92  -4.954   8.644  14.369
  771   2HH2  ARG  92          HH12      ARG  92  -3.818   8.243  15.613
  772    H    ASN  93           HN       ASN  93  -3.055   6.559   5.722
  773    HA   ASN  93           HA       ASN  93  -5.952   6.989   5.825
  774   1HB   ASN  93           HB2      ASN  93  -4.090   7.139   3.438
  775   2HB   ASN  93           HB1      ASN  93  -5.714   7.816   3.552
  776   1HD2  ASN  93          HD22      ASN  93  -4.383  10.155   6.211
  777   2HD2  ASN  93          HD21      ASN  93  -5.489   8.868   6.257
  778    H    LEU  94           HN       LEU  94  -3.801   4.475   4.686
  779    HA   LEU  94           HA       LEU  94  -5.614   3.219   2.856
  780   1HB   LEU  94           HB2      LEU  94  -3.277   2.593   2.836
  781   2HB   LEU  94           HB1      LEU  94  -3.359   2.063   4.516
  782    HG   LEU  94           HG       LEU  94  -4.848   0.255   3.952
  783   1HD1  LEU  94          HD12      LEU  94  -5.163   1.844   1.469
  784   2HD1  LEU  94          HD11      LEU  94  -5.158   0.093   1.260
  785   3HD1  LEU  94          HD13      LEU  94  -6.340   0.849   2.327
  786   1HD2  LEU  94          HD21      LEU  94  -2.241   0.542   2.833
  787   2HD2  LEU  94          HD23      LEU  94  -3.065  -0.948   3.291
  788   3HD2  LEU  94          HD22      LEU  94  -3.234  -0.315   1.653
  789    CH2  TRP  95           CH2      TRP  95  -6.615   2.623  12.666
  790    H    TRP  95           HN       TRP  95  -4.769   2.105   6.167
  791    HA   TRP  95           HA       TRP  95  -7.299   0.609   6.262
  792   1HB   TRP  95           HB2      TRP  95  -6.465  -0.428   8.179
  793   2HB   TRP  95           HB1      TRP  95  -5.007  -0.114   7.240
  794    HD1  TRP  95           HD1      TRP  95  -3.307   1.569   8.145
  795    HE1  TRP  95           HE1      TRP  95  -3.058   2.859  10.368
  796    HE3  TRP  95           HE3      TRP  95  -7.919   0.740  10.139
  797    HZ2  TRP  95           HZ2      TRP  95  -4.627   3.451  12.691
  798    HZ3  TRP  95           HZ3      TRP  95  -8.522   1.673  12.354
  799    HH2  TRP  95           HH2      TRP  95  -6.885   3.026  13.632
  800    H    GLY  96           HN       GLY  96  -6.176   3.715   7.210
  801   1HA   GLY  96           HA2      GLY  96  -7.702   4.263   9.517
  802   2HA   GLY  96           HA1      GLY  96  -7.326   5.473   8.287
  803    H    LEU  97           HN       LEU  97  -8.663   3.993   6.147
  804    HA   LEU  97           HA       LEU  97 -11.399   4.926   6.627
  805   1HB   LEU  97           HB2      LEU  97  -9.823   4.691   4.382
  806   2HB   LEU  97           HB1      LEU  97 -10.872   3.283   4.232
  807    HG   LEU  97           HG       LEU  97 -12.246   5.776   5.028
  808   1HD1  LEU  97          HD13      LEU  97 -10.395   6.349   3.261
  809   2HD1  LEU  97          HD12      LEU  97 -11.458   5.504   2.139
  810   3HD1  LEU  97          HD11      LEU  97 -12.040   6.928   2.998
  811   1HD2  LEU  97          HD22      LEU  97 -12.686   3.333   3.386
  812   2HD2  LEU  97          HD21      LEU  97 -13.777   4.141   4.510
  813   3HD2  LEU  97          HD23      LEU  97 -13.557   4.780   2.882
  814    H    ALA  98           HN       ALA  98  -9.644   1.887   6.414
  815    HA   ALA  98           HA       ALA  98 -11.714   0.015   6.221
  816   1HB   ALA  98           HB2      ALA  98  -8.960   0.053   7.170
  817   2HB   ALA  98           HB1      ALA  98  -9.948  -1.054   8.116
  818   3HB   ALA  98           HB3      ALA  98  -9.837  -1.245   6.368
  819    H    GLY  99           HN       GLY  99 -10.309   1.288   9.248
  820   1HA   GLY  99           HA2      GLY  99 -11.634   2.007  11.144
  821   2HA   GLY  99           HA1      GLY  99 -12.997   1.091  10.498
  822    H    LEU 100           HN       LEU 100  -9.757  -0.250  10.695
  823    HA   LEU 100           HA       LEU 100 -10.546  -1.839  13.084
  824   1HB   LEU 100           HB2      LEU 100 -10.745  -2.877  10.526
  825   2HB   LEU 100           HB1      LEU 100  -9.152  -3.425  11.050
  826    HG   LEU 100           HG       LEU 100 -10.291  -4.153  13.230
  827   1HD1  LEU 100          HD11      LEU 100 -12.443  -2.804  12.149
  828   2HD1  LEU 100          HD13      LEU 100 -12.836  -4.486  11.796
  829   3HD1  LEU 100          HD12      LEU 100 -12.540  -3.980  13.459
  830   1HD2  LEU 100          HD21      LEU 100  -9.746  -5.494  10.943
  831   2HD2  LEU 100          HD23      LEU 100 -10.469  -6.265  12.355
  832   3HD2  LEU 100          HD22      LEU 100 -11.491  -5.736  11.019
  833    H    ASN 101           HN       ASN 101  -8.761  -2.488  14.347
  834    HA   ASN 101           HA       ASN 101  -6.167  -1.260  13.523
  835   1HB   ASN 101           HB2      ASN 101  -7.633  -1.338  16.006
  836   2HB   ASN 101           HB1      ASN 101  -6.049  -2.083  16.226
  837   1HD2  ASN 101          HD22      ASN 101  -4.596   1.111  16.473
  838   2HD2  ASN 101          HD21      ASN 101  -4.725  -0.463  17.094
  839    H    SER 102           HN       SER 102  -7.048  -3.982  15.670
  840    HA   SER 102           HA       SER 102  -4.687  -5.467  15.233
  841   1HB   SER 102           HB2      SER 102  -7.255  -5.899  16.485
  842   2HB   SER 102           HB1      SER 102  -6.758  -7.346  15.612
  843    HG   SER 102           HG       SER 102  -5.533  -6.010  17.752
  844    H    CYS 103           HN       CYS 103  -4.169  -7.161  13.787
  845    HA   CYS 103           HA       CYS 103  -6.053  -8.082  11.775
  846   1HB   CYS 103           HB2      CYS 103  -4.322  -5.778  11.211
  847   2HB   CYS 103           HB1      CYS 103  -4.142  -7.089  10.045
  848    HA   PRO 104           HA       PRO 104  -2.541 -10.861  12.976
  849   1HB   PRO 104           HB2      PRO 104  -4.439 -13.005  12.559
  850   2HB   PRO 104           HB1      PRO 104  -3.673 -12.494  14.070
  851   1HG   PRO 104           HG2      PRO 104  -6.407 -12.092  13.282
  852   2HG   PRO 104           HG1      PRO 104  -5.618 -11.528  14.760
  853   1HD   PRO 104           HD2      PRO 104  -6.455  -9.952  12.493
  854   2HD   PRO 104           HD1      PRO 104  -5.668  -9.389  13.982
  855    H    VAL 105           HN       VAL 105  -1.547 -10.378  10.906
  856    HA   VAL 105           HA       VAL 105  -2.637 -11.664   8.488
  857    HB   VAL 105           HB       VAL 105  -0.622 -10.659   7.387
  858   1HG1  VAL 105          HG11      VAL 105  -2.610  -9.098   8.978
  859   2HG1  VAL 105          HG13      VAL 105  -1.292  -8.208   8.213
  860   3HG1  VAL 105          HG12      VAL 105  -2.386  -9.182   7.230
  861   1HG2  VAL 105          HG22      VAL 105   0.451 -10.701   9.931
  862   2HG2  VAL 105          HG21      VAL 105   1.105  -9.784   8.575
  863   3HG2  VAL 105          HG23      VAL 105   0.027  -9.002   9.732
  864    H    LYS 106           HN       LYS 106  -1.723 -13.493   7.482
  865    HA   LYS 106           HA       LYS 106   0.807 -14.615   8.367
  866   1HB   LYS 106           HB2      LYS 106  -1.275 -15.209  10.045
  867   2HB   LYS 106           HB1      LYS 106  -1.330 -16.569   8.922
  868   1HG   LYS 106           HG2      LYS 106   0.850 -17.261   9.447
  869   2HG   LYS 106           HG1      LYS 106   1.295 -15.681  10.095
  870   1HD   LYS 106           HD2      LYS 106   0.328 -16.089  12.136
  871   2HD   LYS 106           HD1      LYS 106  -0.947 -17.094  11.449
  872   1HE   LYS 106           HE2      LYS 106   1.120 -18.689  10.895
  873   2HE   LYS 106           HE1      LYS 106   1.821 -17.846  12.276
  874   1HZ   LYS 106           HZ1      LYS 106  -0.853 -19.130  12.308
  875   2HZ   LYS 106           HZ3      LYS 106   0.563 -19.890  12.850
  876   3HZ   LYS 106           HZ2      LYS 106  -0.002 -18.492  13.632
  877    H    GLU 107           HN       GLU 107  -2.263 -16.047   7.198
  878    HA   GLU 107           HA       GLU 107  -1.119 -17.785   5.309
  879   1HB   GLU 107           HB2      GLU 107  -3.579 -17.596   6.056
  880   2HB   GLU 107           HB1      GLU 107  -3.732 -16.349   4.819
  881   1HG   GLU 107           HG2      GLU 107  -4.312 -18.231   3.592
  882   2HG   GLU 107           HG1      GLU 107  -2.576 -18.175   3.290
  883    H    ALA 108           HN       ALA 108   0.491 -16.958   3.985
  884    HA   ALA 108           HA       ALA 108  -0.283 -15.452   1.664
  885   1HB   ALA 108           HB2      ALA 108   0.524 -13.922   4.002
  886   2HB   ALA 108           HB1      ALA 108   1.620 -13.645   2.650
  887   3HB   ALA 108           HB3      ALA 108  -0.107 -13.347   2.459
  888    H    ASP 109           HN       ASP 109   1.201 -15.907   0.081
  889    HA   ASP 109           HA       ASP 109   3.667 -17.331   0.891
  890   1HB   ASP 109           HB2      ASP 109   1.931 -17.867  -1.097
  891   2HB   ASP 109           HB1      ASP 109   3.044 -16.822  -1.980
  892    H    GLN 110           HN       GLN 110   5.763 -16.669  -0.056
  893    HA   GLN 110           HA       GLN 110   6.181 -13.825   0.171
  894   1HB   GLN 110           HB2      GLN 110   7.810 -16.135   0.116
  895   2HB   GLN 110           HB1      GLN 110   8.345 -15.126  -1.229
  896   1HG   GLN 110           HG2      GLN 110   9.596 -14.381   0.660
  897   2HG   GLN 110           HG1      GLN 110   8.332 -13.171   0.424
  898   1HE2  GLN 110          HE22      GLN 110   8.228 -15.581   3.734
  899   2HE2  GLN 110          HE21      GLN 110   9.279 -15.948   2.452
  900    H    SER 111           HN       SER 111   4.863 -12.823  -1.426
  901    HA   SER 111           HA       SER 111   5.471 -13.466  -4.263
  902   1HB   SER 111           HB2      SER 111   3.539 -12.007  -4.767
  903   2HB   SER 111           HB1      SER 111   3.094 -13.278  -3.633
  904    HG   SER 111           HG       SER 111   3.194 -11.808  -1.974
  905    H    THR 112           HN       THR 112   6.694 -12.094  -5.503
  906    HA   THR 112           HA       THR 112   8.381 -10.152  -4.381
  907    HB   THR 112           HB       THR 112   8.715  -9.335  -6.712
  908    HG1  THR 112           HG1      THR 112   7.292  -9.770  -8.196
  909   1HG2  THR 112          HG23      THR 112   9.407 -11.742  -5.655
  910   2HG2  THR 112          HG22      THR 112   8.526 -12.263  -7.092
  911   3HG2  THR 112          HG21      THR 112   9.919 -11.193  -7.249
  912    H    LEU 113           HN       LEU 113   8.279  -7.902  -4.179
  913    HA   LEU 113           HA       LEU 113   5.763  -6.748  -3.559
  914   1HB   LEU 113           HB2      LEU 113   8.425  -6.002  -3.293
  915   2HB   LEU 113           HB1      LEU 113   7.758  -4.783  -4.380
  916    HG   LEU 113           HG       LEU 113   6.258  -5.583  -1.898
  917   1HD1  LEU 113          HD13      LEU 113   8.669  -3.800  -2.139
  918   2HD1  LEU 113          HD12      LEU 113   7.416  -3.434  -0.952
  919   3HD1  LEU 113          HD11      LEU 113   8.277  -4.972  -0.880
  920   1HD2  LEU 113          HD23      LEU 113   6.086  -3.571  -4.014
  921   2HD2  LEU 113          HD22      LEU 113   4.856  -4.091  -2.864
  922   3HD2  LEU 113          HD21      LEU 113   6.027  -2.854  -2.404
  923    H    GLU 114           HN       GLU 114   7.338  -7.117  -6.638
  924    HA   GLU 114           HA       GLU 114   6.158  -4.923  -8.024
  925   1HB   GLU 114           HB2      GLU 114   7.748  -7.157  -8.692
  926   2HB   GLU 114           HB1      GLU 114   6.304  -7.272  -9.698
  927   1HG   GLU 114           HG2      GLU 114   6.652  -4.796 -10.235
  928   2HG   GLU 114           HG1      GLU 114   8.247  -4.965  -9.500
  929    H    ASN 115           HN       ASN 115   5.099  -8.331  -8.073
  930    HA   ASN 115           HA       ASN 115   2.540  -7.750  -9.224
  931   1HB   ASN 115           HB2      ASN 115   3.984 -10.049  -8.576
  932   2HB   ASN 115           HB1      ASN 115   2.564 -10.128  -7.533
  933   1HD2  ASN 115          HD22      ASN 115   2.075 -10.334 -11.604
  934   2HD2  ASN 115          HD21      ASN 115   3.529  -9.733 -10.966
  935    H    PHE 116           HN       PHE 116   3.725  -7.494  -5.963
  936    HA   PHE 116           HA       PHE 116   1.222  -7.786  -4.586
  937   1HB   PHE 116           HB2      PHE 116   3.429  -7.820  -3.445
  938   2HB   PHE 116           HB1      PHE 116   3.633  -6.109  -3.819
  939    HD1  PHE 116           HD1      PHE 116   1.166  -8.450  -2.230
  940    HD2  PHE 116           HD2      PHE 116   2.895  -4.517  -2.277
  941    HE1  PHE 116           HE1      PHE 116  -0.148  -7.847  -0.215
  942    HE2  PHE 116           HE2      PHE 116   1.583  -3.916  -0.262
  943    HZ   PHE 116           HZ       PHE 116   0.062  -5.582   0.771
  944    H    LEU 117           HN       LEU 117   3.010  -4.743  -5.208
  945    HA   LEU 117           HA       LEU 117   0.864  -2.993  -4.673
  946   1HB   LEU 117           HB2      LEU 117   3.092  -2.639  -6.707
  947   2HB   LEU 117           HB1      LEU 117   2.084  -1.345  -6.061
  948    HG   LEU 117           HG       LEU 117   3.938  -3.127  -4.447
  949   1HD1  LEU 117          HD11      LEU 117   4.116  -0.333  -5.540
  950   2HD1  LEU 117          HD13      LEU 117   4.925  -0.723  -4.023
  951   3HD1  LEU 117          HD12      LEU 117   5.351  -1.591  -5.498
  952   1HD2  LEU 117          HD22      LEU 117   2.005  -0.924  -3.693
  953   2HD2  LEU 117          HD21      LEU 117   2.082  -2.564  -3.051
  954   3HD2  LEU 117          HD23      LEU 117   3.342  -1.398  -2.645
  955    H    GLU 118           HN       GLU 118   1.621  -4.869  -7.544
  956    HA   GLU 118           HA       GLU 118  -0.060  -3.609  -9.434
  957   1HB   GLU 118           HB2      GLU 118   1.542  -5.462  -9.926
  958   2HB   GLU 118           HB1      GLU 118   0.440  -6.584  -9.128
  959   1HG   GLU 118           HG2      GLU 118  -0.923  -6.675 -10.924
  960   2HG   GLU 118           HG1      GLU 118  -0.912  -4.920 -11.113
  961    NH1  ARG 119           NH2      ARG 119  -5.534  -9.114  -9.824
  962    NH2  ARG 119           NH1      ARG 119  -6.791  -9.651  -8.024
  963    H    ARG 119           HN       ARG 119  -0.846  -6.362  -7.302
  964    HA   ARG 119           HA       ARG 119  -3.629  -6.425  -7.971
  965   1HB   ARG 119           HB2      ARG 119  -2.255  -7.352  -5.432
  966   2HB   ARG 119           HB1      ARG 119  -3.867  -7.827  -5.965
  967   1HG   ARG 119           HG2      ARG 119  -1.326  -8.312  -7.548
  968   2HG   ARG 119           HG1      ARG 119  -2.123  -9.522  -6.543
  969   1HD   ARG 119           HD2      ARG 119  -3.303  -8.127  -8.962
  970   2HD   ARG 119           HD1      ARG 119  -2.838  -9.823  -8.851
  971    HE   ARG 119           HE       ARG 119  -4.671  -9.501  -6.800
  972   1HH1  ARG 119          HH21      ARG 119  -4.653  -8.888 -10.236
  973   2HH1  ARG 119          HH22      ARG 119  -6.353  -9.155 -10.395
  974   1HH2  ARG 119          HH11      ARG 119  -6.872  -9.839  -7.045
  975   2HH2  ARG 119          HH12      ARG 119  -7.601  -9.687  -8.609
  976    H    LEU 120           HN       LEU 120  -1.800  -4.345  -5.848
  977    HA   LEU 120           HA       LEU 120  -3.974  -3.590  -4.115
  978   1HB   LEU 120           HB2      LEU 120  -1.231  -2.825  -4.520
  979   2HB   LEU 120           HB1      LEU 120  -2.230  -1.374  -4.431
  980    HG   LEU 120           HG       LEU 120  -2.305  -3.644  -2.420
  981   1HD1  LEU 120          HD13      LEU 120  -0.178  -2.247  -2.469
  982   2HD1  LEU 120          HD12      LEU 120  -1.181  -0.856  -2.057
  983   3HD1  LEU 120          HD11      LEU 120  -1.063  -2.217  -0.943
  984   1HD2  LEU 120          HD22      LEU 120  -4.152  -1.583  -3.021
  985   2HD2  LEU 120          HD21      LEU 120  -4.163  -2.649  -1.617
  986   3HD2  LEU 120          HD23      LEU 120  -3.337  -1.093  -1.537
  987    H    LYS 121           HN       LYS 121  -2.615  -2.023  -7.036
  988    HA   LYS 121           HA       LYS 121  -4.525   0.095  -7.180
  989   1HB   LYS 121           HB2      LYS 121  -2.300  -0.519  -8.585
  990   2HB   LYS 121           HB1      LYS 121  -3.525  -1.083  -9.722
  991   1HG   LYS 121           HG2      LYS 121  -4.648   1.256  -9.153
  992   2HG   LYS 121           HG1      LYS 121  -2.990   1.695  -8.737
  993   1HD   LYS 121           HD2      LYS 121  -3.207   2.239 -11.043
  994   2HD   LYS 121           HD1      LYS 121  -2.327   0.711 -11.015
  995   1HE   LYS 121           HE2      LYS 121  -4.597  -0.441 -11.260
  996   2HE   LYS 121           HE1      LYS 121  -5.257   1.152 -11.626
  997   1HZ   LYS 121           HZ2      LYS 121  -2.965  -0.056 -13.072
  998   2HZ   LYS 121           HZ1      LYS 121  -4.575  -0.160 -13.604
  999   3HZ   LYS 121           HZ3      LYS 121  -3.817   1.353 -13.489
 1000    H    THR 122           HN       THR 122  -4.427  -3.044  -8.804
 1001    HA   THR 122           HA       THR 122  -6.781  -2.906 -10.303
 1002    HB   THR 122           HB       THR 122  -6.674  -5.528  -9.173
 1003    HG1  THR 122           HG1      THR 122  -4.395  -5.861  -9.778
 1004   1HG2  THR 122          HG22      THR 122  -6.299  -4.156 -11.737
 1005   2HG2  THR 122          HG21      THR 122  -5.334  -5.624 -11.583
 1006   3HG2  THR 122          HG23      THR 122  -7.084  -5.696 -11.390
 1007    H    ILE 123           HN       ILE 123  -6.457  -3.861  -6.902
 1008    HA   ILE 123           HA       ILE 123  -9.252  -4.412  -6.505
 1009    HB   ILE 123           HB       ILE 123  -7.030  -3.677  -4.588
 1010   1HG1  ILE 123          HG12      ILE 123  -6.809  -5.874  -5.667
 1011   2HG1  ILE 123          HG11      ILE 123  -7.217  -6.072  -3.965
 1012   1HG2  ILE 123          HG22      ILE 123  -9.941  -3.919  -4.173
 1013   2HG2  ILE 123          HG21      ILE 123  -8.960  -4.870  -3.058
 1014   3HG2  ILE 123          HG23      ILE 123  -8.722  -3.127  -3.176
 1015   1HD1  ILE 123          HD13      ILE 123  -9.708  -6.029  -4.968
 1016   2HD1  ILE 123          HD12      ILE 123  -8.860  -6.643  -6.384
 1017   3HD1  ILE 123          HD11      ILE 123  -8.770  -7.516  -4.856
 1018    H    MET 124           HN       MET 124  -7.303  -1.486  -6.241
 1019    HA   MET 124           HA       MET 124  -9.318   0.109  -4.944
 1020   1HB   MET 124           HB2      MET 124  -6.938   0.894  -6.639
 1021   2HB   MET 124           HB1      MET 124  -7.942   2.041  -5.750
 1022   1HG   MET 124           HG2      MET 124  -6.867  -0.305  -4.253
 1023   2HG   MET 124           HG1      MET 124  -5.746   0.985  -4.667
 1024   1HE   MET 124           HE1      MET 124  -5.226   2.554  -3.619
 1025   2HE   MET 124           HE3      MET 124  -6.311   3.858  -3.128
 1026   3HE   MET 124           HE2      MET 124  -5.645   2.765  -1.923
 1027    NH1  ARG 125           NH2      ARG 125  -5.079   4.614  -9.828
 1028    NH2  ARG 125           NH1      ARG 125  -5.556   6.217 -11.347
 1029    H    ARG 125           HN       ARG 125  -8.137   0.692  -8.254
 1030    HA   ARG 125           HA       ARG 125 -10.385   2.144  -9.100
 1031   1HB   ARG 125           HB2      ARG 125  -8.105   0.835 -10.381
 1032   2HB   ARG 125           HB1      ARG 125  -9.530   0.896 -11.416
 1033   1HG   ARG 125           HG2      ARG 125  -8.962   3.027 -11.886
 1034   2HG   ARG 125           HG1      ARG 125  -9.431   3.430 -10.234
 1035   1HD   ARG 125           HD2      ARG 125  -7.211   3.226  -9.434
 1036   2HD   ARG 125           HD1      ARG 125  -6.682   2.366 -10.880
 1037    HE   ARG 125           HE       ARG 125  -7.513   4.824 -11.842
 1038   1HH1  ARG 125          HH21      ARG 125  -5.293   3.754  -9.372
 1039   2HH1  ARG 125          HH22      ARG 125  -4.260   5.123  -9.565
 1040   1HH2  ARG 125          HH11      ARG 125  -6.147   6.585 -12.064
 1041   2HH2  ARG 125          HH12      ARG 125  -4.732   6.713 -11.074
 1042    H    GLU 126           HN       GLU 126  -9.910  -1.370  -9.286
 1043    HA   GLU 126           HA       GLU 126 -12.273  -1.823 -10.875
 1044   1HB   GLU 126           HB2      GLU 126 -10.233  -3.372 -10.489
 1045   2HB   GLU 126           HB1      GLU 126 -11.087  -3.883  -9.033
 1046   1HG   GLU 126           HG2      GLU 126 -13.105  -4.016 -10.847
 1047   2HG   GLU 126           HG1      GLU 126 -11.728  -4.401 -11.878
 1048    H    LYS 127           HN       LYS 127 -11.703  -2.443  -7.383
 1049    HA   LYS 127           HA       LYS 127 -14.542  -2.995  -6.981
 1050   1HB   LYS 127           HB2      LYS 127 -12.274  -3.739  -5.662
 1051   2HB   LYS 127           HB1      LYS 127 -12.884  -2.469  -4.600
 1052   1HG   LYS 127           HG2      LYS 127 -13.931  -4.463  -3.835
 1053   2HG   LYS 127           HG1      LYS 127 -15.165  -3.637  -4.787
 1054   1HD   LYS 127           HD2      LYS 127 -13.575  -5.276  -6.532
 1055   2HD   LYS 127           HD1      LYS 127 -14.146  -6.254  -5.181
 1056   1HE   LYS 127           HE2      LYS 127 -16.441  -5.082  -5.643
 1057   2HE   LYS 127           HE1      LYS 127 -15.746  -4.745  -7.229
 1058   1HZ   LYS 127           HZ2      LYS 127 -15.333  -7.449  -6.366
 1059   2HZ   LYS 127           HZ1      LYS 127 -16.978  -7.048  -6.504
 1060   3HZ   LYS 127           HZ3      LYS 127 -15.947  -6.861  -7.837
 1061    OH   TYR 128           OH       TYR 128  -9.816   1.767  -1.461
 1062    H    TYR 128           HN       TYR 128 -12.920  -0.073  -7.289
 1063    HA   TYR 128           HA       TYR 128 -14.519   1.291  -5.210
 1064   1HB   TYR 128           HB2      TYR 128 -12.316   2.157  -7.069
 1065   2HB   TYR 128           HB1      TYR 128 -13.316   3.349  -6.252
 1066    HD1  TYR 128           HD1      TYR 128 -12.287   0.024  -4.854
 1067    HD2  TYR 128           HD2      TYR 128 -11.749   4.285  -4.729
 1068    HE1  TYR 128           HE1      TYR 128 -10.932  -0.212  -2.807
 1069    HE2  TYR 128           HE2      TYR 128 -10.378   4.039  -2.679
 1070    HH   TYR 128           HH       TYR 128 -10.079   2.461  -0.852
 1071    H    SER 129           HN       SER 129 -15.555   0.048  -7.901
 1072    HA   SER 129           HA       SER 129 -16.651   2.449  -9.205
 1073   1HB   SER 129           HB2      SER 129 -15.874   0.182 -10.308
 1074   2HB   SER 129           HB1      SER 129 -17.505  -0.339  -9.893
 1075    HG   SER 129           HG       SER 129 -18.316   1.052 -11.291
 1076    H    LYS 130           HN       LYS 130 -17.509   0.771  -6.464
 1077    HA   LYS 130           HA       LYS 130 -20.409   0.744  -6.991
 1078   1HB   LYS 130           HB2      LYS 130 -18.625  -0.508  -5.108
 1079   2HB   LYS 130           HB1      LYS 130 -19.885   0.361  -4.232
 1080   1HG   LYS 130           HG2      LYS 130 -21.541  -1.017  -4.982
 1081   2HG   LYS 130           HG1      LYS 130 -20.819  -1.175  -6.583
 1082   1HD   LYS 130           HD2      LYS 130 -19.003  -2.442  -4.867
 1083   2HD   LYS 130           HD1      LYS 130 -20.591  -2.942  -4.285
 1084   1HE   LYS 130           HE2      LYS 130 -19.886  -3.013  -7.220
 1085   2HE   LYS 130           HE1      LYS 130 -19.537  -4.370  -6.148
 1086   1HZ   LYS 130           HZ1      LYS 130 -22.201  -3.343  -5.858
 1087   2HZ   LYS 130           HZ3      LYS 130 -21.890  -3.932  -7.417
 1088   3HZ   LYS 130           HZ2      LYS 130 -21.673  -4.944  -6.069
 1089    H    CYS 131           HN       CYS 131 -18.003   2.741  -5.402
 1090    HA   CYS 131           HA       CYS 131 -20.177   4.508  -4.376
 1091   1HB   CYS 131           HB2      CYS 131 -18.459   3.770  -2.734
 1092   2HB   CYS 131           HB1      CYS 131 -17.215   4.537  -3.725
 1093    H    SER 132           HN       SER 132 -17.179   4.531  -6.294
 1094    HA   SER 132           HA       SER 132 -18.027   7.194  -7.362
 1095   1HB   SER 132           HB2      SER 132 -15.981   7.751  -6.478
 1096   2HB   SER 132           HB1      SER 132 -15.376   6.099  -6.570
 1097    HG   SER 132           HG       SER 132 -14.643   6.488  -8.510
 1098    H    SER 133           HN       SER 133 -18.286   7.343  -9.564
 1099    HA   SER 133           HA       SER 133 -18.064   4.847 -11.116
 1100   1HB   SER 133           HB2      SER 133 -19.553   7.353 -11.314
 1101   2HB   SER 133           HB1      SER 133 -18.858   6.868 -12.857
 1102    HG   SER 133           HG       SER 133 -19.804   4.785 -12.479
   
  Start of MODEL           3
 Raw file had 1102 H/Q atoms
  Start of MODEL    3
    1   1H    GLU   1           HT1      GLU   1 -15.155  19.555   7.492
    2   2H    GLU   1           HT3      GLU   1 -15.537  18.080   6.746
    3   3H    GLU   1           HT2      GLU   1 -16.314  19.508   6.251
    4    HA   GLU   1           HA       GLU   1 -17.406  19.707   8.383
    5   1HB   GLU   1           HB2      GLU   1 -17.671  16.959   7.125
    6   2HB   GLU   1           HB1      GLU   1 -18.859  17.711   8.190
    7   1HG   GLU   1           HG2      GLU   1 -18.973  19.636   6.552
    8   2HG   GLU   1           HG1      GLU   1 -17.986  18.669   5.453
    9    H    ALA   2           HN       ALA   2 -17.840  18.711  10.478
   10    HA   ALA   2           HA       ALA   2 -15.443  17.307  11.525
   11   1HB   ALA   2           HB1      ALA   2 -16.617  19.419  12.578
   12   2HB   ALA   2           HB3      ALA   2 -17.730  18.224  13.243
   13   3HB   ALA   2           HB2      ALA   2 -16.010  18.139  13.629
   14    H    GLU   3           HN       GLU   3 -16.706  15.527  10.030
   15    HA   GLU   3           HA       GLU   3 -17.754  13.611  11.978
   16   1HB   GLU   3           HB2      GLU   3 -19.634  15.222  10.793
   17   2HB   GLU   3           HB1      GLU   3 -19.592  13.851   9.684
   18   1HG   GLU   3           HG2      GLU   3 -19.539  12.664  12.202
   19   2HG   GLU   3           HG1      GLU   3 -20.670  14.005  12.392
   20    H    ALA   4           HN       ALA   4 -18.145  11.456  10.870
   21    HA   ALA   4           HA       ALA   4 -16.136  11.124   8.706
   22   1HB   ALA   4           HB3      ALA   4 -15.962   9.696  10.740
   23   2HB   ALA   4           HB2      ALA   4 -17.555   9.032  10.383
   24   3HB   ALA   4           HB1      ALA   4 -16.212   8.743   9.278
   25    H    HIS   5           HN       HIS   5 -16.856   9.128   7.198
   26    HA   HIS   5           HA       HIS   5 -19.676   8.941   6.596
   27   1HB   HIS   5           HB2      HIS   5 -18.658  11.279   5.695
   28   2HB   HIS   5           HB1      HIS   5 -18.251  10.238   4.332
   29    HD1  HIS   5           HD1      HIS   5 -20.208  12.056   3.360
   30    HD2  HIS   5           HD2      HIS   5 -21.460   8.849   5.710
   31    HE1  HIS   5           HE1      HIS   5 -22.677  11.748   2.893
   32    H    LYS   6           HN       LYS   6 -19.958   7.729   4.434
   33    HA   LYS   6           HA       LYS   6 -18.200   5.452   4.429
   34   1HB   LYS   6           HB2      LYS   6 -20.444   6.397   2.661
   35   2HB   LYS   6           HB1      LYS   6 -19.464   5.011   2.179
   36   1HG   LYS   6           HG2      LYS   6 -19.984   4.433   4.813
   37   2HG   LYS   6           HG1      LYS   6 -21.478   5.230   4.318
   38   1HD   LYS   6           HD2      LYS   6 -20.246   3.106   2.576
   39   2HD   LYS   6           HD1      LYS   6 -21.258   2.655   3.949
   40   1HE   LYS   6           HE2      LYS   6 -23.085   4.065   3.063
   41   2HE   LYS   6           HE1      LYS   6 -22.077   4.498   1.682
   42   1HZ   LYS   6           HZ2      LYS   6 -22.127   1.694   1.993
   43   2HZ   LYS   6           HZ1      LYS   6 -23.720   2.281   1.943
   44   3HZ   LYS   6           HZ3      LYS   6 -22.649   2.629   0.675
   45    H    CYS   7           HN       CYS   7 -16.181   5.540   3.711
   46    HA   CYS   7           HA       CYS   7 -14.360   6.869   2.635
   47   1HB   CYS   7           HB2      CYS   7 -14.262   5.251   0.466
   48   2HB   CYS   7           HB1      CYS   7 -13.784   4.742   2.084
   49    H    ASP   8           HN       ASP   8 -15.617   8.884   2.101
   50    HA   ASP   8           HA       ASP   8 -16.594   9.029  -0.680
   51   1HB   ASP   8           HB2      ASP   8 -16.844  10.656   1.752
   52   2HB   ASP   8           HB1      ASP   8 -16.607  11.612   0.288
   53    H    ILE   9           HN       ILE   9 -14.611  11.489   0.949
   54    HA   ILE   9           HA       ILE   9 -12.993  11.700  -1.509
   55    HB   ILE   9           HB       ILE   9 -12.907  13.357   1.025
   56   1HG1  ILE   9          HG12      ILE   9 -14.015  14.512  -1.445
   57   2HG1  ILE   9          HG11      ILE   9 -14.975  13.185  -0.790
   58   1HG2  ILE   9          HG21      ILE   9 -11.447  13.392  -1.565
   59   2HG2  ILE   9          HG23      ILE   9 -11.997  14.954  -0.959
   60   3HG2  ILE   9          HG22      ILE   9 -10.930  13.953   0.025
   61   1HD1  ILE   9          HD13      ILE   9 -14.003  15.119   1.220
   62   2HD1  ILE   9          HD12      ILE   9 -15.168  15.770   0.068
   63   3HD1  ILE   9          HD11      ILE   9 -15.591  14.370   1.053
   64    H    THR  10           HN       THR  10 -12.716  10.267   1.627
   65    HA   THR  10           HA       THR  10  -9.851  10.421   1.888
   66    HB   THR  10           HB       THR  10 -11.870   8.474   3.033
   67    HG1  THR  10           HG1      THR  10 -11.642   9.775   4.845
   68   1HG2  THR  10          HG21      THR  10  -8.903   8.696   3.292
   69   2HG2  THR  10          HG23      THR  10  -9.832   8.298   4.737
   70   3HG2  THR  10          HG22      THR  10  -9.928   7.260   3.314
   71    H    LEU  11           HN       LEU  11 -12.035   8.112   0.329
   72    HA   LEU  11           HA       LEU  11  -9.964   6.158  -0.198
   73   1HB   LEU  11           HB2      LEU  11 -12.752   6.251  -0.430
   74   2HB   LEU  11           HB1      LEU  11 -12.173   6.078  -2.087
   75    HG   LEU  11           HG       LEU  11 -10.725   4.177  -1.326
   76   1HD1  LEU  11          HD13      LEU  11 -11.507   5.169   1.234
   77   2HD1  LEU  11          HD12      LEU  11 -12.144   3.532   1.074
   78   3HD1  LEU  11          HD11      LEU  11 -10.418   3.829   0.875
   79   1HD2  LEU  11          HD21      LEU  11 -13.720   4.139  -1.100
   80   2HD2  LEU  11          HD23      LEU  11 -12.687   3.402  -2.324
   81   3HD2  LEU  11          HD22      LEU  11 -12.813   2.674  -0.723
   82    H    GLN  12           HN       GLN  12 -11.549   8.632  -2.272
   83    HA   GLN  12           HA       GLN  12 -10.094   8.059  -4.627
   84   1HB   GLN  12           HB2      GLN  12 -10.569  10.405  -5.293
   85   2HB   GLN  12           HB1      GLN  12 -11.993   9.594  -4.645
   86   1HG   GLN  12           HG2      GLN  12 -11.501  10.625  -2.415
   87   2HG   GLN  12           HG1      GLN  12 -10.191  11.535  -3.172
   88   1HE2  GLN  12          HE22      GLN  12 -12.346  13.953  -4.558
   89   2HE2  GLN  12          HE21      GLN  12 -10.750  13.451  -4.271
   90    H    GLU  13           HN       GLU  13  -9.227  10.236  -1.937
   91    HA   GLU  13           HA       GLU  13  -6.759  11.126  -3.115
   92   1HB   GLU  13           HB2      GLU  13  -8.176  11.622  -0.731
   93   2HB   GLU  13           HB1      GLU  13  -6.619  10.969  -0.222
   94   1HG   GLU  13           HG2      GLU  13  -6.715  13.080  -2.358
   95   2HG   GLU  13           HG1      GLU  13  -6.848  13.547  -0.663
   96    H    ILE  14           HN       ILE  14  -7.664   8.356  -1.134
   97    HA   ILE  14           HA       ILE  14  -5.004   7.418  -0.601
   98    HB   ILE  14           HB       ILE  14  -7.751   6.411  -0.322
   99   1HG1  ILE  14          HG12      ILE  14  -5.540   5.384   1.351
  100   2HG1  ILE  14          HG11      ILE  14  -5.691   7.140   1.324
  101   1HG2  ILE  14          HG23      ILE  14  -5.473   4.506  -0.936
  102   2HG2  ILE  14          HG22      ILE  14  -6.958   4.018  -0.121
  103   3HG2  ILE  14          HG21      ILE  14  -7.021   4.627  -1.774
  104   1HD1  ILE  14          HD11      ILE  14  -8.286   5.831   1.564
  105   2HD1  ILE  14          HD13      ILE  14  -7.202   5.394   2.884
  106   3HD1  ILE  14          HD12      ILE  14  -7.571   7.089   2.571
  107    H    ILE  15           HN       ILE  15  -7.052   7.258  -3.423
  108    HA   ILE  15           HA       ILE  15  -5.659   5.037  -4.677
  109    HB   ILE  15           HB       ILE  15  -7.788   6.957  -5.404
  110   1HG1  ILE  15          HG12      ILE  15  -8.675   4.875  -6.485
  111   2HG1  ILE  15          HG11      ILE  15  -7.196   4.043  -6.003
  112   1HG2  ILE  15          HG22      ILE  15  -5.848   5.843  -7.442
  113   2HG2  ILE  15          HG21      ILE  15  -7.485   6.345  -7.862
  114   3HG2  ILE  15          HG23      ILE  15  -6.339   7.523  -7.223
  115   1HD1  ILE  15          HD12      ILE  15  -9.098   5.419  -4.088
  116   2HD1  ILE  15          HD11      ILE  15  -9.061   3.683  -4.390
  117   3HD1  ILE  15          HD13      ILE  15  -7.672   4.479  -3.651
  118    H    LYS  16           HN       LYS  16  -5.603   8.587  -5.131
  119    HA   LYS  16           HA       LYS  16  -3.628   8.696  -7.138
  120   1HB   LYS  16           HB2      LYS  16  -4.374  10.568  -4.901
  121   2HB   LYS  16           HB1      LYS  16  -3.029  10.951  -5.976
  122   1HG   LYS  16           HG2      LYS  16  -4.487  11.697  -7.515
  123   2HG   LYS  16           HG1      LYS  16  -5.195  10.084  -7.608
  124   1HD   LYS  16           HD2      LYS  16  -6.343  10.902  -5.320
  125   2HD   LYS  16           HD1      LYS  16  -6.120  12.474  -6.091
  126   1HE   LYS  16           HE2      LYS  16  -7.179  10.366  -7.869
  127   2HE   LYS  16           HE1      LYS  16  -8.258  10.835  -6.555
  128   1HZ   LYS  16           HZ3      LYS  16  -6.915  12.812  -8.304
  129   2HZ   LYS  16           HZ2      LYS  16  -8.443  12.163  -8.663
  130   3HZ   LYS  16           HZ1      LYS  16  -8.214  13.068  -7.244
  131    H    THR  17           HN       THR  17  -3.167   8.727  -3.601
  132    HA   THR  17           HA       THR  17  -0.310   8.810  -3.674
  133    HB   THR  17           HB       THR  17  -2.259   7.762  -1.608
  134    HG1  THR  17           HG1      THR  17  -1.740  10.121  -2.297
  135   1HG2  THR  17          HG23      THR  17   0.692   7.591  -1.744
  136   2HG2  THR  17          HG22      THR  17   0.041   8.218  -0.229
  137   3HG2  THR  17          HG21      THR  17  -0.451   6.627  -0.810
  138    H    LEU  18           HN       LEU  18  -2.600   6.098  -3.640
  139    HA   LEU  18           HA       LEU  18  -0.722   4.000  -3.374
  140   1HB   LEU  18           HB2      LEU  18  -3.223   3.765  -3.266
  141   2HB   LEU  18           HB1      LEU  18  -3.278   3.968  -5.012
  142    HG   LEU  18           HG       LEU  18  -3.307   1.557  -4.063
  143   1HD1  LEU  18          HD13      LEU  18  -2.400   2.646  -6.444
  144   2HD1  LEU  18          HD12      LEU  18  -1.089   1.568  -5.962
  145   3HD1  LEU  18          HD11      LEU  18  -2.726   0.939  -6.143
  146   1HD2  LEU  18          HD21      LEU  18  -1.385   1.956  -2.495
  147   2HD2  LEU  18          HD23      LEU  18  -1.151   0.573  -3.562
  148   3HD2  LEU  18          HD22      LEU  18  -0.328   2.095  -3.900
  149    H    ASN  19           HN       ASN  19  -1.574   6.005  -6.115
  150    HA   ASN  19           HA       ASN  19  -0.334   4.294  -8.108
  151   1HB   ASN  19           HB2      ASN  19  -1.843   6.756  -8.054
  152   2HB   ASN  19           HB1      ASN  19  -0.410   6.949  -9.066
  153   1HD2  ASN  19          HD22      ASN  19  -2.322   5.436 -11.639
  154   2HD2  ASN  19          HD21      ASN  19  -1.571   6.858 -11.093
  155    H    SER  20           HN       SER  20   0.690   7.150  -6.245
  156    HA   SER  20           HA       SER  20   3.163   7.551  -7.627
  157   1HB   SER  20           HB2      SER  20   3.807   8.486  -5.214
  158   2HB   SER  20           HB1      SER  20   2.712   9.359  -6.281
  159    HG   SER  20           HG       SER  20   1.311   9.136  -4.749
  160    H    LEU  21           HN       LEU  21   2.266   5.313  -5.038
  161    HA   LEU  21           HA       LEU  21   4.970   4.620  -4.311
  162   1HB   LEU  21           HB2      LEU  21   2.334   3.775  -3.568
  163   2HB   LEU  21           HB1      LEU  21   3.287   2.344  -3.963
  164    HG   LEU  21           HG       LEU  21   5.060   3.071  -2.437
  165   1HD1  LEU  21          HD12      LEU  21   3.670   5.585  -2.670
  166   2HD1  LEU  21          HD11      LEU  21   3.768   5.126  -0.971
  167   3HD1  LEU  21          HD13      LEU  21   5.239   5.258  -1.934
  168   1HD2  LEU  21          HD22      LEU  21   2.537   2.133  -1.728
  169   2HD2  LEU  21          HD21      LEU  21   3.965   2.128  -0.693
  170   3HD2  LEU  21          HD23      LEU  21   2.813   3.461  -0.602
  171    H    THR  22           HN       THR  22   2.892   3.674  -6.959
  172    HA   THR  22           HA       THR  22   4.457   1.311  -7.650
  173    HB   THR  22           HB       THR  22   2.588   2.807  -9.490
  174    HG1  THR  22           HG1      THR  22   0.967   1.471  -8.565
  175   1HG2  THR  22          HG23      THR  22   4.154   0.643  -9.948
  176   2HG2  THR  22          HG22      THR  22   2.707  -0.149  -9.326
  177   3HG2  THR  22          HG21      THR  22   2.599   0.897 -10.741
  178    H    GLU  23           HN       GLU  23   4.879   4.690  -8.146
  179    HA   GLU  23           HA       GLU  23   6.068   4.848 -10.683
  180   1HB   GLU  23           HB2      GLU  23   6.758   6.275  -8.103
  181   2HB   GLU  23           HB1      GLU  23   7.477   6.698  -9.657
  182   1HG   GLU  23           HG2      GLU  23   5.348   7.285 -10.585
  183   2HG   GLU  23           HG1      GLU  23   4.485   6.583  -9.216
  184    H    GLN  24           HN       GLN  24   7.515   3.814  -7.612
  185    HA   GLN  24           HA       GLN  24   9.935   2.936  -9.134
  186   1HB   GLN  24           HB2      GLN  24   9.491   3.980  -6.389
  187   2HB   GLN  24           HB1      GLN  24  10.654   2.662  -6.532
  188   1HG   GLN  24           HG2      GLN  24  10.839   4.885  -8.515
  189   2HG   GLN  24           HG1      GLN  24  11.387   5.209  -6.871
  190   1HE2  GLN  24          HE22      GLN  24  14.306   3.244  -7.178
  191   2HE2  GLN  24          HE21      GLN  24  13.354   4.225  -6.174
  192    H    LYS  25           HN       LYS  25   8.201   1.161  -9.718
  193    HA   LYS  25           HA       LYS  25   8.001  -0.859  -7.557
  194   1HB   LYS  25           HB2      LYS  25   6.424  -2.009  -9.106
  195   2HB   LYS  25           HB1      LYS  25   5.924  -0.358  -8.737
  196   1HG   LYS  25           HG2      LYS  25   6.513   0.435 -10.855
  197   2HG   LYS  25           HG1      LYS  25   7.649  -0.881 -11.144
  198   1HD   LYS  25           HD2      LYS  25   4.831  -1.697 -10.734
  199   2HD   LYS  25           HD1      LYS  25   5.155  -0.801 -12.218
  200   1HE   LYS  25           HE2      LYS  25   7.206  -2.805 -11.698
  201   2HE   LYS  25           HE1      LYS  25   5.601  -3.527 -11.813
  202   1HZ   LYS  25           HZ2      LYS  25   5.343  -2.100 -13.881
  203   2HZ   LYS  25           HZ1      LYS  25   7.028  -1.889 -13.817
  204   3HZ   LYS  25           HZ3      LYS  25   6.376  -3.445 -13.995
  205    H    THR  26           HN       THR  26  10.587  -0.725  -8.303
  206    HA   THR  26           HA       THR  26  10.957  -3.296  -9.706
  207    HB   THR  26           HB       THR  26  12.251  -0.723 -10.655
  208    HG1  THR  26           HG1      THR  26  10.912  -0.878 -12.290
  209   1HG2  THR  26          HG22      THR  26  12.808  -3.625 -11.192
  210   2HG2  THR  26          HG21      THR  26  13.088  -2.433 -12.459
  211   3HG2  THR  26          HG23      THR  26  13.947  -2.306 -10.925
  212    H    LEU  27           HN       LEU  27  13.038  -0.545  -8.717
  213    HA   LEU  27           HA       LEU  27  15.006  -2.350  -7.587
  214   1HB   LEU  27           HB2      LEU  27  14.843   0.431  -8.226
  215   2HB   LEU  27           HB1      LEU  27  15.319   0.286  -6.532
  216    HG   LEU  27           HG       LEU  27  16.630  -1.308  -8.745
  217   1HD1  LEU  27          HD13      LEU  27  16.777   1.439  -8.505
  218   2HD1  LEU  27          HD12      LEU  27  18.159   0.899  -7.551
  219   3HD1  LEU  27          HD11      LEU  27  18.012   0.417  -9.242
  220   1HD2  LEU  27          HD21      LEU  27  16.678  -1.635  -6.019
  221   2HD2  LEU  27          HD23      LEU  27  17.969  -2.145  -7.106
  222   3HD2  LEU  27          HD22      LEU  27  18.078  -0.593  -6.275
  223    H    CYS  28           HN       CYS  28  12.602  -0.127  -6.155
  224    HA   CYS  28           HA       CYS  28  13.250  -0.993  -3.453
  225   1HB   CYS  28           HB2      CYS  28  11.824   1.130  -4.543
  226   2HB   CYS  28           HB1      CYS  28  10.578   0.140  -3.780
  227    H    THR  29           HN       THR  29  11.465  -2.415  -5.994
  228    HA   THR  29           HA       THR  29   9.636  -3.858  -4.192
  229    HB   THR  29           HB       THR  29   8.963  -5.011  -6.353
  230    HG1  THR  29           HG1      THR  29  10.645  -4.729  -7.678
  231   1HG2  THR  29          HG22      THR  29   8.802  -2.032  -5.935
  232   2HG2  THR  29          HG21      THR  29   7.978  -2.813  -7.284
  233   3HG2  THR  29          HG23      THR  29   7.569  -3.253  -5.628
  234    H    GLU  30           HN       GLU  30  12.808  -4.177  -4.523
  235    HA   GLU  30           HA       GLU  30  12.916  -7.067  -5.102
  236   1HB   GLU  30           HB2      GLU  30  15.328  -6.801  -4.900
  237   2HB   GLU  30           HB1      GLU  30  14.700  -5.490  -5.899
  238   1HG   GLU  30           HG2      GLU  30  15.703  -4.053  -4.486
  239   2HG   GLU  30           HG1      GLU  30  14.518  -4.533  -3.269
  240    H    LEU  31           HN       LEU  31  11.362  -6.305  -2.791
  241    HA   LEU  31           HA       LEU  31  12.924  -7.681  -0.678
  242   1HB   LEU  31           HB2      LEU  31  11.154  -5.242  -0.264
  243   2HB   LEU  31           HB1      LEU  31  11.944  -6.162   1.015
  244    HG   LEU  31           HG       LEU  31  13.851  -5.359  -1.031
  245   1HD1  LEU  31          HD11      LEU  31  11.954  -3.495  -0.951
  246   2HD1  LEU  31          HD13      LEU  31  12.808  -3.024   0.518
  247   3HD1  LEU  31          HD12      LEU  31  13.660  -3.055  -1.026
  248   1HD2  LEU  31          HD21      LEU  31  13.496  -5.134   1.946
  249   2HD2  LEU  31          HD23      LEU  31  14.748  -5.982   1.040
  250   3HD2  LEU  31          HD22      LEU  31  14.780  -4.223   1.150
  251    H    THR  32           HN       THR  32  11.742  -9.555  -1.203
  252    HA   THR  32           HA       THR  32   9.114  -9.999  -1.793
  253    HB   THR  32           HB       THR  32   9.328 -12.107  -0.303
  254    HG1  THR  32           HG1      THR  32  10.929 -11.130   1.055
  255   1HG2  THR  32          HG22      THR  32  10.802 -11.266  -2.711
  256   2HG2  THR  32          HG21      THR  32  11.496 -12.662  -1.886
  257   3HG2  THR  32          HG23      THR  32   9.821 -12.706  -2.436
  258    H    VAL  33           HN       VAL  33   7.144 -10.198  -0.718
  259    HA   VAL  33           HA       VAL  33   7.038  -9.430   2.153
  260    HB   VAL  33           HB       VAL  33   5.285  -7.779   1.704
  261   1HG1  VAL  33          HG12      VAL  33   7.824  -7.261   1.456
  262   2HG1  VAL  33          HG11      VAL  33   7.477  -7.162  -0.271
  263   3HG1  VAL  33          HG13      VAL  33   6.666  -6.075   0.856
  264   1HG2  VAL  33          HG23      VAL  33   5.332  -9.096  -0.911
  265   2HG2  VAL  33          HG22      VAL  33   4.061  -8.121  -0.172
  266   3HG2  VAL  33          HG21      VAL  33   5.380  -7.338  -1.044
  267    H    THR  34           HN       THR  34   3.952  -9.242   1.635
  268    HA   THR  34           HA       THR  34   3.565 -12.202   1.476
  269    HB   THR  34           HB       THR  34   2.651 -10.196   3.379
  270    HG1  THR  34           HG1      THR  34   3.299 -11.935   4.360
  271   1HG2  THR  34          HG21      THR  34   0.556 -11.923   2.029
  272   2HG2  THR  34          HG23      THR  34   0.323 -11.096   3.567
  273   3HG2  THR  34          HG22      THR  34   0.586 -10.160   2.098
  274    H    ASP  35           HN       ASP  35   2.009 -12.971   0.050
  275    HA   ASP  35           HA       ASP  35   0.834 -10.954  -1.795
  276   1HB   ASP  35           HB2      ASP  35   1.759 -12.510  -3.206
  277   2HB   ASP  35           HB1      ASP  35   1.646 -13.805  -2.015
  278    H    ILE  36           HN       ILE  36  -1.245 -10.378  -1.409
  279    HA   ILE  36           HA       ILE  36  -2.992 -12.362  -0.014
  280    HB   ILE  36           HB       ILE  36  -3.963 -10.649   1.187
  281   1HG1  ILE  36          HG12      ILE  36  -3.377  -9.009  -1.267
  282   2HG1  ILE  36          HG11      ILE  36  -4.920  -9.277  -0.453
  283   1HG2  ILE  36          HG23      ILE  36  -1.374 -10.680   1.409
  284   2HG2  ILE  36          HG22      ILE  36  -1.428  -9.164   0.510
  285   3HG2  ILE  36          HG21      ILE  36  -2.244  -9.294   2.067
  286   1HD1  ILE  36          HD13      ILE  36  -3.820  -8.032   1.548
  287   2HD1  ILE  36          HD12      ILE  36  -2.659  -7.460   0.351
  288   3HD1  ILE  36          HD11      ILE  36  -4.371  -7.078   0.169
  289    H    PHE  37           HN       PHE  37  -2.469 -11.677  -3.056
  290    HA   PHE  37           HA       PHE  37  -5.344 -11.241  -3.746
  291   1HB   PHE  37           HB2      PHE  37  -2.840 -10.820  -5.407
  292   2HB   PHE  37           HB1      PHE  37  -4.485 -10.625  -6.013
  293    HD1  PHE  37           HD2      PHE  37  -6.034  -9.150  -4.340
  294    HD2  PHE  37           HD1      PHE  37  -1.764  -8.876  -4.712
  295    HE1  PHE  37           HE2      PHE  37  -6.104  -6.846  -3.427
  296    HE2  PHE  37           HE1      PHE  37  -1.833  -6.571  -3.799
  297    HZ   PHE  37           HZ       PHE  37  -4.003  -5.557  -3.156
  298    H    ALA  38           HN       ALA  38  -4.460 -13.782  -2.866
  299    HA   ALA  38           HA       ALA  38  -4.436 -15.346  -5.414
  300   1HB   ALA  38           HB2      ALA  38  -2.621 -15.517  -3.407
  301   2HB   ALA  38           HB1      ALA  38  -3.802 -16.705  -2.853
  302   3HB   ALA  38           HB3      ALA  38  -3.048 -16.884  -4.438
  303    H    ALA  39           HN       ALA  39  -5.938 -14.995  -2.237
  304    HA   ALA  39           HA       ALA  39  -8.103 -16.840  -3.169
  305   1HB   ALA  39           HB1      ALA  39  -6.836 -17.755  -1.244
  306   2HB   ALA  39           HB3      ALA  39  -7.208 -16.299  -0.320
  307   3HB   ALA  39           HB2      ALA  39  -8.506 -17.391  -0.805
  308    H    SER  40           HN       SER  40  -8.347 -14.272  -3.974
  309    HA   SER  40           HA       SER  40 -10.126 -12.954  -1.967
  310   1HB   SER  40           HB2      SER  40  -8.548 -11.347  -2.620
  311   2HB   SER  40           HB1      SER  40  -8.482 -11.944  -4.277
  312    HG   SER  40           HG       SER  40  -9.670  -9.982  -4.072
  313    H    LYS  41           HN       LYS  41 -12.065 -14.081  -2.372
  314    HA   LYS  41           HA       LYS  41 -13.149 -13.756  -5.142
  315   1HB   LYS  41           HB2      LYS  41 -13.610 -16.007  -3.164
  316   2HB   LYS  41           HB1      LYS  41 -14.489 -15.821  -4.682
  317   1HG   LYS  41           HG2      LYS  41 -12.529 -16.149  -5.983
  318   2HG   LYS  41           HG1      LYS  41 -11.472 -15.910  -4.591
  319   1HD   LYS  41           HD2      LYS  41 -12.027 -18.007  -3.657
  320   2HD   LYS  41           HD1      LYS  41 -13.472 -18.167  -4.657
  321   1HE   LYS  41           HE2      LYS  41 -11.476 -17.913  -6.544
  322   2HE   LYS  41           HE1      LYS  41 -10.684 -18.854  -5.280
  323   1HZ   LYS  41           HZ2      LYS  41 -13.070 -20.044  -5.397
  324   2HZ   LYS  41           HZ1      LYS  41 -12.885 -19.574  -7.020
  325   3HZ   LYS  41           HZ3      LYS  41 -11.715 -20.558  -6.285
  326    H    ASP  42           HN       ASP  42 -13.924 -13.792  -1.667
  327    HA   ASP  42           HA       ASP  42 -16.265 -12.067  -2.317
  328   1HB   ASP  42           HB2      ASP  42 -16.339 -14.308  -0.279
  329   2HB   ASP  42           HB1      ASP  42 -17.679 -13.269  -0.763
  330    H    THR  43           HN       THR  43 -14.015 -10.864  -1.535
  331    HA   THR  43           HA       THR  43 -14.292 -10.458   1.415
  332    HB   THR  43           HB       THR  43 -11.981  -9.135   0.367
  333    HG1  THR  43           HG1      THR  43 -12.074 -11.895  -0.250
  334   1HG2  THR  43          HG21      THR  43 -12.638 -10.391   2.632
  335   2HG2  THR  43          HG23      THR  43 -11.794 -11.723   1.841
  336   3HG2  THR  43          HG22      THR  43 -10.956 -10.199   2.135
  337    H    THR  44           HN       THR  44 -13.572  -8.015   1.931
  338    HA   THR  44           HA       THR  44 -15.028  -6.272  -0.013
  339    HB   THR  44           HB       THR  44 -15.779  -4.931   1.945
  340    HG1  THR  44           HG1      THR  44 -15.352  -5.639   3.966
  341   1HG2  THR  44          HG21      THR  44 -16.596  -7.635   1.260
  342   2HG2  THR  44          HG23      THR  44 -16.974  -7.256   2.940
  343   3HG2  THR  44          HG22      THR  44 -17.592  -6.232   1.643
  344    H    GLU  45           HN       GLU  45 -14.448  -3.842   0.538
  345    HA   GLU  45           HA       GLU  45 -11.575  -3.625   0.164
  346   1HB   GLU  45           HB2      GLU  45 -11.960  -1.273  -0.122
  347   2HB   GLU  45           HB1      GLU  45 -13.321  -2.098  -0.880
  348   1HG   GLU  45           HG2      GLU  45 -14.452  -1.854   1.463
  349   2HG   GLU  45           HG1      GLU  45 -13.237  -0.605   1.729
  350    H    LYS  46           HN       LYS  46 -13.795  -3.187   2.865
  351    HA   LYS  46           HA       LYS  46 -11.977  -1.764   4.569
  352   1HB   LYS  46           HB2      LYS  46 -13.992  -1.673   5.604
  353   2HB   LYS  46           HB1      LYS  46 -14.547  -3.166   4.848
  354   1HG   LYS  46           HG2      LYS  46 -13.397  -4.515   6.477
  355   2HG   LYS  46           HG1      LYS  46 -12.553  -3.109   7.128
  356   1HD   LYS  46           HD2      LYS  46 -14.496  -2.252   8.135
  357   2HD   LYS  46           HD1      LYS  46 -15.562  -3.220   7.118
  358   1HE   LYS  46           HE2      LYS  46 -13.630  -4.608   8.946
  359   2HE   LYS  46           HE1      LYS  46 -15.123  -3.945   9.612
  360   1HZ   LYS  46           HZ1      LYS  46 -15.084  -5.702   7.229
  361   2HZ   LYS  46           HZ3      LYS  46 -15.217  -6.313   8.806
  362   3HZ   LYS  46           HZ2      LYS  46 -16.414  -5.275   8.195
  363    H    GLU  47           HN       GLU  47 -12.710  -5.254   4.296
  364    HA   GLU  47           HA       GLU  47 -10.775  -6.063   6.263
  365   1HB   GLU  47           HB2      GLU  47 -12.249  -7.462   4.043
  366   2HB   GLU  47           HB1      GLU  47 -10.972  -8.303   4.925
  367   1HG   GLU  47           HG2      GLU  47 -12.244  -8.510   6.792
  368   2HG   GLU  47           HG1      GLU  47 -12.856  -6.861   6.664
  369    H    THR  48           HN       THR  48 -10.635  -6.276   2.685
  370    HA   THR  48           HA       THR  48  -7.935  -7.103   2.512
  371    HB   THR  48           HB       THR  48  -9.099  -5.221   0.482
  372    HG1  THR  48           HG1      THR  48 -10.487  -6.751  -0.190
  373   1HG2  THR  48          HG22      THR  48  -7.212  -7.535   0.574
  374   2HG2  THR  48          HG21      THR  48  -8.147  -7.289  -0.901
  375   3HG2  THR  48          HG23      THR  48  -7.081  -6.014  -0.309
  376    H    PHE  49           HN       PHE  49  -9.216  -3.960   3.297
  377    HA   PHE  49           HA       PHE  49  -6.817  -2.493   2.541
  378   1HB   PHE  49           HB2      PHE  49  -9.382  -1.867   3.919
  379   2HB   PHE  49           HB1      PHE  49  -8.013  -0.801   4.236
  380    HD1  PHE  49           HD1      PHE  49  -8.657  -2.687   1.099
  381    HD2  PHE  49           HD2      PHE  49  -8.674   1.152   3.025
  382    HE1  PHE  49           HE1      PHE  49  -9.015  -1.591  -1.096
  383    HE2  PHE  49           HE2      PHE  49  -9.030   2.249   0.828
  384    HZ   PHE  49           HZ       PHE  49  -9.204   0.876  -1.232
  385    H    CYS  50           HN       CYS  50  -8.137  -3.712   5.641
  386    HA   CYS  50           HA       CYS  50  -5.967  -2.625   7.212
  387   1HB   CYS  50           HB2      CYS  50  -7.326  -3.297   8.877
  388   2HB   CYS  50           HB1      CYS  50  -8.359  -4.111   7.703
  389    NH1  ARG  51           NH2      ARG  51  -8.681 -11.064   3.724
  390    NH2  ARG  51           NH1      ARG  51  -7.386 -10.957   1.877
  391    H    ARG  51           HN       ARG  51  -6.451  -5.688   5.506
  392    HA   ARG  51           HA       ARG  51  -4.208  -7.070   6.650
  393   1HB   ARG  51           HB2      ARG  51  -5.953  -7.392   4.264
  394   2HB   ARG  51           HB1      ARG  51  -4.367  -8.159   4.175
  395   1HG   ARG  51           HG2      ARG  51  -4.880  -9.701   5.774
  396   2HG   ARG  51           HG1      ARG  51  -5.798  -8.543   6.736
  397   1HD   ARG  51           HD2      ARG  51  -7.224 -10.352   5.744
  398   2HD   ARG  51           HD1      ARG  51  -7.704  -8.733   5.238
  399    HE   ARG  51           HE       ARG  51  -5.932  -9.558   3.270
  400   1HH1  ARG  51          HH21      ARG  51  -8.866 -10.824   4.676
  401   2HH1  ARG  51          HH22      ARG  51  -9.329 -11.640   3.225
  402   1HH2  ARG  51          HH11      ARG  51  -6.566 -10.629   1.408
  403   2HH2  ARG  51          HH12      ARG  51  -8.042 -11.535   1.392
  404    H    ALA  52           HN       ALA  52  -4.510  -5.458   3.467
  405    HA   ALA  52           HA       ALA  52  -1.715  -5.537   2.875
  406   1HB   ALA  52           HB1      ALA  52  -3.988  -3.808   1.905
  407   2HB   ALA  52           HB3      ALA  52  -2.342  -3.588   1.314
  408   3HB   ALA  52           HB2      ALA  52  -3.174  -5.121   1.056
  409    H    ALA  53           HN       ALA  53  -3.563  -3.475   4.975
  410    HA   ALA  53           HA       ALA  53  -1.727  -1.234   4.959
  411   1HB   ALA  53           HB1      ALA  53  -4.099  -1.064   5.726
  412   2HB   ALA  53           HB3      ALA  53  -3.693  -2.077   7.110
  413   3HB   ALA  53           HB2      ALA  53  -2.952  -0.486   6.935
  414    H    THR  54           HN       THR  54  -2.069  -4.202   6.853
  415    HA   THR  54           HA       THR  54  -0.079  -3.535   8.827
  416    HB   THR  54           HB       THR  54  -1.274  -6.122   7.835
  417    HG1  THR  54           HG1      THR  54  -2.365  -4.719   9.337
  418   1HG2  THR  54          HG21      THR  54   1.159  -5.704   9.534
  419   2HG2  THR  54          HG23      THR  54   0.077  -7.046   9.903
  420   3HG2  THR  54          HG22      THR  54   0.845  -6.943   8.319
  421    H    VAL  55           HN       VAL  55   0.018  -5.401   5.795
  422    HA   VAL  55           HA       VAL  55   2.825  -5.951   5.856
  423    HB   VAL  55           HB       VAL  55   1.035  -5.593   3.428
  424   1HG1  VAL  55          HG13      VAL  55   3.806  -6.088   3.669
  425   2HG1  VAL  55          HG12      VAL  55   3.073  -7.642   3.275
  426   3HG1  VAL  55          HG11      VAL  55   2.820  -6.254   2.217
  427   1HG2  VAL  55          HG21      VAL  55   1.107  -7.596   5.555
  428   2HG2  VAL  55          HG23      VAL  55  -0.080  -7.374   4.269
  429   3HG2  VAL  55          HG22      VAL  55   1.383  -8.311   3.968
  430    H    LEU  56           HN       LEU  56   0.991  -3.107   4.949
  431    HA   LEU  56           HA       LEU  56   3.180  -1.825   3.522
  432   1HB   LEU  56           HB2      LEU  56   0.442  -1.361   3.802
  433   2HB   LEU  56           HB1      LEU  56   1.192  -0.015   4.659
  434    HG   LEU  56           HG       LEU  56   2.733  -0.272   2.352
  435   1HD1  LEU  56          HD12      LEU  56   0.908  -1.807   1.506
  436   2HD1  LEU  56          HD11      LEU  56  -0.199  -0.436   1.600
  437   3HD1  LEU  56          HD13      LEU  56   1.183  -0.382   0.504
  438   1HD2  LEU  56          HD21      LEU  56   0.536   1.549   3.292
  439   2HD2  LEU  56          HD23      LEU  56   2.255   1.889   3.091
  440   3HD2  LEU  56          HD22      LEU  56   1.207   1.775   1.677
  441    NH1  ARG  57           NH2      ARG  57   1.403  -0.327  14.158
  442    NH2  ARG  57           NH1      ARG  57   3.245  -1.430  14.863
  443    H    ARG  57           HN       ARG  57   2.081  -1.995   6.854
  444    HA   ARG  57           HA       ARG  57   3.591   0.288   7.787
  445   1HB   ARG  57           HB2      ARG  57   1.655  -0.875   9.001
  446   2HB   ARG  57           HB1      ARG  57   2.824  -2.116   9.453
  447   1HG   ARG  57           HG2      ARG  57   4.202  -0.497  10.600
  448   2HG   ARG  57           HG1      ARG  57   3.217   0.837  10.001
  449   1HD   ARG  57           HD2      ARG  57   1.909   0.641  11.819
  450   2HD   ARG  57           HD1      ARG  57   1.441  -0.969  11.273
  451    HE   ARG  57           HE       ARG  57   3.890  -1.372  12.499
  452   1HH1  ARG  57          HH21      ARG  57   0.860   0.087  13.430
  453   2HH1  ARG  57          HH22      ARG  57   1.066  -0.308  15.099
  454   1HH2  ARG  57          HH11      ARG  57   4.124  -1.866  14.671
  455   2HH2  ARG  57          HH12      ARG  57   2.893  -1.404  15.799
  456    H    GLN  58           HN       GLN  58   4.252  -3.171   7.450
  457    HA   GLN  58           HA       GLN  58   6.844  -3.007   8.759
  458   1HB   GLN  58           HB2      GLN  58   5.905  -5.125   6.807
  459   2HB   GLN  58           HB1      GLN  58   7.135  -5.289   8.060
  460   1HG   GLN  58           HG2      GLN  58   4.793  -4.365   9.358
  461   2HG   GLN  58           HG1      GLN  58   4.286  -5.667   8.281
  462   1HE2  GLN  58          HE22      GLN  58   5.989  -6.704  11.694
  463   2HE2  GLN  58          HE21      GLN  58   5.198  -5.231  11.399
  464    H    PHE  59           HN       PHE  59   5.629  -2.587   5.494
  465    HA   PHE  59           HA       PHE  59   8.287  -2.635   4.272
  466   1HB   PHE  59           HB2      PHE  59   6.746  -3.224   2.670
  467   2HB   PHE  59           HB1      PHE  59   5.482  -2.214   3.364
  468    HD1  PHE  59           HD1      PHE  59   8.792  -1.931   1.620
  469    HD2  PHE  59           HD2      PHE  59   4.923  -0.195   2.312
  470    HE1  PHE  59           HE1      PHE  59   9.280  -0.176  -0.059
  471    HE2  PHE  59           HE2      PHE  59   5.414   1.559   0.633
  472    HZ   PHE  59           HZ       PHE  59   7.591   1.569  -0.553
  473    OH   TYR  60           OH       TYR  60   6.993   5.680  10.449
  474    H    TYR  60           HN       TYR  60   6.342  -0.278   5.906
  475    HA   TYR  60           HA       TYR  60   7.730   1.996   4.639
  476   1HB   TYR  60           HB2      TYR  60   5.729   2.914   5.117
  477   2HB   TYR  60           HB1      TYR  60   5.305   1.593   6.201
  478    HD1  TYR  60           HD1      TYR  60   7.386   4.704   6.014
  479    HD2  TYR  60           HD2      TYR  60   5.295   1.913   8.524
  480    HE1  TYR  60           HE1      TYR  60   7.786   6.167   7.977
  481    HE2  TYR  60           HE2      TYR  60   5.697   3.376  10.486
  482    HH   TYR  60           HH       TYR  60   7.704   6.285  10.225
  483    H    SER  61           HN       SER  61   7.730   0.258   7.732
  484    HA   SER  61           HA       SER  61   9.619   2.212   8.878
  485   1HB   SER  61           HB2      SER  61   8.364   1.548  10.652
  486   2HB   SER  61           HB1      SER  61   7.924   0.021   9.892
  487    HG   SER  61           HG       SER  61   9.914   0.591  11.657
  488    H    HIS  62           HN       HIS  62   9.662  -1.154   7.727
  489    HA   HIS  62           HA       HIS  62  12.465  -1.472   8.545
  490   1HB   HIS  62           HB2      HIS  62  10.593  -3.258   6.973
  491   2HB   HIS  62           HB1      HIS  62  12.245  -3.697   7.402
  492    HD1  HIS  62           HD1      HIS  62   9.325  -4.837   8.512
  493    HD2  HIS  62           HD2      HIS  62  12.178  -2.576  10.543
  494    HE1  HIS  62           HE1      HIS  62   8.948  -5.259  10.981
  495    H    HIS  63           HN       HIS  63  10.738  -1.397   5.394
  496    HA   HIS  63           HA       HIS  63  13.343  -1.159   4.023
  497   1HB   HIS  63           HB2      HIS  63  10.557  -1.181   2.835
  498   2HB   HIS  63           HB1      HIS  63  12.077  -1.417   1.971
  499    HD1  HIS  63           HD1      HIS  63  13.298  -3.242   4.348
  500    HD2  HIS  63           HD2      HIS  63   9.708  -3.867   2.324
  501    HE1  HIS  63           HE1      HIS  63  12.753  -5.701   4.603
  502    H    GLU  64           HN       GLU  64  12.464   1.104   5.705
  503    HA   GLU  64           HA       GLU  64  11.731   3.170   3.725
  504   1HB   GLU  64           HB2      GLU  64  10.757   4.102   5.520
  505   2HB   GLU  64           HB1      GLU  64  11.429   2.846   6.556
  506   1HG   GLU  64           HG2      GLU  64  13.518   4.134   6.783
  507   2HG   GLU  64           HG1      GLU  64  12.862   5.389   5.728
  508    H    LYS  65           HN       LYS  65  14.528   1.998   5.485
  509    HA   LYS  65           HA       LYS  65  16.160   4.070   4.078
  510   1HB   LYS  65           HB2      LYS  65  15.888   4.442   6.599
  511   2HB   LYS  65           HB1      LYS  65  16.840   2.972   6.813
  512   1HG   LYS  65           HG2      LYS  65  18.515   4.586   6.838
  513   2HG   LYS  65           HG1      LYS  65  18.489   4.159   5.128
  514   1HD   LYS  65           HD2      LYS  65  17.263   6.094   4.541
  515   2HD   LYS  65           HD1      LYS  65  16.771   6.391   6.209
  516   1HE   LYS  65           HE2      LYS  65  18.482   7.942   6.009
  517   2HE   LYS  65           HE1      LYS  65  19.390   6.552   6.601
  518   1HZ   LYS  65           HZ3      LYS  65  19.024   7.182   3.725
  519   2HZ   LYS  65           HZ2      LYS  65  20.381   7.657   4.631
  520   3HZ   LYS  65           HZ1      LYS  65  20.047   6.007   4.396
  521    H    ASP  66           HN       ASP  66  15.704   1.556   2.961
  522    HA   ASP  66           HA       ASP  66  17.865  -0.265   3.726
  523   1HB   ASP  66           HB2      ASP  66  15.597  -0.918   2.683
  524   2HB   ASP  66           HB1      ASP  66  16.285  -0.374   1.152
  525    H    THR  67           HN       THR  67  19.909  -0.247   2.898
  526    HA   THR  67           HA       THR  67  20.837   1.926   1.289
  527    HB   THR  67           HB       THR  67  22.914   0.467   1.040
  528    HG1  THR  67           HG1      THR  67  22.898  -1.432   2.255
  529   1HG2  THR  67          HG23      THR  67  22.519   2.089   2.912
  530   2HG2  THR  67          HG22      THR  67  21.840   0.764   3.857
  531   3HG2  THR  67          HG21      THR  67  23.535   0.722   3.369
  532    NH1  ARG  68           NH2      ARG  68  19.398  -7.863  -1.507
  533    NH2  ARG  68           NH1      ARG  68  21.099  -8.059  -2.981
  534    H    ARG  68           HN       ARG  68  19.540  -1.221   0.462
  535    HA   ARG  68           HA       ARG  68  20.554  -1.295  -2.240
  536   1HB   ARG  68           HB2      ARG  68  18.395  -2.727  -0.725
  537   2HB   ARG  68           HB1      ARG  68  18.447  -2.864  -2.483
  538   1HG   ARG  68           HG2      ARG  68  20.839  -3.568  -2.314
  539   2HG   ARG  68           HG1      ARG  68  20.686  -3.547  -0.557
  540   1HD   ARG  68           HD2      ARG  68  19.488  -5.483  -0.509
  541   2HD   ARG  68           HD1      ARG  68  18.580  -5.067  -1.962
  542    HE   ARG  68           HE       ARG  68  21.129  -5.606  -2.902
  543   1HH1  ARG  68          HH21      ARG  68  18.782  -7.305  -0.954
  544   2HH1  ARG  68          HH22      ARG  68  19.318  -8.860  -1.483
  545   1HH2  ARG  68          HH11      ARG  68  21.795  -7.642  -3.565
  546   2HH2  ARG  68          HH12      ARG  68  21.006  -9.054  -2.945
  547    H    CYS  69           HN       CYS  69  17.186  -0.754  -1.128
  548    HA   CYS  69           HA       CYS  69  16.208   0.256  -3.572
  549   1HB   CYS  69           HB2      CYS  69  14.715  -0.324  -1.721
  550   2HB   CYS  69           HB1      CYS  69  15.370   0.995  -0.752
  551    H    LEU  70           HN       LEU  70  18.241   1.811  -1.194
  552    HA   LEU  70           HA       LEU  70  17.716   4.529  -1.687
  553   1HB   LEU  70           HB2      LEU  70  20.047   2.958  -0.757
  554   2HB   LEU  70           HB1      LEU  70  20.424   4.551  -1.410
  555    HG   LEU  70           HG       LEU  70  18.329   4.027   0.717
  556   1HD1  LEU  70          HD12      LEU  70  21.072   3.910   1.037
  557   2HD1  LEU  70          HD11      LEU  70  20.708   5.591   1.427
  558   3HD1  LEU  70          HD13      LEU  70  19.915   4.289   2.314
  559   1HD2  LEU  70          HD21      LEU  70  19.295   6.417  -0.794
  560   2HD2  LEU  70          HD23      LEU  70  17.676   6.044  -0.202
  561   3HD2  LEU  70          HD22      LEU  70  18.908   6.638   0.912
  562    H    GLY  71           HN       GLY  71  20.283   2.605  -3.302
  563   1HA   GLY  71           HA2      GLY  71  20.295   2.656  -5.817
  564   2HA   GLY  71           HA1      GLY  71  19.883   4.366  -5.690
  565    H    ALA  72           HN       ALA  72  22.023   4.095  -7.153
  566    HA   ALA  72           HA       ALA  72  24.345   4.520  -5.311
  567   1HB   ALA  72           HB2      ALA  72  24.082   3.013  -7.866
  568   2HB   ALA  72           HB1      ALA  72  25.568   3.935  -7.640
  569   3HB   ALA  72           HB3      ALA  72  25.116   2.694  -6.473
  570    H    THR  73           HN       THR  73  22.479   6.569  -6.150
  571    HA   THR  73           HA       THR  73  24.412   8.346  -7.534
  572    HB   THR  73           HB       THR  73  22.635   9.219  -9.015
  573    HG1  THR  73           HG1      THR  73  21.015   7.037  -8.487
  574   1HG2  THR  73          HG23      THR  73  22.977   6.212  -9.177
  575   2HG2  THR  73          HG22      THR  73  22.475   7.259 -10.504
  576   3HG2  THR  73          HG21      THR  73  24.096   7.408  -9.828
  577    H    ALA  74           HN       ALA  74  23.635  10.689  -7.344
  578    HA   ALA  74           HA       ALA  74  22.762  11.135  -4.584
  579   1HB   ALA  74           HB1      ALA  74  24.235  12.591  -6.563
  580   2HB   ALA  74           HB3      ALA  74  22.874  13.584  -6.039
  581   3HB   ALA  74           HB2      ALA  74  24.029  12.972  -4.853
  582    H    GLN  75           HN       GLN  75  21.434  11.583  -7.837
  583    HA   GLN  75           HA       GLN  75  19.101  13.051  -6.998
  584   1HB   GLN  75           HB2      GLN  75  19.557  11.302  -9.434
  585   2HB   GLN  75           HB1      GLN  75  18.181  12.382  -9.215
  586   1HG   GLN  75           HG2      GLN  75  19.431  14.271  -9.562
  587   2HG   GLN  75           HG1      GLN  75  20.871  13.580  -8.813
  588   1HE2  GLN  75          HE22      GLN  75  21.008  13.760 -12.683
  589   2HE2  GLN  75          HE21      GLN  75  20.329  14.874 -11.597
  590    H    GLN  76           HN       GLN  76  19.909   9.639  -7.116
  591    HA   GLN  76           HA       GLN  76  17.191   8.686  -6.822
  592   1HB   GLN  76           HB2      GLN  76  19.924   7.476  -6.497
  593   2HB   GLN  76           HB1      GLN  76  18.504   6.597  -5.927
  594   1HG   GLN  76           HG2      GLN  76  18.820   7.698  -8.734
  595   2HG   GLN  76           HG1      GLN  76  19.123   6.020  -8.281
  596   1HE2  GLN  76          HE22      GLN  76  15.573   5.468  -7.509
  597   2HE2  GLN  76          HE21      GLN  76  17.083   5.182  -6.791
  598    H    PHE  77           HN       PHE  77  19.628   9.875  -4.610
  599    HA   PHE  77           HA       PHE  77  18.617   8.703  -2.202
  600   1HB   PHE  77           HB2      PHE  77  20.703  10.432  -2.882
  601   2HB   PHE  77           HB1      PHE  77  19.663  11.403  -1.841
  602    HD1  PHE  77           HD2      PHE  77  19.117  10.639   0.459
  603    HD2  PHE  77           HD1      PHE  77  21.910   8.525  -2.028
  604    HE1  PHE  77           HE2      PHE  77  19.976   9.432   2.448
  605    HE2  PHE  77           HE1      PHE  77  22.768   7.319  -0.038
  606    HZ   PHE  77           HZ       PHE  77  21.802   7.773   2.199
  607    H    HIS  78           HN       HIS  78  18.117  12.025  -3.462
  608    HA   HIS  78           HA       HIS  78  16.081  12.703  -1.589
  609   1HB   HIS  78           HB2      HIS  78  17.428  14.129  -3.415
  610   2HB   HIS  78           HB1      HIS  78  15.947  13.856  -4.335
  611    HD1  HIS  78           HD1      HIS  78  13.782  14.970  -3.487
  612    HD2  HIS  78           HD2      HIS  78  17.083  15.716  -1.052
  613    HE1  HIS  78           HE1      HIS  78  13.082  16.789  -1.870
  614    NH1  ARG  79           NH2      ARG  79  13.964  12.544 -10.386
  615    NH2  ARG  79           NH1      ARG  79  12.548  14.035  -9.452
  616    H    ARG  79           HN       ARG  79  15.855  11.375  -4.886
  617    HA   ARG  79           HA       ARG  79  13.044  11.365  -5.133
  618   1HB   ARG  79           HB2      ARG  79  14.977  10.596  -6.783
  619   2HB   ARG  79           HB1      ARG  79  14.593   9.004  -6.128
  620   1HG   ARG  79           HG2      ARG  79  12.720   8.888  -7.370
  621   2HG   ARG  79           HG1      ARG  79  12.156  10.433  -6.732
  622   1HD   ARG  79           HD2      ARG  79  14.359  10.650  -8.683
  623   2HD   ARG  79           HD1      ARG  79  12.856  10.010  -9.347
  624    HE   ARG  79           HE       ARG  79  12.044  12.215  -7.888
  625   1HH1  ARG  79          HH21      ARG  79  14.382  11.638 -10.415
  626   2HH1  ARG  79          HH22      ARG  79  14.227  13.232 -11.064
  627   1HH2  ARG  79          HH11      ARG  79  11.871  14.273  -8.755
  628   2HH2  ARG  79          HH12      ARG  79  12.820  14.712 -10.135
  629    H    HIS  80           HN       HIS  80  15.162   9.231  -3.307
  630    HA   HIS  80           HA       HIS  80  13.109   7.238  -2.784
  631   1HB   HIS  80           HB2      HIS  80  15.434   6.574  -2.608
  632   2HB   HIS  80           HB1      HIS  80  15.751   7.842  -1.423
  633    HD1  HIS  80           HD1      HIS  80  13.568   4.738  -1.798
  634    HD2  HIS  80           HD2      HIS  80  15.335   7.039   1.194
  635    HE1  HIS  80           HE1      HIS  80  13.120   3.537   0.387
  636    H    LYS  81           HN       LYS  81  14.332  10.120  -1.139
  637    HA   LYS  81           HA       LYS  81  13.007   9.825   1.341
  638   1HB   LYS  81           HB2      LYS  81  14.519  11.801   0.108
  639   2HB   LYS  81           HB1      LYS  81  12.940  12.564   0.294
  640   1HG   LYS  81           HG2      LYS  81  13.338  12.880   2.483
  641   2HG   LYS  81           HG1      LYS  81  13.528  11.143   2.708
  642   1HD   LYS  81           HD2      LYS  81  15.845  12.432   1.430
  643   2HD   LYS  81           HD1      LYS  81  15.529  12.994   3.071
  644   1HE   LYS  81           HE2      LYS  81  15.228  10.386   3.524
  645   2HE   LYS  81           HE1      LYS  81  16.283  10.264   2.116
  646   1HZ   LYS  81           HZ2      LYS  81  16.881  11.974   4.464
  647   2HZ   LYS  81           HZ1      LYS  81  17.450  10.381   4.298
  648   3HZ   LYS  81           HZ3      LYS  81  17.924  11.571   3.185
  649    H    GLN  82           HN       GLN  82  11.793  10.763  -1.817
  650    HA   GLN  82           HA       GLN  82   9.222  11.706  -0.842
  651   1HB   GLN  82           HB2      GLN  82   9.857  10.689  -3.623
  652   2HB   GLN  82           HB1      GLN  82   8.598  11.834  -3.155
  653   1HG   GLN  82           HG2      GLN  82  11.040  12.892  -2.183
  654   2HG   GLN  82           HG1      GLN  82  11.347  12.363  -3.837
  655   1HE2  GLN  82          HE22      GLN  82   9.325  14.875  -5.301
  656   2HE2  GLN  82          HE21      GLN  82  10.258  13.481  -5.564
  657    H    LEU  83           HN       LEU  83  10.517   8.638  -2.037
  658    HA   LEU  83           HA       LEU  83   8.116   7.186  -2.341
  659   1HB   LEU  83           HB2      LEU  83  10.146   6.144  -3.035
  660   2HB   LEU  83           HB1      LEU  83  10.891   6.364  -1.454
  661    HG   LEU  83           HG       LEU  83   9.298   4.757  -0.471
  662   1HD1  LEU  83          HD11      LEU  83   7.955   5.206  -3.009
  663   2HD1  LEU  83          HD13      LEU  83   8.213   3.485  -2.727
  664   3HD1  LEU  83          HD12      LEU  83   7.334   4.449  -1.541
  665   1HD2  LEU  83          HD21      LEU  83  10.856   3.891  -2.910
  666   2HD2  LEU  83          HD23      LEU  83  11.328   3.766  -1.217
  667   3HD2  LEU  83          HD22      LEU  83  10.052   2.730  -1.854
  668    H    ILE  84           HN       ILE  84  10.099   7.670   0.583
  669    HA   ILE  84           HA       ILE  84   8.414   6.140   2.333
  670    HB   ILE  84           HB       ILE  84  10.152   8.497   3.095
  671   1HG1  ILE  84          HG12      ILE  84  11.598   7.145   1.795
  672   2HG1  ILE  84          HG11      ILE  84  11.878   6.598   3.448
  673   1HG2  ILE  84          HG22      ILE  84   9.030   6.091   4.523
  674   2HG2  ILE  84          HG21      ILE  84  10.477   6.903   5.121
  675   3HG2  ILE  84          HG23      ILE  84   8.956   7.788   4.998
  676   1HD1  ILE  84          HD12      ILE  84  10.156   4.790   3.046
  677   2HD1  ILE  84          HD11      ILE  84  10.147   5.266   1.348
  678   3HD1  ILE  84          HD13      ILE  84  11.621   4.631   2.079
  679    NH1  ARG  85           NH2      ARG  85  10.072  15.356   1.241
  680    NH2  ARG  85           NH1      ARG  85  10.457  15.698   3.440
  681    H    ARG  85           HN       ARG  85   8.327   9.510   1.289
  682    HA   ARG  85           HA       ARG  85   6.507  10.481   3.257
  683   1HB   ARG  85           HB2      ARG  85   7.693  11.438   0.837
  684   2HB   ARG  85           HB1      ARG  85   5.959  11.752   0.760
  685   1HG   ARG  85           HG2      ARG  85   5.987  13.144   2.617
  686   2HG   ARG  85           HG1      ARG  85   7.413  12.368   3.306
  687   1HD   ARG  85           HD2      ARG  85   8.485  13.334   1.016
  688   2HD   ARG  85           HD1      ARG  85   7.231  14.544   1.293
  689    HE   ARG  85           HE       ARG  85   8.467  14.296   3.758
  690   1HH1  ARG  85          HH21      ARG  85   9.537  14.953   0.501
  691   2HH1  ARG  85          HH22      ARG  85  10.873  15.915   1.025
  692   1HH2  ARG  85          HH11      ARG  85  10.212  15.553   4.399
  693   2HH2  ARG  85          HH12      ARG  85  11.253  16.255   3.206
  694    H    PHE  86           HN       PHE  86   5.878   9.123   0.019
  695    HA   PHE  86           HA       PHE  86   3.033   9.339   0.169
  696   1HB   PHE  86           HB2      PHE  86   4.986   7.872  -1.531
  697   2HB   PHE  86           HB1      PHE  86   3.325   7.278  -1.527
  698    HD1  PHE  86           HD2      PHE  86   1.557   9.408  -1.441
  699    HD2  PHE  86           HD1      PHE  86   5.448   9.359  -3.258
  700    HE1  PHE  86           HE2      PHE  86   0.880  11.264  -2.938
  701    HE2  PHE  86           HE1      PHE  86   4.773  11.216  -4.755
  702    HZ   PHE  86           HZ       PHE  86   2.489  12.171  -4.595
  703    H    LEU  87           HN       LEU  87   5.011   6.352   0.461
  704    HA   LEU  87           HA       LEU  87   2.952   4.678   1.366
  705   1HB   LEU  87           HB2      LEU  87   4.773   3.363   2.546
  706   2HB   LEU  87           HB1      LEU  87   5.055   3.671   0.836
  707    HG   LEU  87           HG       LEU  87   6.297   5.828   1.819
  708   1HD1  LEU  87          HD11      LEU  87   5.590   4.628   4.169
  709   2HD1  LEU  87          HD13      LEU  87   7.198   3.954   3.911
  710   3HD1  LEU  87          HD12      LEU  87   6.974   5.701   3.985
  711   1HD2  LEU  87          HD21      LEU  87   7.191   2.997   1.408
  712   2HD2  LEU  87          HD23      LEU  87   7.571   4.434   0.460
  713   3HD2  LEU  87          HD22      LEU  87   8.354   4.172   2.016
  714    H    LYS  88           HN       LYS  88   4.619   7.187   3.129
  715    HA   LYS  88           HA       LYS  88   3.928   6.294   5.778
  716   1HB   LYS  88           HB2      LYS  88   5.066   8.688   4.543
  717   2HB   LYS  88           HB1      LYS  88   3.989   9.078   5.885
  718   1HG   LYS  88           HG2      LYS  88   5.313   7.061   7.036
  719   2HG   LYS  88           HG1      LYS  88   6.562   7.563   5.896
  720   1HD   LYS  88           HD2      LYS  88   7.112   9.130   7.434
  721   2HD   LYS  88           HD1      LYS  88   5.651   9.972   6.915
  722   1HE   LYS  88           HE2      LYS  88   4.562   8.196   8.640
  723   2HE   LYS  88           HE1      LYS  88   6.152   8.391   9.379
  724   1HZ   LYS  88           HZ2      LYS  88   4.689  10.781   8.515
  725   2HZ   LYS  88           HZ1      LYS  88   4.215  10.014   9.955
  726   3HZ   LYS  88           HZ3      LYS  88   5.800  10.595   9.787
  727    NH1  ARG  89           NH2      ARG  89  -2.017  14.322   2.600
  728    NH2  ARG  89           NH1      ARG  89  -1.980  13.898   0.383
  729    H    ARG  89           HN       ARG  89   2.376   8.579   3.521
  730    HA   ARG  89           HA       ARG  89   0.127   9.147   5.212
  731   1HB   ARG  89           HB2      ARG  89   0.781  10.506   3.219
  732   2HB   ARG  89           HB1      ARG  89   0.256   9.181   2.181
  733   1HG   ARG  89           HG2      ARG  89  -1.890   9.831   2.342
  734   2HG   ARG  89           HG1      ARG  89  -1.806   9.812   4.102
  735   1HD   ARG  89           HD2      ARG  89  -2.152  12.063   3.842
  736   2HD   ARG  89           HD1      ARG  89  -0.402  12.067   3.621
  737    HE   ARG  89           HE       ARG  89  -1.391  11.618   1.073
  738   1HH1  ARG  89          HH21      ARG  89  -1.910  14.024   3.548
  739   2HH1  ARG  89          HH22      ARG  89  -2.261  15.271   2.404
  740   1HH2  ARG  89          HH11      ARG  89  -1.845  13.266  -0.379
  741   2HH2  ARG  89          HH12      ARG  89  -2.225  14.851   0.205
  742    H    LEU  90           HN       LEU  90   0.852   6.533   2.989
  743    HA   LEU  90           HA       LEU  90  -1.865   5.500   2.888
  744   1HB   LEU  90           HB2      LEU  90   0.641   4.973   1.606
  745   2HB   LEU  90           HB1      LEU  90   0.032   3.463   2.280
  746    HG   LEU  90           HG       LEU  90  -1.675   5.332   0.623
  747   1HD1  LEU  90          HD13      LEU  90   0.383   4.354  -0.566
  748   2HD1  LEU  90          HD12      LEU  90  -0.379   2.780  -0.344
  749   3HD1  LEU  90          HD11      LEU  90  -1.185   4.023  -1.301
  750   1HD2  LEU  90          HD22      LEU  90  -2.457   3.353   2.291
  751   2HD2  LEU  90          HD21      LEU  90  -3.308   3.722   0.791
  752   3HD2  LEU  90          HD23      LEU  90  -2.142   2.400   0.841
  753    H    ASP  91           HN       ASP  91   0.786   5.188   5.119
  754    HA   ASP  91           HA       ASP  91   0.162   2.593   6.153
  755   1HB   ASP  91           HB2      ASP  91   2.162   3.181   7.056
  756   2HB   ASP  91           HB1      ASP  91   1.795   4.905   6.974
  757    NH1  ARG  92           NH2      ARG  92  -4.346   7.737  13.891
  758    NH2  ARG  92           NH1      ARG  92  -5.401   5.742  13.802
  759    H    ARG  92           HN       ARG  92  -0.868   5.841   7.255
  760    HA   ARG  92           HA       ARG  92  -2.704   4.578   9.192
  761   1HB   ARG  92           HB2      ARG  92  -1.546   7.246   8.770
  762   2HB   ARG  92           HB1      ARG  92  -3.235   7.275   9.271
  763   1HG   ARG  92           HG2      ARG  92  -2.014   5.312  10.882
  764   2HG   ARG  92           HG1      ARG  92  -0.884   6.665  10.845
  765   1HD   ARG  92           HD2      ARG  92  -2.198   7.558  12.464
  766   2HD   ARG  92           HD1      ARG  92  -3.300   7.948  11.144
  767    HE   ARG  92           HE       ARG  92  -3.976   5.350  11.842
  768   1HH1  ARG  92          HH21      ARG  92  -3.679   8.389  13.534
  769   2HH1  ARG  92          HH22      ARG  92  -4.887   7.976  14.697
  770   1HH2  ARG  92          HH11      ARG  92  -5.542   4.852  13.369
  771   2HH2  ARG  92          HH12      ARG  92  -5.935   5.997  14.608
  772    H    ASN  93           HN       ASN  93  -2.881   6.011   6.006
  773    HA   ASN  93           HA       ASN  93  -5.727   6.603   6.184
  774   1HB   ASN  93           HB2      ASN  93  -3.669   6.629   4.014
  775   2HB   ASN  93           HB1      ASN  93  -5.372   6.640   3.563
  776   1HD2  ASN  93          HD22      ASN  93  -4.338   9.769   6.015
  777   2HD2  ASN  93          HD21      ASN  93  -3.899   8.191   6.453
  778    H    LEU  94           HN       LEU  94  -3.839   3.920   4.797
  779    HA   LEU  94           HA       LEU  94  -5.918   2.600   3.446
  780   1HB   LEU  94           HB2      LEU  94  -3.275   2.013   4.085
  781   2HB   LEU  94           HB1      LEU  94  -4.193   0.720   4.852
  782    HG   LEU  94           HG       LEU  94  -4.750   1.560   2.011
  783   1HD1  LEU  94          HD13      LEU  94  -2.291   0.575   2.851
  784   2HD1  LEU  94          HD12      LEU  94  -3.156  -0.872   2.333
  785   3HD1  LEU  94          HD11      LEU  94  -2.935   0.472   1.213
  786   1HD2  LEU  94          HD22      LEU  94  -5.896  -0.264   3.845
  787   2HD2  LEU  94          HD21      LEU  94  -6.263  -0.104   2.128
  788   3HD2  LEU  94          HD23      LEU  94  -5.026  -1.241   2.662
  789    CH2  TRP  95           CH2      TRP  95  -6.245   2.036  13.581
  790    H    TRP  95           HN       TRP  95  -4.797   1.638   6.726
  791    HA   TRP  95           HA       TRP  95  -7.375   0.286   7.150
  792   1HB   TRP  95           HB2      TRP  95  -6.392  -0.738   8.975
  793   2HB   TRP  95           HB1      TRP  95  -4.980  -0.418   7.971
  794    HD1  TRP  95           HD1      TRP  95  -3.374   1.534   8.678
  795    HE1  TRP  95           HE1      TRP  95  -3.021   2.767  10.922
  796    HE3  TRP  95           HE3      TRP  95  -7.604   0.102  11.120
  797    HZ2  TRP  95           HZ2      TRP  95  -4.373   3.091  13.428
  798    HZ3  TRP  95           HZ3      TRP  95  -8.057   0.880  13.431
  799    HH2  TRP  95           HH2      TRP  95  -6.447   2.372  14.587
  800    H    GLY  96           HN       GLY  96  -6.011   3.367   7.911
  801   1HA   GLY  96           HA2      GLY  96  -7.274   4.095  10.301
  802   2HA   GLY  96           HA1      GLY  96  -7.015   5.226   8.972
  803    H    LEU  97           HN       LEU  97  -8.647   3.723   7.090
  804    HA   LEU  97           HA       LEU  97 -11.303   4.661   7.994
  805   1HB   LEU  97           HB2      LEU  97 -10.284   5.104   5.664
  806   2HB   LEU  97           HB1      LEU  97 -10.638   3.411   5.324
  807    HG   LEU  97           HG       LEU  97 -13.016   4.202   6.378
  808   1HD1  LEU  97          HD11      LEU  97 -11.578   6.613   5.800
  809   2HD1  LEU  97          HD13      LEU  97 -12.908   6.469   4.651
  810   3HD1  LEU  97          HD12      LEU  97 -13.232   6.442   6.385
  811   1HD2  LEU  97          HD22      LEU  97 -12.614   3.002   4.238
  812   2HD2  LEU  97          HD21      LEU  97 -13.801   4.292   4.050
  813   3HD2  LEU  97          HD23      LEU  97 -12.146   4.528   3.487
  814    H    ALA  98           HN       ALA  98  -9.551   1.700   7.308
  815    HA   ALA  98           HA       ALA  98 -11.602  -0.178   7.019
  816   1HB   ALA  98           HB2      ALA  98  -8.990  -0.427   8.542
  817   2HB   ALA  98           HB1      ALA  98 -10.008  -1.792   8.083
  818   3HB   ALA  98           HB3      ALA  98  -9.251  -0.799   6.838
  819    H    GLY  99           HN       GLY  99 -10.148   0.932  10.088
  820   1HA   GLY  99           HA2      GLY  99 -11.403   1.351  12.102
  821   2HA   GLY  99           HA1      GLY  99 -12.751   0.442  11.418
  822    H    LEU 100           HN       LEU 100  -9.458  -0.783  11.353
  823    HA   LEU 100           HA       LEU 100 -10.231  -2.766  13.457
  824   1HB   LEU 100           HB2      LEU 100  -9.404  -3.186  10.686
  825   2HB   LEU 100           HB1      LEU 100  -8.371  -4.048  11.828
  826    HG   LEU 100           HG       LEU 100 -10.741  -4.643  12.923
  827   1HD1  LEU 100          HD11      LEU 100 -11.941  -3.284  11.183
  828   2HD1  LEU 100          HD13      LEU 100 -11.353  -4.413   9.962
  829   3HD1  LEU 100          HD12      LEU 100 -12.446  -4.974  11.227
  830   1HD2  LEU 100          HD23      LEU 100  -8.809  -6.001  11.538
  831   2HD2  LEU 100          HD22      LEU 100 -10.255  -6.754  12.209
  832   3HD2  LEU 100          HD21      LEU 100 -10.219  -6.274  10.513
  833    H    ASN 101           HN       ASN 101  -8.826  -2.756  15.142
  834    HA   ASN 101           HA       ASN 101  -6.403  -1.155  15.044
  835   1HB   ASN 101           HB2      ASN 101  -7.451  -1.202  17.161
  836   2HB   ASN 101           HB1      ASN 101  -7.673  -2.951  17.108
  837   1HD2  ASN 101          HD22      ASN 101  -4.522  -3.642  18.529
  838   2HD2  ASN 101          HD21      ASN 101  -6.006  -4.250  17.972
  839    H    SER 102           HN       SER 102  -6.819  -4.620  15.866
  840    HA   SER 102           HA       SER 102  -4.044  -5.114  14.991
  841   1HB   SER 102           HB2      SER 102  -5.438  -6.152  17.044
  842   2HB   SER 102           HB1      SER 102  -5.829  -7.353  15.816
  843    HG   SER 102           HG       SER 102  -3.207  -6.458  16.448
  844    H    CYS 103           HN       CYS 103  -3.538  -6.743  13.390
  845    HA   CYS 103           HA       CYS 103  -5.731  -7.710  11.667
  846   1HB   CYS 103           HB2      CYS 103  -3.625  -5.733  10.782
  847   2HB   CYS 103           HB1      CYS 103  -4.397  -6.825   9.633
  848    HA   PRO 104           HA       PRO 104  -2.181 -10.581  12.530
  849   1HB   PRO 104           HB2      PRO 104  -4.170 -12.671  12.510
  850   2HB   PRO 104           HB1      PRO 104  -3.209 -12.087  13.875
  851   1HG   PRO 104           HG2      PRO 104  -6.012 -11.641  13.386
  852   2HG   PRO 104           HG1      PRO 104  -5.042 -11.051  14.741
  853   1HD   PRO 104           HD2      PRO 104  -6.091  -9.527  12.535
  854   2HD   PRO 104           HD1      PRO 104  -5.093  -8.944  13.883
  855    H    VAL 105           HN       VAL 105  -1.511 -10.201  10.303
  856    HA   VAL 105           HA       VAL 105  -2.953 -11.485   8.105
  857    HB   VAL 105           HB       VAL 105  -1.678  -9.479   7.608
  858   1HG1  VAL 105          HG13      VAL 105   0.215 -10.693   9.391
  859   2HG1  VAL 105          HG12      VAL 105   1.012 -10.372   7.851
  860   3HG1  VAL 105          HG11      VAL 105   0.225  -9.058   8.727
  861   1HG2  VAL 105          HG23      VAL 105  -1.721 -11.408   5.939
  862   2HG2  VAL 105          HG22      VAL 105  -0.405 -10.252   5.728
  863   3HG2  VAL 105          HG21      VAL 105  -0.095 -11.809   6.496
  864    H    LYS 106           HN       LYS 106  -2.986 -13.717   8.246
  865    HA   LYS 106           HA       LYS 106  -0.335 -15.072   8.262
  866   1HB   LYS 106           HB2      LYS 106  -1.280 -15.157  10.575
  867   2HB   LYS 106           HB1      LYS 106  -2.697 -15.986   9.931
  868   1HG   LYS 106           HG2      LYS 106  -1.576 -17.923  10.191
  869   2HG   LYS 106           HG1      LYS 106  -0.503 -17.396   8.893
  870   1HD   LYS 106           HD2      LYS 106   1.166 -16.770  10.339
  871   2HD   LYS 106           HD1      LYS 106   0.032 -16.274  11.596
  872   1HE   LYS 106           HE2      LYS 106  -0.144 -18.399  12.474
  873   2HE   LYS 106           HE1      LYS 106   0.153 -19.179  10.920
  874   1HZ   LYS 106           HZ2      LYS 106   2.479 -17.977  11.285
  875   2HZ   LYS 106           HZ1      LYS 106   2.045 -18.218  12.910
  876   3HZ   LYS 106           HZ3      LYS 106   2.156 -19.544  11.859
  877    H    GLU 107           HN       GLU 107  -1.162 -14.981   5.888
  878    HA   GLU 107           HA       GLU 107  -2.100 -17.618   5.184
  879   1HB   GLU 107           HB2      GLU 107  -4.213 -16.999   4.113
  880   2HB   GLU 107           HB1      GLU 107  -4.273 -16.583   5.825
  881   1HG   GLU 107           HG2      GLU 107  -3.195 -14.307   4.667
  882   2HG   GLU 107           HG1      GLU 107  -4.392 -14.831   3.483
  883    H    ALA 108           HN       ALA 108   0.174 -16.509   4.428
  884    HA   ALA 108           HA       ALA 108   0.023 -16.463   1.572
  885   1HB   ALA 108           HB1      ALA 108  -0.840 -14.132   2.217
  886   2HB   ALA 108           HB3      ALA 108   0.801 -13.799   2.767
  887   3HB   ALA 108           HB2      ALA 108   0.502 -14.186   1.073
  888    H    ASP 109           HN       ASP 109   2.010 -16.877   0.736
  889    HA   ASP 109           HA       ASP 109   4.225 -17.267   2.639
  890   1HB   ASP 109           HB2      ASP 109   3.843 -17.979  -0.281
  891   2HB   ASP 109           HB1      ASP 109   5.354 -18.258   0.585
  892    H    GLN 110           HN       GLN 110   6.492 -16.659   1.564
  893    HA   GLN 110           HA       GLN 110   6.519 -13.781   1.388
  894   1HB   GLN 110           HB2      GLN 110   8.406 -15.772   1.894
  895   2HB   GLN 110           HB1      GLN 110   8.934 -15.059   0.369
  896   1HG   GLN 110           HG2      GLN 110   9.893 -13.482   1.700
  897   2HG   GLN 110           HG1      GLN 110   8.258 -12.823   1.784
  898   1HE2  GLN 110          HE22      GLN 110   7.844 -13.610   5.199
  899   2HE2  GLN 110          HE21      GLN 110   7.187 -12.890   3.809
  900    H    SER 111           HN       SER 111   5.230 -13.223  -0.434
  901    HA   SER 111           HA       SER 111   5.993 -14.226  -3.091
  902   1HB   SER 111           HB2      SER 111   4.051 -13.218  -3.859
  903   2HB   SER 111           HB1      SER 111   3.609 -13.467  -2.172
  904    HG   SER 111           HG       SER 111   3.366 -11.269  -3.173
  905    H    THR 112           HN       THR 112   5.732 -11.845  -4.573
  906    HA   THR 112           HA       THR 112   8.167 -10.372  -3.651
  907    HB   THR 112           HB       THR 112   8.624  -9.914  -6.016
  908    HG1  THR 112           HG1      THR 112   7.274 -10.823  -7.580
  909   1HG2  THR 112          HG23      THR 112   8.912 -12.318  -4.729
  910   2HG2  THR 112          HG22      THR 112   8.066 -12.802  -6.199
  911   3HG2  THR 112          HG21      THR 112   9.603 -11.943  -6.307
  912    H    LEU 113           HN       LEU 113   8.145  -8.086  -3.792
  913    HA   LEU 113           HA       LEU 113   5.556  -6.859  -3.429
  914   1HB   LEU 113           HB2      LEU 113   8.092  -6.196  -2.695
  915   2HB   LEU 113           HB1      LEU 113   7.843  -5.093  -4.050
  916    HG   LEU 113           HG       LEU 113   5.590  -5.339  -2.130
  917   1HD1  LEU 113          HD11      LEU 113   8.080  -5.104  -1.019
  918   2HD1  LEU 113          HD13      LEU 113   7.665  -3.412  -1.290
  919   3HD1  LEU 113          HD12      LEU 113   6.612  -4.432  -0.309
  920   1HD2  LEU 113          HD22      LEU 113   6.966  -3.142  -3.691
  921   2HD2  LEU 113          HD21      LEU 113   5.346  -3.796  -3.937
  922   3HD2  LEU 113          HD23      LEU 113   5.691  -2.808  -2.518
  923    H    GLU 114           HN       GLU 114   7.282  -7.637  -6.280
  924    HA   GLU 114           HA       GLU 114   6.567  -5.377  -7.896
  925   1HB   GLU 114           HB2      GLU 114   7.410  -8.198  -8.434
  926   2HB   GLU 114           HB1      GLU 114   6.721  -7.258  -9.759
  927   1HG   GLU 114           HG2      GLU 114   8.537  -5.894  -9.901
  928   2HG   GLU 114           HG1      GLU 114   8.732  -5.815  -8.150
  929    H    ASN 115           HN       ASN 115   5.123  -8.646  -7.958
  930    HA   ASN 115           HA       ASN 115   2.764  -7.762  -9.337
  931   1HB   ASN 115           HB2      ASN 115   1.951  -9.971  -9.051
  932   2HB   ASN 115           HB1      ASN 115   3.702 -10.147  -9.171
  933   1HD2  ASN 115          HD22      ASN 115   1.825 -11.284  -5.784
  934   2HD2  ASN 115          HD21      ASN 115   0.973 -10.773  -7.161
  935    H    PHE 116           HN       PHE 116   3.675  -7.546  -6.006
  936    HA   PHE 116           HA       PHE 116   1.010  -7.618  -4.882
  937   1HB   PHE 116           HB2      PHE 116   2.852  -7.954  -3.379
  938   2HB   PHE 116           HB1      PHE 116   3.634  -6.465  -3.905
  939    HD1  PHE 116           HD1      PHE 116   0.536  -7.755  -2.252
  940    HD2  PHE 116           HD2      PHE 116   3.194  -4.426  -2.808
  941    HE1  PHE 116           HE1      PHE 116  -0.669  -6.497  -0.487
  942    HE2  PHE 116           HE2      PHE 116   1.988  -3.168  -1.042
  943    HZ   PHE 116           HZ       PHE 116   0.058  -4.205   0.119
  944    H    LEU 117           HN       LEU 117   3.223  -4.834  -5.332
  945    HA   LEU 117           HA       LEU 117   1.241  -2.841  -4.954
  946   1HB   LEU 117           HB2      LEU 117   3.962  -2.946  -6.141
  947   2HB   LEU 117           HB1      LEU 117   2.952  -1.583  -6.627
  948    HG   LEU 117           HG       LEU 117   3.432  -2.401  -3.749
  949   1HD1  LEU 117          HD12      LEU 117   5.504  -1.587  -4.832
  950   2HD1  LEU 117          HD11      LEU 117   4.650  -0.136  -5.360
  951   3HD1  LEU 117          HD13      LEU 117   4.907  -0.432  -3.641
  952   1HD2  LEU 117          HD22      LEU 117   1.742  -0.407  -5.138
  953   2HD2  LEU 117          HD21      LEU 117   1.546  -1.132  -3.542
  954   3HD2  LEU 117          HD23      LEU 117   2.656   0.220  -3.767
  955    H    GLU 118           HN       GLU 118   2.121  -4.714  -7.805
  956    HA   GLU 118           HA       GLU 118   0.779  -3.124  -9.758
  957   1HB   GLU 118           HB2      GLU 118   2.115  -4.796 -10.695
  958   2HB   GLU 118           HB1      GLU 118   1.546  -6.022  -9.562
  959   1HG   GLU 118           HG2      GLU 118  -0.486  -6.318 -10.706
  960   2HG   GLU 118           HG1      GLU 118  -0.352  -4.767 -11.535
  961    NH1  ARG 119           NH2      ARG 119  -5.117  -9.048 -11.120
  962    NH2  ARG 119           NH1      ARG 119  -3.541  -8.368 -12.590
  963    H    ARG 119           HN       ARG 119  -0.364  -5.894  -7.831
  964    HA   ARG 119           HA       ARG 119  -3.076  -5.796  -8.805
  965   1HB   ARG 119           HB2      ARG 119  -1.795  -6.993  -6.338
  966   2HB   ARG 119           HB1      ARG 119  -3.530  -7.107  -6.641
  967   1HG   ARG 119           HG2      ARG 119  -1.448  -7.978  -8.657
  968   2HG   ARG 119           HG1      ARG 119  -2.158  -9.077  -7.474
  969   1HD   ARG 119           HD2      ARG 119  -3.941  -9.355  -8.817
  970   2HD   ARG 119           HD1      ARG 119  -4.295  -7.634  -8.687
  971    HE   ARG 119           HE       ARG 119  -2.263  -7.786 -10.580
  972   1HH1  ARG 119          HH21      ARG 119  -5.439  -9.179 -10.184
  973   2HH1  ARG 119          HH22      ARG 119  -5.704  -9.311 -11.886
  974   1HH2  ARG 119          HH11      ARG 119  -2.642  -7.972 -12.779
  975   2HH2  ARG 119          HH12      ARG 119  -4.138  -8.634 -13.345
  976    H    LEU 120           HN       LEU 120  -1.335  -3.836  -6.539
  977    HA   LEU 120           HA       LEU 120  -3.689  -3.011  -5.026
  978   1HB   LEU 120           HB2      LEU 120  -0.824  -2.537  -4.949
  979   2HB   LEU 120           HB1      LEU 120  -1.718  -1.025  -4.779
  980    HG   LEU 120           HG       LEU 120  -2.849  -3.256  -3.230
  981   1HD1  LEU 120          HD11      LEU 120  -0.036  -2.259  -2.765
  982   2HD1  LEU 120          HD13      LEU 120  -1.020  -2.903  -1.451
  983   3HD1  LEU 120          HD12      LEU 120  -0.609  -3.925  -2.828
  984   1HD2  LEU 120          HD22      LEU 120  -3.113  -0.557  -3.257
  985   2HD2  LEU 120          HD21      LEU 120  -3.459  -1.542  -1.835
  986   3HD2  LEU 120          HD23      LEU 120  -1.902  -0.729  -1.986
  987    H    LYS 121           HN       LYS 121  -1.867  -1.811  -7.807
  988    HA   LYS 121           HA       LYS 121  -3.345   0.688  -8.001
  989   1HB   LYS 121           HB2      LYS 121  -0.999  -0.116  -9.036
  990   2HB   LYS 121           HB1      LYS 121  -2.048  -0.504 -10.400
  991   1HG   LYS 121           HG2      LYS 121  -3.014   1.929  -9.874
  992   2HG   LYS 121           HG1      LYS 121  -1.394   2.159  -9.214
  993   1HD   LYS 121           HD2      LYS 121  -1.270   2.806 -11.514
  994   2HD   LYS 121           HD1      LYS 121  -0.502   1.222 -11.409
  995   1HE   LYS 121           HE2      LYS 121  -2.557   0.140 -12.185
  996   2HE   LYS 121           HE1      LYS 121  -3.391   1.693 -12.209
  997   1HZ   LYS 121           HZ2      LYS 121  -0.895   1.375 -13.723
  998   2HZ   LYS 121           HZ1      LYS 121  -2.337   0.744 -14.365
  999   3HZ   LYS 121           HZ3      LYS 121  -2.215   2.401 -14.023
 1000    H    THR 122           HN       THR 122  -3.721  -2.555  -9.234
 1001    HA   THR 122           HA       THR 122  -5.706  -1.778 -11.229
 1002    HB   THR 122           HB       THR 122  -5.789  -4.587 -10.562
 1003    HG1  THR 122           HG1      THR 122  -3.283  -4.074 -11.487
 1004   1HG2  THR 122          HG23      THR 122  -4.911  -2.880 -12.885
 1005   2HG2  THR 122          HG22      THR 122  -4.794  -4.638 -12.935
 1006   3HG2  THR 122          HG21      THR 122  -6.366  -3.864 -12.743
 1007    H    ILE 123           HN       ILE 123  -5.772  -3.320  -8.050
 1008    HA   ILE 123           HA       ILE 123  -8.633  -3.721  -8.032
 1009    HB   ILE 123           HB       ILE 123  -6.666  -3.578  -5.733
 1010   1HG1  ILE 123          HG12      ILE 123  -6.290  -5.320  -7.583
 1011   2HG1  ILE 123          HG11      ILE 123  -6.456  -5.948  -5.944
 1012   1HG2  ILE 123          HG21      ILE 123  -9.575  -4.151  -5.945
 1013   2HG2  ILE 123          HG23      ILE 123  -8.643  -5.238  -4.916
 1014   3HG2  ILE 123          HG22      ILE 123  -8.651  -3.504  -4.589
 1015   1HD1  ILE 123          HD13      ILE 123  -8.973  -5.641  -7.496
 1016   2HD1  ILE 123          HD12      ILE 123  -7.879  -6.920  -8.022
 1017   3HD1  ILE 123          HD11      ILE 123  -8.493  -6.911  -6.370
 1018    H    MET 124           HN       MET 124  -6.529  -1.073  -7.014
 1019    HA   MET 124           HA       MET 124  -8.739   0.247  -5.617
 1020   1HB   MET 124           HB2      MET 124  -5.895   0.605  -5.777
 1021   2HB   MET 124           HB1      MET 124  -6.687   2.128  -6.162
 1022   1HG   MET 124           HG2      MET 124  -7.287   2.436  -4.017
 1023   2HG   MET 124           HG1      MET 124  -8.000   0.829  -3.925
 1024   1HE   MET 124           HE2      MET 124  -5.804   3.205  -2.942
 1025   2HE   MET 124           HE1      MET 124  -5.911   2.379  -1.389
 1026   3HE   MET 124           HE3      MET 124  -4.354   2.524  -2.212
 1027    NH1  ARG 125           NH2      ARG 125  -5.178   2.563 -15.247
 1028    NH2  ARG 125           NH1      ARG 125  -4.660   4.717 -14.807
 1029    H    ARG 125           HN       ARG 125  -7.174   0.530  -8.787
 1030    HA   ARG 125           HA       ARG 125  -8.566   2.942  -9.501
 1031   1HB   ARG 125           HB2      ARG 125  -6.538   2.004 -10.687
 1032   2HB   ARG 125           HB1      ARG 125  -7.609   0.806 -11.415
 1033   1HG   ARG 125           HG2      ARG 125  -9.033   2.728 -12.246
 1034   2HG   ARG 125           HG1      ARG 125  -7.752   3.816 -11.714
 1035   1HD   ARG 125           HD2      ARG 125  -6.587   1.681 -13.245
 1036   2HD   ARG 125           HD1      ARG 125  -7.910   2.396 -14.168
 1037    HE   ARG 125           HE       ARG 125  -6.498   4.579 -13.194
 1038   1HH1  ARG 125          HH21      ARG 125  -5.735   1.750 -15.088
 1039   2HH1  ARG 125          HH22      ARG 125  -4.445   2.536 -15.926
 1040   1HH2  ARG 125          HH11      ARG 125  -4.823   5.564 -14.303
 1041   2HH2  ARG 125          HH12      ARG 125  -3.930   4.673 -15.490
 1042    H    GLU 126           HN       GLU 126  -9.264  -0.474 -10.261
 1043    HA   GLU 126           HA       GLU 126 -11.869   0.320 -11.395
 1044   1HB   GLU 126           HB2      GLU 126 -10.044  -1.703 -11.939
 1045   2HB   GLU 126           HB1      GLU 126 -11.389  -2.540 -11.165
 1046   1HG   GLU 126           HG2      GLU 126 -12.880  -1.989 -12.840
 1047   2HG   GLU 126           HG1      GLU 126 -12.044  -0.487 -13.234
 1048    H    LYS 127           HN       LYS 127 -10.706  -1.569  -8.594
 1049    HA   LYS 127           HA       LYS 127 -13.487  -2.212  -7.893
 1050   1HB   LYS 127           HB2      LYS 127 -10.876  -3.284  -7.264
 1051   2HB   LYS 127           HB1      LYS 127 -11.850  -3.096  -5.807
 1052   1HG   LYS 127           HG2      LYS 127 -12.751  -5.092  -6.420
 1053   2HG   LYS 127           HG1      LYS 127 -13.677  -4.139  -7.580
 1054   1HD   LYS 127           HD2      LYS 127 -12.187  -4.625  -9.350
 1055   2HD   LYS 127           HD1      LYS 127 -10.914  -5.148  -8.248
 1056   1HE   LYS 127           HE2      LYS 127 -12.171  -7.136  -7.649
 1057   2HE   LYS 127           HE1      LYS 127 -13.561  -6.585  -8.585
 1058   1HZ   LYS 127           HZ2      LYS 127 -11.277  -6.555 -10.221
 1059   2HZ   LYS 127           HZ1      LYS 127 -11.386  -8.077  -9.474
 1060   3HZ   LYS 127           HZ3      LYS 127 -12.687  -7.488 -10.389
 1061    OH   TYR 128           OH       TYR 128 -12.038   7.331  -6.877
 1062    H    TYR 128           HN       TYR 128 -11.355   0.385  -6.967
 1063    HA   TYR 128           HA       TYR 128 -12.552   0.593  -4.295
 1064   1HB   TYR 128           HB2      TYR 128 -10.944   2.102  -3.868
 1065   2HB   TYR 128           HB1      TYR 128 -10.260   1.628  -5.412
 1066    HD1  TYR 128           HD2      TYR 128 -11.455   2.862  -7.531
 1067    HD2  TYR 128           HD1      TYR 128 -11.332   4.350  -3.500
 1068    HE1  TYR 128           HE2      TYR 128 -11.849   5.159  -8.369
 1069    HE2  TYR 128           HE1      TYR 128 -11.733   6.648  -4.342
 1070    HH   TYR 128           HH       TYR 128 -11.908   7.940  -6.147
 1071    H    SER 129           HN       SER 129 -13.902   1.133  -7.262
 1072    HA   SER 129           HA       SER 129 -15.292   3.631  -6.528
 1073   1HB   SER 129           HB2      SER 129 -16.136   2.057  -8.904
 1074   2HB   SER 129           HB1      SER 129 -15.878   3.792  -8.738
 1075    HG   SER 129           HG       SER 129 -13.598   3.277  -8.620
 1076    H    LYS 130           HN       LYS 130 -15.706   0.896  -5.119
 1077    HA   LYS 130           HA       LYS 130 -18.645   0.685  -5.606
 1078   1HB   LYS 130           HB2      LYS 130 -16.604  -1.293  -5.314
 1079   2HB   LYS 130           HB1      LYS 130 -17.687  -1.421  -3.927
 1080   1HG   LYS 130           HG2      LYS 130 -19.606  -1.289  -5.645
 1081   2HG   LYS 130           HG1      LYS 130 -18.372  -1.624  -6.860
 1082   1HD   LYS 130           HD2      LYS 130 -17.710  -3.646  -5.484
 1083   2HD   LYS 130           HD1      LYS 130 -19.145  -3.358  -4.501
 1084   1HE   LYS 130           HE2      LYS 130 -20.257  -3.256  -6.963
 1085   2HE   LYS 130           HE1      LYS 130 -18.931  -4.373  -7.283
 1086   1HZ   LYS 130           HZ3      LYS 130 -20.513  -4.793  -4.861
 1087   2HZ   LYS 130           HZ2      LYS 130 -21.234  -5.192  -6.348
 1088   3HZ   LYS 130           HZ1      LYS 130 -19.775  -5.928  -5.883
 1089    H    CYS 131           HN       CYS 131 -17.206   2.695  -3.890
 1090    HA   CYS 131           HA       CYS 131 -18.049   1.860  -1.170
 1091   1HB   CYS 131           HB2      CYS 131 -15.904   2.922  -1.201
 1092   2HB   CYS 131           HB1      CYS 131 -16.492   4.235  -2.220
 1093    H    SER 132           HN       SER 132 -18.931   4.057  -3.766
 1094    HA   SER 132           HA       SER 132 -21.180   5.062  -2.071
 1095   1HB   SER 132           HB2      SER 132 -21.263   6.842  -3.981
 1096   2HB   SER 132           HB1      SER 132 -19.997   6.967  -2.763
 1097    HG   SER 132           HG       SER 132 -19.733   5.619  -5.249
 1098    H    SER 133           HN       SER 133 -22.855   3.655  -2.493
 1099    HA   SER 133           HA       SER 133 -24.150   3.747  -5.059
 1100   1HB   SER 133           HB2      SER 133 -22.072   2.027  -5.167
 1101   2HB   SER 133           HB1      SER 133 -23.301   0.949  -4.513
 1102    HG   SER 133           HG       SER 133 -23.772   0.813  -6.584
   
  Start of MODEL           4
 Raw file had 1102 H/Q atoms
  Start of MODEL    4
    1   1H    GLU   1           HT3      GLU   1 -23.706  20.656   7.206
    2   2H    GLU   1           HT2      GLU   1 -24.093  21.597   5.845
    3   3H    GLU   1           HT1      GLU   1 -25.324  21.043   6.877
    4    HA   GLU   1           HA       GLU   1 -25.580  19.371   5.447
    5   1HB   GLU   1           HB2      GLU   1 -24.324  19.208   3.525
    6   2HB   GLU   1           HB1      GLU   1 -23.800  20.812   4.038
    7   1HG   GLU   1           HG2      GLU   1 -21.937  19.626   5.339
    8   2HG   GLU   1           HG1      GLU   1 -22.368  18.179   4.425
    9    H    ALA   2           HN       ALA   2 -25.215  17.112   5.602
   10    HA   ALA   2           HA       ALA   2 -23.020  16.318   7.477
   11   1HB   ALA   2           HB1      ALA   2 -25.842  16.045   7.793
   12   2HB   ALA   2           HB3      ALA   2 -25.174  14.431   7.551
   13   3HB   ALA   2           HB2      ALA   2 -24.569  15.449   8.859
   14    H    GLU   3           HN       GLU   3 -21.554  15.396   6.075
   15    HA   GLU   3           HA       GLU   3 -22.152  14.054   3.651
   16   1HB   GLU   3           HB2      GLU   3 -19.816  13.900   5.555
   17   2HB   GLU   3           HB1      GLU   3 -19.872  12.919   4.090
   18   1HG   GLU   3           HG2      GLU   3 -19.255  14.680   2.837
   19   2HG   GLU   3           HG1      GLU   3 -20.606  15.630   3.454
   20    H    ALA   4           HN       ALA   4 -22.554  11.886   3.161
   21    HA   ALA   4           HA       ALA   4 -22.974  10.081   5.511
   22   1HB   ALA   4           HB3      ALA   4 -25.011  11.037   4.078
   23   2HB   ALA   4           HB2      ALA   4 -24.574   9.697   3.019
   24   3HB   ALA   4           HB1      ALA   4 -25.016   9.385   4.698
   25    H    HIS   5           HN       HIS   5 -21.328  10.492   2.527
   26    HA   HIS   5           HA       HIS   5 -20.816   7.549   2.406
   27   1HB   HIS   5           HB2      HIS   5 -21.150   9.631   0.293
   28   2HB   HIS   5           HB1      HIS   5 -19.974   8.352  -0.008
   29    HD1  HIS   5           HD1      HIS   5 -23.440   8.293   1.603
   30    HD2  HIS   5           HD2      HIS   5 -21.303   6.400  -1.434
   31    HE1  HIS   5           HE1      HIS   5 -24.970   6.512   0.653
   32    H    LYS   6           HN       LYS   6 -18.931   7.259   3.525
   33    HA   LYS   6           HA       LYS   6 -16.776   9.270   3.343
   34   1HB   LYS   6           HB2      LYS   6 -17.619   7.603   5.364
   35   2HB   LYS   6           HB1      LYS   6 -16.211   6.742   4.748
   36   1HG   LYS   6           HG2      LYS   6 -14.942   8.157   5.960
   37   2HG   LYS   6           HG1      LYS   6 -15.412   9.421   4.823
   38   1HD   LYS   6           HD2      LYS   6 -16.120  10.372   6.818
   39   2HD   LYS   6           HD1      LYS   6 -17.586   9.520   6.332
   40   1HE   LYS   6           HE2      LYS   6 -17.391   8.749   8.505
   41   2HE   LYS   6           HE1      LYS   6 -16.444   7.519   7.667
   42   1HZ   LYS   6           HZ2      LYS   6 -14.717   9.615   8.156
   43   2HZ   LYS   6           HZ1      LYS   6 -15.600   9.416   9.594
   44   3HZ   LYS   6           HZ3      LYS   6 -14.745   8.106   8.937
   45    H    CYS   7           HN       CYS   7 -17.146   8.247   0.853
   46    HA   CYS   7           HA       CYS   7 -14.828   6.385   0.554
   47   1HB   CYS   7           HB2      CYS   7 -16.667   5.018   0.011
   48   2HB   CYS   7           HB1      CYS   7 -17.520   6.334  -0.798
   49    H    ASP   8           HN       ASP   8 -16.722   9.010  -0.902
   50    HA   ASP   8           HA       ASP   8 -15.016   9.333  -3.201
   51   1HB   ASP   8           HB2      ASP   8 -17.346  10.173  -3.099
   52   2HB   ASP   8           HB1      ASP   8 -16.857  11.342  -1.872
   53    H    ILE   9           HN       ILE   9 -14.801  10.479   0.104
   54    HA   ILE   9           HA       ILE   9 -12.803  12.516  -0.652
   55    HB   ILE   9           HB       ILE   9 -14.077  11.730   1.969
   56   1HG1  ILE   9          HG12      ILE   9 -14.043  14.391   0.526
   57   2HG1  ILE   9          HG11      ILE   9 -15.271  13.164   0.209
   58   1HG2  ILE   9          HG22      ILE   9 -11.771  13.601   1.399
   59   2HG2  ILE   9          HG21      ILE   9 -12.794  13.785   2.824
   60   3HG2  ILE   9          HG23      ILE   9 -11.855  12.309   2.596
   61   1HD1  ILE   9          HD13      ILE   9 -15.404  13.195   2.892
   62   2HD1  ILE   9          HD12      ILE   9 -14.854  14.850   2.630
   63   3HD1  ILE   9          HD11      ILE   9 -16.357  14.293   1.894
   64    H    THR  10           HN       THR  10 -12.699  10.136   2.000
   65    HA   THR  10           HA       THR  10  -9.833  10.064   2.007
   66    HB   THR  10           HB       THR  10 -11.731   8.037   3.206
   67    HG1  THR  10           HG1      THR  10 -12.061   9.437   4.767
   68   1HG2  THR  10          HG22      THR  10  -8.903   8.209   3.114
   69   2HG2  THR  10          HG21      THR  10  -9.384   8.671   4.747
   70   3HG2  THR  10          HG23      THR  10  -9.881   7.112   4.089
   71    H    LEU  11           HN       LEU  11 -12.219   7.781   0.634
   72    HA   LEU  11           HA       LEU  11 -10.182   5.849  -0.065
   73   1HB   LEU  11           HB2      LEU  11 -13.029   6.002  -0.139
   74   2HB   LEU  11           HB1      LEU  11 -12.470   5.545  -1.745
   75    HG   LEU  11           HG       LEU  11 -11.225   3.668  -0.848
   76   1HD1  LEU  11          HD12      LEU  11 -11.860   4.983   1.781
   77   2HD1  LEU  11          HD11      LEU  11 -11.627   3.235   1.722
   78   3HD1  LEU  11          HD13      LEU  11 -10.330   4.315   1.210
   79   1HD2  LEU  11          HD22      LEU  11 -14.015   3.908   0.309
   80   2HD2  LEU  11          HD21      LEU  11 -13.560   3.190  -1.236
   81   3HD2  LEU  11          HD23      LEU  11 -13.100   2.401   0.273
   82    H    GLN  12           HN       GLN  12 -11.695   8.528  -1.862
   83    HA   GLN  12           HA       GLN  12 -10.527   7.735  -4.390
   84   1HB   GLN  12           HB2      GLN  12 -11.722   9.462  -5.225
   85   2HB   GLN  12           HB1      GLN  12 -12.383   9.639  -3.603
   86   1HG   GLN  12           HG2      GLN  12 -10.547  11.219  -3.045
   87   2HG   GLN  12           HG1      GLN  12  -9.938  11.073  -4.696
   88   1HE2  GLN  12          HE22      GLN  12 -13.053  12.647  -5.990
   89   2HE2  GLN  12          HE21      GLN  12 -12.257  11.167  -6.230
   90    H    GLU  13           HN       GLU  13  -9.489   9.890  -1.769
   91    HA   GLU  13           HA       GLU  13  -7.131  10.825  -3.156
   92   1HB   GLU  13           HB2      GLU  13  -8.252  11.002  -0.432
   93   2HB   GLU  13           HB1      GLU  13  -6.489  11.014  -0.494
   94   1HG   GLU  13           HG2      GLU  13  -6.721  12.778  -2.343
   95   2HG   GLU  13           HG1      GLU  13  -8.411  12.908  -1.854
   96    H    ILE  14           HN       ILE  14  -7.883   8.049  -1.133
   97    HA   ILE  14           HA       ILE  14  -5.142   7.172  -0.811
   98    HB   ILE  14           HB       ILE  14  -7.789   6.272  -0.032
   99   1HG1  ILE  14          HG12      ILE  14  -5.072   5.383   0.956
  100   2HG1  ILE  14          HG11      ILE  14  -5.787   6.936   1.388
  101   1HG2  ILE  14          HG21      ILE  14  -5.842   4.167  -1.036
  102   2HG2  ILE  14          HG23      ILE  14  -7.245   3.832  -0.024
  103   3HG2  ILE  14          HG22      ILE  14  -7.470   4.469  -1.651
  104   1HD1  ILE  14          HD11      ILE  14  -7.825   5.652   2.187
  105   2HD1  ILE  14          HD13      ILE  14  -6.877   4.178   1.987
  106   3HD1  ILE  14          HD12      ILE  14  -6.364   5.407   3.140
  107    H    ILE  15           HN       ILE  15  -7.564   6.836  -3.305
  108    HA   ILE  15           HA       ILE  15  -6.366   4.556  -4.619
  109    HB   ILE  15           HB       ILE  15  -8.316   6.695  -5.490
  110   1HG1  ILE  15          HG12      ILE  15  -8.839   3.747  -5.434
  111   2HG1  ILE  15          HG11      ILE  15  -8.761   4.610  -3.897
  112   1HG2  ILE  15          HG22      ILE  15  -6.939   4.560  -7.089
  113   2HG2  ILE  15          HG21      ILE  15  -8.610   4.981  -7.465
  114   3HG2  ILE  15          HG23      ILE  15  -7.349   6.210  -7.555
  115   1HD1  ILE  15          HD11      ILE  15 -10.308   6.209  -5.659
  116   2HD1  ILE  15          HD13      ILE  15 -10.905   4.556  -5.808
  117   3HD1  ILE  15          HD12      ILE  15 -10.861   5.338  -4.227
  118    H    LYS  16           HN       LYS  16  -6.153   8.085  -5.081
  119    HA   LYS  16           HA       LYS  16  -4.422   8.002  -7.357
  120   1HB   LYS  16           HB2      LYS  16  -4.731  10.093  -5.185
  121   2HB   LYS  16           HB1      LYS  16  -3.811  10.336  -6.671
  122   1HG   LYS  16           HG2      LYS  16  -5.823   9.932  -8.012
  123   2HG   LYS  16           HG1      LYS  16  -6.756   9.622  -6.547
  124   1HD   LYS  16           HD2      LYS  16  -5.546  12.073  -6.041
  125   2HD   LYS  16           HD1      LYS  16  -5.983  12.172  -7.746
  126   1HE   LYS  16           HE2      LYS  16  -8.290  11.610  -7.245
  127   2HE   LYS  16           HE1      LYS  16  -7.890  11.317  -5.552
  128   1HZ   LYS  16           HZ2      LYS  16  -6.937  13.812  -5.996
  129   2HZ   LYS  16           HZ1      LYS  16  -8.365  13.797  -6.917
  130   3HZ   LYS  16           HZ3      LYS  16  -8.424  13.445  -5.259
  131    H    THR  17           HN       THR  17  -3.590   8.640  -3.939
  132    HA   THR  17           HA       THR  17  -0.786   8.564  -4.237
  133    HB   THR  17           HB       THR  17  -2.366   7.556  -1.855
  134    HG1  THR  17           HG1      THR  17  -1.753   9.892  -1.285
  135   1HG2  THR  17          HG22      THR  17   0.360   7.525  -2.323
  136   2HG2  THR  17          HG21      THR  17   0.130   9.026  -1.428
  137   3HG2  THR  17          HG23      THR  17  -0.404   7.495  -0.735
  138    H    LEU  18           HN       LEU  18  -3.104   5.933  -3.924
  139    HA   LEU  18           HA       LEU  18  -1.353   3.794  -3.373
  140   1HB   LEU  18           HB2      LEU  18  -3.806   3.559  -3.402
  141   2HB   LEU  18           HB1      LEU  18  -3.823   3.821  -5.141
  142    HG   LEU  18           HG       LEU  18  -3.900   1.370  -4.175
  143   1HD1  LEU  18          HD13      LEU  18  -3.356   2.425  -6.606
  144   2HD1  LEU  18          HD12      LEU  18  -1.837   1.584  -6.295
  145   3HD1  LEU  18          HD11      LEU  18  -3.357   0.692  -6.283
  146   1HD2  LEU  18          HD21      LEU  18  -1.729   1.894  -2.843
  147   2HD2  LEU  18          HD23      LEU  18  -1.821   0.356  -3.700
  148   3HD2  LEU  18          HD22      LEU  18  -0.907   1.695  -4.390
  149    H    ASN  19           HN       ASN  19  -2.494   4.846  -6.612
  150    HA   ASN  19           HA       ASN  19  -0.655   3.200  -8.056
  151   1HB   ASN  19           HB2      ASN  19  -2.738   4.435  -8.935
  152   2HB   ASN  19           HB1      ASN  19  -1.691   5.850  -9.064
  153   1HD2  ASN  19          HD22      ASN  19  -0.771   4.687 -12.271
  154   2HD2  ASN  19          HD21      ASN  19  -1.470   5.936 -11.358
  155    H    SER  20           HN       SER  20  -0.215   6.252  -6.425
  156    HA   SER  20           HA       SER  20   2.067   7.168  -7.907
  157   1HB   SER  20           HB2      SER  20   0.676   8.503  -6.235
  158   2HB   SER  20           HB1      SER  20   1.562   7.662  -4.967
  159    HG   SER  20           HG       SER  20   2.955   8.889  -7.075
  160    H    LEU  21           HN       LEU  21   1.728   5.032  -5.088
  161    HA   LEU  21           HA       LEU  21   4.521   4.829  -4.502
  162   1HB   LEU  21           HB2      LEU  21   2.092   3.211  -3.859
  163   2HB   LEU  21           HB1      LEU  21   3.671   2.464  -3.608
  164    HG   LEU  21           HG       LEU  21   3.483   5.237  -2.633
  165   1HD1  LEU  21          HD13      LEU  21   1.407   3.316  -1.962
  166   2HD1  LEU  21          HD12      LEU  21   2.330   3.782  -0.534
  167   3HD1  LEU  21          HD11      LEU  21   1.539   5.017  -1.514
  168   1HD2  LEU  21          HD22      LEU  21   5.090   2.994  -2.258
  169   2HD2  LEU  21          HD21      LEU  21   5.140   4.472  -1.295
  170   3HD2  LEU  21          HD23      LEU  21   4.170   3.100  -0.757
  171    H    THR  22           HN       THR  22   2.712   3.589  -7.163
  172    HA   THR  22           HA       THR  22   4.616   1.388  -7.662
  173    HB   THR  22           HB       THR  22   3.097   0.602  -9.221
  174    HG1  THR  22           HG1      THR  22   1.563   2.698  -9.801
  175   1HG2  THR  22          HG22      THR  22   2.016   1.128  -6.915
  176   2HG2  THR  22          HG21      THR  22   1.169   2.410  -7.781
  177   3HG2  THR  22          HG23      THR  22   0.954   0.727  -8.266
  178    H    GLU  23           HN       GLU  23   5.390   4.358  -7.795
  179    HA   GLU  23           HA       GLU  23   6.000   4.703 -10.656
  180   1HB   GLU  23           HB2      GLU  23   5.405   6.583  -8.941
  181   2HB   GLU  23           HB1      GLU  23   7.093   6.439  -8.448
  182   1HG   GLU  23           HG2      GLU  23   6.329   6.758 -11.350
  183   2HG   GLU  23           HG1      GLU  23   6.545   8.158 -10.299
  184    H    GLN  24           HN       GLN  24   7.626   3.839  -7.654
  185    HA   GLN  24           HA       GLN  24  10.149   3.393  -9.203
  186   1HB   GLN  24           HB2      GLN  24  10.317   4.957  -7.266
  187   2HB   GLN  24           HB1      GLN  24   9.781   3.654  -6.204
  188   1HG   GLN  24           HG2      GLN  24  11.871   2.827  -6.101
  189   2HG   GLN  24           HG1      GLN  24  11.937   2.706  -7.860
  190   1HE2  GLN  24          HE22      GLN  24  14.463   5.231  -6.441
  191   2HE2  GLN  24          HE21      GLN  24  14.050   3.678  -5.893
  192    H    LYS  25           HN       LYS  25   8.502   1.468  -9.744
  193    HA   LYS  25           HA       LYS  25   8.633  -0.668  -7.714
  194   1HB   LYS  25           HB2      LYS  25   7.277  -1.953  -9.393
  195   2HB   LYS  25           HB1      LYS  25   6.527  -0.437  -8.894
  196   1HG   LYS  25           HG2      LYS  25   6.687   0.456 -10.970
  197   2HG   LYS  25           HG1      LYS  25   8.332  -0.138 -11.190
  198   1HD   LYS  25           HD2      LYS  25   7.468  -2.383 -11.707
  199   2HD   LYS  25           HD1      LYS  25   5.817  -1.812 -11.459
  200   1HE   LYS  25           HE2      LYS  25   7.742  -0.724 -13.533
  201   2HE   LYS  25           HE1      LYS  25   6.420  -1.845 -13.865
  202   1HZ   LYS  25           HZ2      LYS  25   5.077   0.017 -12.596
  203   2HZ   LYS  25           HZ1      LYS  25   6.329   0.997 -13.195
  204   3HZ   LYS  25           HZ3      LYS  25   5.366   0.105 -14.269
  205    H    THR  26           HN       THR  26  11.139  -0.486  -8.085
  206    HA   THR  26           HA       THR  26  11.904  -2.787  -9.712
  207    HB   THR  26           HB       THR  26  13.473  -0.361 -10.428
  208    HG1  THR  26           HG1      THR  26  11.130  -0.928 -11.859
  209   1HG2  THR  26          HG21      THR  26  13.269  -3.040 -11.245
  210   2HG2  THR  26          HG23      THR  26  12.587  -2.096 -12.570
  211   3HG2  THR  26          HG22      THR  26  14.226  -1.769 -12.009
  212    H    LEU  27           HN       LEU  27  13.122   0.093  -7.986
  213    HA   LEU  27           HA       LEU  27  15.455  -1.451  -7.040
  214   1HB   LEU  27           HB2      LEU  27  14.759   1.359  -7.338
  215   2HB   LEU  27           HB1      LEU  27  15.413   1.027  -5.734
  216    HG   LEU  27           HG       LEU  27  17.135  -0.412  -7.277
  217   1HD1  LEU  27          HD11      LEU  27  15.710   1.169  -9.123
  218   2HD1  LEU  27          HD13      LEU  27  17.269   1.968  -8.921
  219   3HD1  LEU  27          HD12      LEU  27  17.203   0.279  -9.420
  220   1HD2  LEU  27          HD21      LEU  27  17.340   1.617  -5.540
  221   2HD2  LEU  27          HD23      LEU  27  18.695   1.131  -6.559
  222   3HD2  LEU  27          HD22      LEU  27  17.697   2.511  -7.018
  223    H    CYS  28           HN       CYS  28  12.567   0.138  -5.699
  224    HA   CYS  28           HA       CYS  28  13.186  -0.909  -3.019
  225   1HB   CYS  28           HB2      CYS  28  11.570   1.201  -4.061
  226   2HB   CYS  28           HB1      CYS  28  10.517   0.103  -3.165
  227    H    THR  29           HN       THR  29  11.559  -2.054  -5.817
  228    HA   THR  29           HA       THR  29   9.756  -3.797  -4.262
  229    HB   THR  29           HB       THR  29   9.137  -4.655  -6.577
  230    HG1  THR  29           HG1      THR  29  10.465  -4.094  -8.084
  231   1HG2  THR  29          HG23      THR  29   8.906  -1.693  -5.981
  232   2HG2  THR  29          HG22      THR  29   7.932  -2.553  -7.174
  233   3HG2  THR  29          HG21      THR  29   7.792  -2.957  -5.463
  234    H    GLU  30           HN       GLU  30  12.950  -3.923  -4.627
  235    HA   GLU  30           HA       GLU  30  13.166  -6.726  -5.543
  236   1HB   GLU  30           HB2      GLU  30  15.003  -4.449  -5.153
  237   2HB   GLU  30           HB1      GLU  30  15.668  -5.998  -4.642
  238   1HG   GLU  30           HG2      GLU  30  14.485  -6.667  -7.027
  239   2HG   GLU  30           HG1      GLU  30  15.049  -5.028  -7.351
  240    H    LEU  31           HN       LEU  31  11.606  -6.823  -3.433
  241    HA   LEU  31           HA       LEU  31  13.153  -8.273  -1.455
  242   1HB   LEU  31           HB2      LEU  31  12.142  -6.801   0.442
  243   2HB   LEU  31           HB1      LEU  31  13.590  -6.226  -0.379
  244    HG   LEU  31           HG       LEU  31  11.187  -5.372  -1.782
  245   1HD1  LEU  31          HD12      LEU  31  10.203  -5.498   0.486
  246   2HD1  LEU  31          HD11      LEU  31  11.512  -4.487   1.098
  247   3HD1  LEU  31          HD13      LEU  31  10.358  -3.828  -0.062
  248   1HD2  LEU  31          HD21      LEU  31  13.758  -4.302  -0.780
  249   2HD2  LEU  31          HD23      LEU  31  12.934  -4.000  -2.309
  250   3HD2  LEU  31          HD22      LEU  31  12.447  -3.127  -0.857
  251    H    THR  32           HN       THR  32  11.800  -9.989  -1.776
  252    HA   THR  32           HA       THR  32   9.092 -10.078  -2.316
  253    HB   THR  32           HB       THR  32   9.094 -12.314  -1.187
  254    HG1  THR  32           HG1      THR  32  10.450 -12.004   0.505
  255   1HG2  THR  32          HG22      THR  32  10.677 -11.352  -3.370
  256   2HG2  THR  32          HG21      THR  32  11.583 -12.623  -2.546
  257   3HG2  THR  32          HG23      THR  32   9.964 -12.952  -3.161
  258    H    VAL  33           HN       VAL  33   7.179 -10.184  -1.106
  259    HA   VAL  33           HA       VAL  33   7.335  -9.550   1.790
  260    HB   VAL  33           HB       VAL  33   6.046  -7.588   1.634
  261   1HG1  VAL  33          HG12      VAL  33   8.398  -7.438   0.622
  262   2HG1  VAL  33          HG11      VAL  33   7.606  -7.453  -0.955
  263   3HG1  VAL  33          HG13      VAL  33   7.278  -6.148   0.186
  264   1HG2  VAL  33          HG22      VAL  33   5.293  -8.671  -1.080
  265   2HG2  VAL  33          HG21      VAL  33   4.236  -8.222   0.258
  266   3HG2  VAL  33          HG23      VAL  33   5.043  -6.970  -0.687
  267    H    THR  34           HN       THR  34   5.038  -9.699   2.737
  268    HA   THR  34           HA       THR  34   3.911 -12.219   2.115
  269    HB   THR  34           HB       THR  34   3.123  -9.878   3.759
  270    HG1  THR  34           HG1      THR  34   4.189 -11.902   4.405
  271   1HG2  THR  34          HG23      THR  34   1.098 -11.833   2.657
  272   2HG2  THR  34          HG22      THR  34   0.841 -10.936   4.151
  273   3HG2  THR  34          HG21      THR  34   1.031 -10.071   2.628
  274    H    ASP  35           HN       ASP  35   2.217 -12.865   0.834
  275    HA   ASP  35           HA       ASP  35   1.169 -10.833  -1.083
  276   1HB   ASP  35           HB2      ASP  35   1.389 -12.392  -2.705
  277   2HB   ASP  35           HB1      ASP  35   2.295 -13.359  -1.541
  278    H    ILE  36           HN       ILE  36  -0.991 -10.356  -0.948
  279    HA   ILE  36           HA       ILE  36  -2.611 -12.068   0.885
  280    HB   ILE  36           HB       ILE  36  -3.644 -10.165   1.726
  281   1HG1  ILE  36          HG12      ILE  36  -2.859  -8.827  -0.882
  282   2HG1  ILE  36          HG11      ILE  36  -4.488  -9.179  -0.307
  283   1HG2  ILE  36          HG22      ILE  36  -0.960 -10.213   1.790
  284   2HG2  ILE  36          HG21      ILE  36  -1.178  -8.690   0.927
  285   3HG2  ILE  36          HG23      ILE  36  -1.890  -8.909   2.527
  286   1HD1  ILE  36          HD13      ILE  36  -3.458  -7.687   1.764
  287   2HD1  ILE  36          HD12      ILE  36  -2.725  -6.924   0.353
  288   3HD1  ILE  36          HD11      ILE  36  -4.480  -7.053   0.474
  289    H    PHE  37           HN       PHE  37  -2.202 -12.123  -2.189
  290    HA   PHE  37           HA       PHE  37  -5.117 -12.031  -2.858
  291   1HB   PHE  37           HB2      PHE  37  -2.733 -11.522  -4.666
  292   2HB   PHE  37           HB1      PHE  37  -4.407 -11.612  -5.213
  293    HD1  PHE  37           HD2      PHE  37  -6.096  -9.959  -4.313
  294    HD2  PHE  37           HD1      PHE  37  -1.872  -9.550  -3.643
  295    HE1  PHE  37           HE2      PHE  37  -6.422  -7.577  -3.710
  296    HE2  PHE  37           HE1      PHE  37  -2.200  -7.166  -3.041
  297    HZ   PHE  37           HZ       PHE  37  -4.475  -6.181  -3.075
  298    H    ALA  38           HN       ALA  38  -3.504 -14.252  -1.730
  299    HA   ALA  38           HA       ALA  38  -3.462 -16.137  -4.037
  300   1HB   ALA  38           HB1      ALA  38  -1.414 -15.998  -2.623
  301   2HB   ALA  38           HB3      ALA  38  -2.371 -16.508  -1.233
  302   3HB   ALA  38           HB2      ALA  38  -2.141 -17.604  -2.595
  303    H    ALA  39           HN       ALA  39  -4.302 -16.358  -0.569
  304    HA   ALA  39           HA       ALA  39  -6.732 -17.895  -1.398
  305   1HB   ALA  39           HB2      ALA  39  -4.827 -19.219  -0.277
  306   2HB   ALA  39           HB1      ALA  39  -5.246 -18.341   1.194
  307   3HB   ALA  39           HB3      ALA  39  -6.437 -19.389   0.423
  308    H    SER  40           HN       SER  40  -7.974 -15.919  -1.269
  309    HA   SER  40           HA       SER  40  -9.187 -15.442   1.270
  310   1HB   SER  40           HB2      SER  40  -6.864 -13.728   0.553
  311   2HB   SER  40           HB1      SER  40  -8.283 -12.900   1.187
  312    HG   SER  40           HG       SER  40  -8.195 -14.601   2.881
  313    H    LYS  41           HN       LYS  41 -10.670 -15.902  -0.707
  314    HA   LYS  41           HA       LYS  41 -11.268 -13.405  -2.215
  315   1HB   LYS  41           HB2      LYS  41 -12.650 -16.043  -2.657
  316   2HB   LYS  41           HB1      LYS  41 -12.349 -14.743  -3.811
  317   1HG   LYS  41           HG2      LYS  41  -9.896 -15.233  -3.643
  318   2HG   LYS  41           HG1      LYS  41 -10.285 -16.620  -2.623
  319   1HD   LYS  41           HD2      LYS  41 -11.141 -17.842  -4.370
  320   2HD   LYS  41           HD1      LYS  41 -11.738 -16.413  -5.215
  321   1HE   LYS  41           HE2      LYS  41  -9.904 -17.268  -6.513
  322   2HE   LYS  41           HE1      LYS  41  -9.318 -15.819  -5.697
  323   1HZ   LYS  41           HZ2      LYS  41  -8.758 -17.670  -3.877
  324   2HZ   LYS  41           HZ1      LYS  41  -8.590 -18.597  -5.289
  325   3HZ   LYS  41           HZ3      LYS  41  -7.665 -17.192  -5.085
  326    H    ASP  42           HN       ASP  42 -11.931 -13.604   0.611
  327    HA   ASP  42           HA       ASP  42 -14.832 -13.096   0.374
  328   1HB   ASP  42           HB2      ASP  42 -14.182 -15.590   1.112
  329   2HB   ASP  42           HB1      ASP  42 -14.026 -14.805   2.685
  330    H    THR  43           HN       THR  43 -12.818 -11.221   0.759
  331    HA   THR  43           HA       THR  43 -13.154 -10.528   3.652
  332    HB   THR  43           HB       THR  43 -11.019  -9.199   3.347
  333    HG1  THR  43           HG1      THR  43 -11.267  -9.303   0.982
  334   1HG2  THR  43          HG23      THR  43 -11.366 -12.094   3.492
  335   2HG2  THR  43          HG22      THR  43  -9.784 -11.641   2.861
  336   3HG2  THR  43          HG21      THR  43 -10.309 -11.043   4.434
  337    H    THR  44           HN       THR  44 -13.668  -8.332   4.106
  338    HA   THR  44           HA       THR  44 -14.999  -6.944   1.879
  339    HB   THR  44           HB       THR  44 -14.873  -5.470   4.397
  340    HG1  THR  44           HG1      THR  44 -16.312  -7.852   4.582
  341   1HG2  THR  44          HG22      THR  44 -16.515  -5.316   2.421
  342   2HG2  THR  44          HG21      THR  44 -17.260  -6.769   3.087
  343   3HG2  THR  44          HG23      THR  44 -17.209  -5.286   4.042
  344    H    GLU  45           HN       GLU  45 -14.616  -4.279   2.393
  345    HA   GLU  45           HA       GLU  45 -11.893  -3.918   1.407
  346   1HB   GLU  45           HB2      GLU  45 -12.502  -1.469   1.419
  347   2HB   GLU  45           HB1      GLU  45 -13.582  -2.480   0.462
  348   1HG   GLU  45           HG2      GLU  45 -14.575  -2.444   3.140
  349   2HG   GLU  45           HG1      GLU  45 -14.242  -0.781   2.666
  350    H    LYS  46           HN       LYS  46 -13.559  -3.428   4.492
  351    HA   LYS  46           HA       LYS  46 -11.342  -1.925   5.629
  352   1HB   LYS  46           HB2      LYS  46 -12.537  -2.062   7.711
  353   2HB   LYS  46           HB1      LYS  46 -13.731  -1.801   6.439
  354   1HG   LYS  46           HG2      LYS  46 -14.782  -3.581   7.402
  355   2HG   LYS  46           HG1      LYS  46 -13.622  -4.526   6.471
  356   1HD   LYS  46           HD2      LYS  46 -12.553  -5.218   8.336
  357   2HD   LYS  46           HD1      LYS  46 -12.492  -3.582   8.994
  358   1HE   LYS  46           HE2      LYS  46 -13.834  -4.958  10.481
  359   2HE   LYS  46           HE1      LYS  46 -14.900  -3.822   9.655
  360   1HZ   LYS  46           HZ3      LYS  46 -14.809  -5.964   7.983
  361   2HZ   LYS  46           HZ2      LYS  46 -14.831  -6.682   9.523
  362   3HZ   LYS  46           HZ1      LYS  46 -16.064  -5.605   9.065
  363    H    GLU  47           HN       GLU  47 -12.197  -5.315   5.349
  364    HA   GLU  47           HA       GLU  47 -10.272  -6.221   7.339
  365   1HB   GLU  47           HB2      GLU  47 -11.757  -7.650   5.115
  366   2HB   GLU  47           HB1      GLU  47 -10.682  -8.470   6.249
  367   1HG   GLU  47           HG2      GLU  47 -12.143  -7.228   8.062
  368   2HG   GLU  47           HG1      GLU  47 -13.332  -7.161   6.760
  369    H    THR  48           HN       THR  48 -10.355  -6.214   3.766
  370    HA   THR  48           HA       THR  48  -7.632  -7.140   3.492
  371    HB   THR  48           HB       THR  48  -8.980  -5.479   1.387
  372    HG1  THR  48           HG1      THR  48 -10.388  -7.064   0.955
  373   1HG2  THR  48          HG21      THR  48  -6.730  -7.159   1.543
  374   2HG2  THR  48          HG23      THR  48  -7.935  -8.069   0.633
  375   3HG2  THR  48          HG22      THR  48  -7.438  -6.469   0.082
  376    H    PHE  49           HN       PHE  49  -9.024  -4.032   4.182
  377    HA   PHE  49           HA       PHE  49  -6.804  -2.455   3.166
  378   1HB   PHE  49           HB2      PHE  49  -9.250  -1.969   4.800
  379   2HB   PHE  49           HB1      PHE  49  -7.930  -0.816   4.977
  380    HD1  PHE  49           HD1      PHE  49  -8.716  -2.733   1.890
  381    HD2  PHE  49           HD2      PHE  49  -8.910   1.075   3.866
  382    HE1  PHE  49           HE1      PHE  49  -9.411  -1.665  -0.235
  383    HE2  PHE  49           HE2      PHE  49  -9.596   2.144   1.737
  384    HZ   PHE  49           HZ       PHE  49  -9.854   0.770  -0.311
  385    H    CYS  50           HN       CYS  50  -7.727  -3.758   6.362
  386    HA   CYS  50           HA       CYS  50  -5.434  -2.570   7.705
  387   1HB   CYS  50           HB2      CYS  50  -7.439  -3.165   8.983
  388   2HB   CYS  50           HB1      CYS  50  -7.246  -4.860   8.534
  389    NH1  ARG  51           NH2      ARG  51  -6.906 -12.555   4.971
  390    NH2  ARG  51           NH1      ARG  51  -5.972 -13.637   6.721
  391    H    ARG  51           HN       ARG  51  -6.095  -5.675   6.141
  392    HA   ARG  51           HA       ARG  51  -3.765  -7.046   7.117
  393   1HB   ARG  51           HB2      ARG  51  -5.870  -7.524   5.176
  394   2HB   ARG  51           HB1      ARG  51  -4.307  -8.029   4.535
  395   1HG   ARG  51           HG2      ARG  51  -3.897  -9.324   6.618
  396   2HG   ARG  51           HG1      ARG  51  -5.501  -8.867   7.194
  397   1HD   ARG  51           HD2      ARG  51  -6.560 -10.014   5.337
  398   2HD   ARG  51           HD1      ARG  51  -4.995 -10.341   4.594
  399    HE   ARG  51           HE       ARG  51  -4.809 -11.512   7.103
  400   1HH1  ARG  51          HH21      ARG  51  -7.014 -11.738   4.407
  401   2HH1  ARG  51          HH22      ARG  51  -7.421 -13.382   4.747
  402   1HH2  ARG  51          HH11      ARG  51  -5.356 -13.647   7.508
  403   2HH2  ARG  51          HH12      ARG  51  -6.493 -14.457   6.483
  404    H    ALA  52           HN       ALA  52  -4.368  -5.392   4.001
  405    HA   ALA  52           HA       ALA  52  -1.680  -5.614   3.059
  406   1HB   ALA  52           HB2      ALA  52  -4.092  -4.066   2.329
  407   2HB   ALA  52           HB1      ALA  52  -2.561  -3.313   1.882
  408   3HB   ALA  52           HB3      ALA  52  -2.954  -4.929   1.295
  409    H    ALA  53           HN       ALA  53  -3.252  -3.389   5.272
  410    HA   ALA  53           HA       ALA  53  -1.203  -1.358   5.223
  411   1HB   ALA  53           HB3      ALA  53  -3.587  -1.990   6.829
  412   2HB   ALA  53           HB2      ALA  53  -2.289  -1.244   7.763
  413   3HB   ALA  53           HB1      ALA  53  -2.944  -0.421   6.346
  414    H    THR  54           HN       THR  54  -1.624  -4.393   6.959
  415    HA   THR  54           HA       THR  54   0.472  -3.998   8.886
  416    HB   THR  54           HB       THR  54  -0.941  -6.389   7.734
  417    HG1  THR  54           HG1      THR  54  -1.865  -5.300   9.462
  418   1HG2  THR  54          HG22      THR  54   1.614  -6.400   9.346
  419   2HG2  THR  54          HG21      THR  54   0.501  -7.768   9.338
  420   3HG2  THR  54          HG23      THR  54   1.274  -7.252   7.839
  421    H    VAL  55           HN       VAL  55   0.371  -5.430   5.632
  422    HA   VAL  55           HA       VAL  55   3.173  -6.089   5.538
  423    HB   VAL  55           HB       VAL  55   1.170  -5.522   3.329
  424   1HG1  VAL  55          HG11      VAL  55   3.983  -6.658   3.197
  425   2HG1  VAL  55          HG13      VAL  55   2.844  -6.628   1.852
  426   3HG1  VAL  55          HG12      VAL  55   3.452  -5.116   2.525
  427   1HG2  VAL  55          HG23      VAL  55   1.891  -7.849   4.986
  428   2HG2  VAL  55          HG22      VAL  55   0.436  -7.560   4.031
  429   3HG2  VAL  55          HG21      VAL  55   1.892  -8.186   3.256
  430    H    LEU  56           HN       LEU  56   1.346  -3.148   5.052
  431    HA   LEU  56           HA       LEU  56   3.491  -1.703   3.714
  432   1HB   LEU  56           HB2      LEU  56   0.955  -0.762   5.090
  433   2HB   LEU  56           HB1      LEU  56   2.050   0.293   4.198
  434    HG   LEU  56           HG       LEU  56   1.003  -2.183   2.867
  435   1HD1  LEU  56          HD13      LEU  56  -0.591   0.114   3.757
  436   2HD1  LEU  56          HD12      LEU  56  -0.683  -0.159   2.018
  437   3HD1  LEU  56          HD11      LEU  56  -1.123  -1.449   3.136
  438   1HD2  LEU  56          HD21      LEU  56   1.850   0.585   1.978
  439   2HD2  LEU  56          HD23      LEU  56   2.711  -0.929   1.707
  440   3HD2  LEU  56          HD22      LEU  56   1.177  -0.629   0.889
  441    NH1  ARG  57           NH2      ARG  57   2.072  -0.762  14.152
  442    NH2  ARG  57           NH1      ARG  57   3.869   0.452  14.779
  443    H    ARG  57           HN       ARG  57   2.640  -2.444   7.003
  444    HA   ARG  57           HA       ARG  57   4.069  -0.248   8.232
  445   1HB   ARG  57           HB2      ARG  57   2.412  -1.364   9.566
  446   2HB   ARG  57           HB1      ARG  57   3.123  -2.944   9.243
  447   1HG   ARG  57           HG2      ARG  57   4.916  -2.586  10.685
  448   2HG   ARG  57           HG1      ARG  57   4.797  -0.829  10.559
  449   1HD   ARG  57           HD2      ARG  57   2.379  -1.368  11.645
  450   2HD   ARG  57           HD1      ARG  57   3.308  -2.706  12.318
  451    HE   ARG  57           HE       ARG  57   4.905  -0.480  12.762
  452   1HH1  ARG  57          HH21      ARG  57   1.622  -1.393  13.522
  453   2HH1  ARG  57          HH22      ARG  57   1.578  -0.427  14.955
  454   1HH2  ARG  57          HH11      ARG  57   4.810   0.756  14.627
  455   2HH2  ARG  57          HH12      ARG  57   3.362   0.778  15.577
  456    H    GLN  58           HN       GLN  58   4.823  -3.685   7.608
  457    HA   GLN  58           HA       GLN  58   7.563  -3.418   8.545
  458   1HB   GLN  58           HB2      GLN  58   6.545  -5.606   8.622
  459   2HB   GLN  58           HB1      GLN  58   6.171  -5.551   6.899
  460   1HG   GLN  58           HG2      GLN  58   8.401  -5.851   6.269
  461   2HG   GLN  58           HG1      GLN  58   9.019  -5.251   7.809
  462   1HE2  GLN  58          HE22      GLN  58   9.408  -8.941   7.900
  463   2HE2  GLN  58          HE21      GLN  58  10.062  -7.664   6.995
  464    H    PHE  59           HN       PHE  59   5.933  -2.874   5.503
  465    HA   PHE  59           HA       PHE  59   8.256  -3.069   3.802
  466   1HB   PHE  59           HB2      PHE  59   6.013  -3.194   2.857
  467   2HB   PHE  59           HB1      PHE  59   5.632  -1.584   3.465
  468    HD1  PHE  59           HD1      PHE  59   8.842  -2.683   1.931
  469    HD2  PHE  59           HD2      PHE  59   5.237  -0.400   1.429
  470    HE1  PHE  59           HE1      PHE  59   9.759  -1.694  -0.149
  471    HE2  PHE  59           HE2      PHE  59   6.157   0.590  -0.650
  472    HZ   PHE  59           HZ       PHE  59   8.417  -0.057  -1.439
  473    OH   TYR  60           OH       TYR  60   5.937   3.778  10.698
  474    H    TYR  60           HN       TYR  60   6.606  -0.299   5.329
  475    HA   TYR  60           HA       TYR  60   8.778   1.505   4.476
  476   1HB   TYR  60           HB2      TYR  60   7.257   3.159   4.736
  477   2HB   TYR  60           HB1      TYR  60   6.072   1.858   4.872
  478    HD1  TYR  60           HD2      TYR  60   5.621   0.871   7.202
  479    HD2  TYR  60           HD1      TYR  60   7.702   4.576   6.572
  480    HE1  TYR  60           HE2      TYR  60   5.174   1.522   9.553
  481    HE2  TYR  60           HE1      TYR  60   7.255   5.226   8.924
  482    HH   TYR  60           HH       TYR  60   5.951   4.737  10.749
  483    H    SER  61           HN       SER  61   8.323  -0.578   7.095
  484    HA   SER  61           HA       SER  61   9.480   1.244   9.095
  485   1HB   SER  61           HB2      SER  61   8.480  -1.589   9.127
  486   2HB   SER  61           HB1      SER  61   9.497  -1.001  10.440
  487    HG   SER  61           HG       SER  61   7.980   0.762  10.623
  488    H    HIS  62           HN       HIS  62  10.477  -1.807   7.485
  489    HA   HIS  62           HA       HIS  62  13.212  -1.435   8.535
  490   1HB   HIS  62           HB2      HIS  62  12.114  -3.595   6.713
  491   2HB   HIS  62           HB1      HIS  62  13.668  -3.622   7.548
  492    HD1  HIS  62           HD1      HIS  62  12.287  -2.283  10.197
  493    HD2  HIS  62           HD2      HIS  62  11.211  -5.832   8.294
  494    HE1  HIS  62           HE1      HIS  62  11.082  -3.684  11.926
  495    H    HIS  63           HN       HIS  63  11.522  -1.344   5.408
  496    HA   HIS  63           HA       HIS  63  14.057  -0.728   4.025
  497   1HB   HIS  63           HB2      HIS  63  11.270  -0.794   2.850
  498   2HB   HIS  63           HB1      HIS  63  12.805  -0.928   1.989
  499    HD1  HIS  63           HD1      HIS  63  14.317  -3.100   2.814
  500    HD2  HIS  63           HD2      HIS  63  10.215  -3.256   3.534
  501    HE1  HIS  63           HE1      HIS  63  13.754  -5.535   3.226
  502    H    GLU  64           HN       GLU  64  12.784   1.225   5.993
  503    HA   GLU  64           HA       GLU  64  12.011   3.437   4.196
  504   1HB   GLU  64           HB2      GLU  64  10.723   3.848   6.008
  505   2HB   GLU  64           HB1      GLU  64  11.717   2.829   7.049
  506   1HG   GLU  64           HG2      GLU  64  13.313   4.609   7.391
  507   2HG   GLU  64           HG1      GLU  64  12.534   5.613   6.166
  508    H    LYS  65           HN       LYS  65  14.552   2.744   6.614
  509    HA   LYS  65           HA       LYS  65  16.192   4.874   5.297
  510   1HB   LYS  65           HB2      LYS  65  15.433   4.879   7.895
  511   2HB   LYS  65           HB1      LYS  65  16.923   3.945   8.023
  512   1HG   LYS  65           HG2      LYS  65  18.117   5.843   7.870
  513   2HG   LYS  65           HG1      LYS  65  17.431   6.135   6.271
  514   1HD   LYS  65           HD2      LYS  65  15.644   7.417   7.144
  515   2HD   LYS  65           HD1      LYS  65  15.902   6.816   8.782
  516   1HE   LYS  65           HE2      LYS  65  18.263   7.927   8.535
  517   2HE   LYS  65           HE1      LYS  65  17.493   8.851   7.244
  518   1HZ   LYS  65           HZ1      LYS  65  15.708   9.385   8.893
  519   2HZ   LYS  65           HZ3      LYS  65  16.701   8.720  10.096
  520   3HZ   LYS  65           HZ2      LYS  65  17.223  10.081   9.223
  521    H    ASP  66           HN       ASP  66  16.432   2.679   3.923
  522    HA   ASP  66           HA       ASP  66  18.801   1.230   5.036
  523   1HB   ASP  66           HB2      ASP  66  18.138  -0.711   3.806
  524   2HB   ASP  66           HB1      ASP  66  16.677  -0.118   4.597
  525    H    THR  67           HN       THR  67  20.357   0.499   3.305
  526    HA   THR  67           HA       THR  67  20.813   2.719   1.424
  527    HB   THR  67           HB       THR  67  22.474   0.261   2.047
  528    HG1  THR  67           HG1      THR  67  22.216   2.783   3.125
  529   1HG2  THR  67          HG23      THR  67  22.952   2.678   0.296
  530   2HG2  THR  67          HG22      THR  67  24.274   1.692   0.922
  531   3HG2  THR  67          HG21      THR  67  23.069   0.975  -0.147
  532    NH1  ARG  68           NH2      ARG  68  20.959  -4.390   2.798
  533    NH2  ARG  68           NH1      ARG  68  19.492  -5.757   3.835
  534    H    ARG  68           HN       ARG  68  19.689  -0.586   1.371
  535    HA   ARG  68           HA       ARG  68  20.243  -1.312  -1.294
  536   1HB   ARG  68           HB2      ARG  68  17.662  -1.929   0.171
  537   2HB   ARG  68           HB1      ARG  68  18.422  -2.881  -1.105
  538   1HG   ARG  68           HG2      ARG  68  20.424  -2.594   0.822
  539   2HG   ARG  68           HG1      ARG  68  18.957  -2.884   1.758
  540   1HD   ARG  68           HD2      ARG  68  18.711  -4.695  -0.301
  541   2HD   ARG  68           HD1      ARG  68  20.448  -4.706  -0.011
  542    HE   ARG  68           HE       ARG  68  18.485  -5.966   1.618
  543   1HH1  ARG  68          HH21      ARG  68  21.310  -3.955   1.972
  544   2HH1  ARG  68          HH22      ARG  68  21.438  -4.262   3.667
  545   1HH2  ARG  68          HH11      ARG  68  18.702  -6.368   3.803
  546   2HH2  ARG  68          HH12      ARG  68  19.989  -5.626   4.693
  547    H    CYS  69           HN       CYS  69  17.151   0.113  -0.137
  548    HA   CYS  69           HA       CYS  69  16.272   0.695  -2.825
  549   1HB   CYS  69           HB2      CYS  69  14.800   0.393  -0.762
  550   2HB   CYS  69           HB1      CYS  69  15.267   2.032  -0.307
  551    H    LEU  70           HN       LEU  70  18.286   2.415  -0.552
  552    HA   LEU  70           HA       LEU  70  17.895   5.084  -1.371
  553   1HB   LEU  70           HB2      LEU  70  20.183   3.548  -0.244
  554   2HB   LEU  70           HB1      LEU  70  20.551   5.111  -0.970
  555    HG   LEU  70           HG       LEU  70  18.369   4.702   1.090
  556   1HD1  LEU  70          HD12      LEU  70  21.190   4.679   1.466
  557   2HD1  LEU  70          HD11      LEU  70  20.598   6.233   2.053
  558   3HD1  LEU  70          HD13      LEU  70  19.936   4.734   2.704
  559   1HD2  LEU  70          HD21      LEU  70  19.488   6.992  -0.457
  560   2HD2  LEU  70          HD23      LEU  70  17.839   6.716   0.106
  561   3HD2  LEU  70          HD22      LEU  70  19.068   7.300   1.228
  562    H    GLY  71           HN       GLY  71  20.687   3.165  -2.520
  563   1HA   GLY  71           HA2      GLY  71  20.771   2.771  -5.037
  564   2HA   GLY  71           HA1      GLY  71  20.298   4.464  -5.188
  565    H    ALA  72           HN       ALA  72  22.502   4.121  -6.492
  566    HA   ALA  72           HA       ALA  72  24.738   4.795  -4.619
  567   1HB   ALA  72           HB3      ALA  72  24.937   2.657  -6.009
  568   2HB   ALA  72           HB2      ALA  72  25.045   3.704  -7.425
  569   3HB   ALA  72           HB1      ALA  72  26.271   3.800  -6.160
  570    H    THR  73           HN       THR  73  22.736   6.642  -5.802
  571    HA   THR  73           HA       THR  73  24.682   8.431  -7.175
  572    HB   THR  73           HB       THR  73  23.116   9.025  -8.887
  573    HG1  THR  73           HG1      THR  73  21.031   7.743  -8.769
  574   1HG2  THR  73          HG23      THR  73  24.314   6.722  -8.974
  575   2HG2  THR  73          HG22      THR  73  22.714   6.048  -8.660
  576   3HG2  THR  73          HG21      THR  73  22.995   7.017 -10.107
  577    H    ALA  74           HN       ALA  74  23.597  10.734  -7.325
  578    HA   ALA  74           HA       ALA  74  22.647  11.353  -4.597
  579   1HB   ALA  74           HB2      ALA  74  23.759  12.940  -6.889
  580   2HB   ALA  74           HB1      ALA  74  22.820  13.769  -5.647
  581   3HB   ALA  74           HB3      ALA  74  24.286  12.893  -5.207
  582    H    GLN  75           HN       GLN  75  21.467  11.333  -7.908
  583    HA   GLN  75           HA       GLN  75  19.092  12.897  -7.388
  584   1HB   GLN  75           HB2      GLN  75  19.906  10.994  -9.587
  585   2HB   GLN  75           HB1      GLN  75  18.299  11.720  -9.545
  586   1HG   GLN  75           HG2      GLN  75  19.150  13.577 -10.487
  587   2HG   GLN  75           HG1      GLN  75  20.143  13.814  -9.048
  588   1HE2  GLN  75          HE22      GLN  75  21.884  11.714 -12.138
  589   2HE2  GLN  75          HE21      GLN  75  20.236  11.475 -11.808
  590    H    GLN  76           HN       GLN  76  19.493   9.375  -7.933
  591    HA   GLN  76           HA       GLN  76  16.872   8.615  -7.248
  592   1HB   GLN  76           HB2      GLN  76  19.533   7.234  -7.133
  593   2HB   GLN  76           HB1      GLN  76  18.120   6.438  -6.440
  594   1HG   GLN  76           HG2      GLN  76  16.986   7.092  -8.722
  595   2HG   GLN  76           HG1      GLN  76  18.651   7.197  -9.296
  596   1HE2  GLN  76          HE22      GLN  76  19.191   3.688  -9.210
  597   2HE2  GLN  76          HE21      GLN  76  19.915   5.214  -9.382
  598    H    PHE  77           HN       PHE  77  19.493   9.620  -5.164
  599    HA   PHE  77           HA       PHE  77  18.671   8.456  -2.718
  600   1HB   PHE  77           HB2      PHE  77  20.732  10.010  -3.373
  601   2HB   PHE  77           HB1      PHE  77  19.684  11.269  -2.719
  602    HD1  PHE  77           HD2      PHE  77  18.890  11.149  -0.365
  603    HD2  PHE  77           HD1      PHE  77  21.721   8.334  -1.952
  604    HE1  PHE  77           HE2      PHE  77  19.490  10.453   1.939
  605    HE2  PHE  77           HE1      PHE  77  22.320   7.639   0.352
  606    HZ   PHE  77           HZ       PHE  77  21.205   8.699   2.297
  607    H    HIS  78           HN       HIS  78  17.854  11.729  -3.950
  608    HA   HIS  78           HA       HIS  78  15.912  12.218  -1.881
  609   1HB   HIS  78           HB2      HIS  78  16.992  14.032  -3.180
  610   2HB   HIS  78           HB1      HIS  78  16.137  13.488  -4.624
  611    HD1  HIS  78           HD1      HIS  78  13.771  14.304  -4.935
  612    HD2  HIS  78           HD2      HIS  78  15.170  14.984  -1.068
  613    HE1  HIS  78           HE1      HIS  78  12.004  15.693  -3.767
  614    NH1  ARG  79           NH2      ARG  79  12.461   9.945 -11.414
  615    NH2  ARG  79           NH1      ARG  79  14.091  11.204 -12.343
  616    H    ARG  79           HN       ARG  79  15.665  10.977  -5.191
  617    HA   ARG  79           HA       ARG  79  12.858  10.964  -5.460
  618   1HB   ARG  79           HB2      ARG  79  14.953   9.036  -6.492
  619   2HB   ARG  79           HB1      ARG  79  13.257   8.957  -6.968
  620   1HG   ARG  79           HG2      ARG  79  14.095  11.673  -7.211
  621   2HG   ARG  79           HG1      ARG  79  15.306  10.666  -8.005
  622   1HD   ARG  79           HD2      ARG  79  13.130   9.454  -8.966
  623   2HD   ARG  79           HD1      ARG  79  12.418  11.040  -8.670
  624    HE   ARG  79           HE       ARG  79  14.772  11.604 -10.021
  625   1HH1  ARG  79          HH21      ARG  79  12.002   9.564 -10.614
  626   2HH1  ARG  79          HH22      ARG  79  12.118   9.732 -12.329
  627   1HH2  ARG  79          HH11      ARG  79  14.890  11.796 -12.251
  628   2HH2  ARG  79          HH12      ARG  79  13.737  10.980 -13.251
  629    H    HIS  80           HN       HIS  80  14.945   8.890  -3.555
  630    HA   HIS  80           HA       HIS  80  12.788   6.954  -3.036
  631   1HB   HIS  80           HB2      HIS  80  14.837   5.855  -3.030
  632   2HB   HIS  80           HB1      HIS  80  15.678   7.212  -2.279
  633    HD1  HIS  80           HD1      HIS  80  13.202   4.465  -1.408
  634    HD2  HIS  80           HD2      HIS  80  15.834   7.074   0.501
  635    HE1  HIS  80           HE1      HIS  80  13.257   3.771   1.027
  636    H    LYS  81           HN       LYS  81  14.383   9.657  -1.410
  637    HA   LYS  81           HA       LYS  81  13.335   9.260   1.199
  638   1HB   LYS  81           HB2      LYS  81  14.139  11.735  -0.332
  639   2HB   LYS  81           HB1      LYS  81  13.517  11.836   1.317
  640   1HG   LYS  81           HG2      LYS  81  15.431   9.759   1.332
  641   2HG   LYS  81           HG1      LYS  81  16.159  11.085   0.426
  642   1HD   LYS  81           HD2      LYS  81  14.735  11.671   3.005
  643   2HD   LYS  81           HD1      LYS  81  16.376  11.028   3.049
  644   1HE   LYS  81           HE2      LYS  81  16.947  13.236   2.892
  645   2HE   LYS  81           HE1      LYS  81  16.684  12.957   1.171
  646   1HZ   LYS  81           HZ2      LYS  81  14.390  13.670   2.853
  647   2HZ   LYS  81           HZ1      LYS  81  15.479  14.895   2.409
  648   3HZ   LYS  81           HZ3      LYS  81  14.673  14.005   1.211
  649    H    GLN  82           HN       GLN  82  11.816  10.473  -1.723
  650    HA   GLN  82           HA       GLN  82   9.497  11.528  -0.266
  651   1HB   GLN  82           HB2      GLN  82   8.648  12.182  -2.385
  652   2HB   GLN  82           HB1      GLN  82  10.392  12.417  -2.504
  653   1HG   GLN  82           HG2      GLN  82  10.114  11.213  -4.434
  654   2HG   GLN  82           HG1      GLN  82  10.238   9.850  -3.323
  655   1HE2  GLN  82          HE22      GLN  82   7.119   9.398  -5.336
  656   2HE2  GLN  82          HE21      GLN  82   8.774   9.505  -5.700
  657    H    LEU  83           HN       LEU  83  10.430   8.532  -1.819
  658    HA   LEU  83           HA       LEU  83   7.784   7.452  -2.119
  659   1HB   LEU  83           HB2      LEU  83   9.004   5.895  -3.195
  660   2HB   LEU  83           HB1      LEU  83  10.486   6.592  -2.556
  661    HG   LEU  83           HG       LEU  83  10.070   5.222  -0.432
  662   1HD1  LEU  83          HD13      LEU  83   7.582   4.807  -1.461
  663   2HD1  LEU  83          HD12      LEU  83   8.406   3.361  -2.044
  664   3HD1  LEU  83          HD11      LEU  83   8.349   3.706  -0.316
  665   1HD2  LEU  83          HD22      LEU  83  11.401   4.643  -2.726
  666   2HD2  LEU  83          HD21      LEU  83  11.406   3.605  -1.301
  667   3HD2  LEU  83          HD23      LEU  83  10.303   3.266  -2.635
  668    H    ILE  84           HN       ILE  84  10.136   7.420   0.535
  669    HA   ILE  84           HA       ILE  84   8.628   5.629   2.211
  670    HB   ILE  84           HB       ILE  84  10.608   7.781   3.019
  671   1HG1  ILE  84          HG12      ILE  84  11.620   6.237   1.427
  672   2HG1  ILE  84          HG11      ILE  84  12.217   5.852   3.042
  673   1HG2  ILE  84          HG22      ILE  84   9.051   5.766   4.481
  674   2HG2  ILE  84          HG21      ILE  84  10.785   5.663   4.791
  675   3HG2  ILE  84          HG23      ILE  84   9.922   7.172   5.093
  676   1HD1  ILE  84          HD11      ILE  84  10.207   4.188   3.123
  677   2HD1  ILE  84          HD13      ILE  84  10.211   4.357   1.368
  678   3HD1  ILE  84          HD12      ILE  84  11.640   3.740   2.200
  679    NH1  ARG  85           NH2      ARG  85   9.326  15.604   4.079
  680    NH2  ARG  85           NH1      ARG  85   8.200  16.024   5.993
  681    H    ARG  85           HN       ARG  85   8.631   9.163   1.833
  682    HA   ARG  85           HA       ARG  85   6.956   9.732   4.080
  683   1HB   ARG  85           HB2      ARG  85   8.257  11.277   2.275
  684   2HB   ARG  85           HB1      ARG  85   6.614  11.395   1.644
  685   1HG   ARG  85           HG2      ARG  85   5.803  12.431   3.561
  686   2HG   ARG  85           HG1      ARG  85   7.058  11.740   4.588
  687   1HD   ARG  85           HD2      ARG  85   8.728  13.186   3.332
  688   2HD   ARG  85           HD1      ARG  85   7.348  14.000   2.594
  689    HE   ARG  85           HE       ARG  85   6.824  14.109   5.318
  690   1HH1  ARG  85          HH21      ARG  85   9.464  15.068   3.247
  691   2HH1  ARG  85          HH22      ARG  85   9.933  16.374   4.278
  692   1HH2  ARG  85          HH11      ARG  85   7.464  15.807   6.633
  693   2HH2  ARG  85          HH12      ARG  85   8.815  16.790   6.179
  694    H    PHE  86           HN       PHE  86   6.182   9.030   0.682
  695    HA   PHE  86           HA       PHE  86   3.359   9.364   0.890
  696   1HB   PHE  86           HB2      PHE  86   5.243   8.316  -1.045
  697   2HB   PHE  86           HB1      PHE  86   3.822   7.276  -0.949
  698    HD1  PHE  86           HD1      PHE  86   4.332  10.978  -0.599
  699    HD2  PHE  86           HD2      PHE  86   2.316   7.790  -2.653
  700    HE1  PHE  86           HE1      PHE  86   3.026  12.640  -1.898
  701    HE2  PHE  86           HE2      PHE  86   1.011   9.451  -3.952
  702    HZ   PHE  86           HZ       PHE  86   1.366  11.876  -3.574
  703    H    LEU  87           HN       LEU  87   5.478   6.643   1.649
  704    HA   LEU  87           HA       LEU  87   3.430   4.666   1.979
  705   1HB   LEU  87           HB2      LEU  87   6.216   4.758   2.198
  706   2HB   LEU  87           HB1      LEU  87   5.661   4.342   3.820
  707    HG   LEU  87           HG       LEU  87   4.673   2.942   1.325
  708   1HD1  LEU  87          HD13      LEU  87   7.186   2.675   2.799
  709   2HD1  LEU  87          HD12      LEU  87   6.271   1.169   2.746
  710   3HD1  LEU  87          HD11      LEU  87   6.719   1.982   1.246
  711   1HD2  LEU  87          HD21      LEU  87   4.031   2.874   4.167
  712   2HD2  LEU  87          HD23      LEU  87   3.182   2.124   2.815
  713   3HD2  LEU  87          HD22      LEU  87   4.533   1.288   3.580
  714    H    LYS  88           HN       LYS  88   5.042   6.771   4.391
  715    HA   LYS  88           HA       LYS  88   3.661   5.877   6.676
  716   1HB   LYS  88           HB2      LYS  88   4.550   8.699   6.008
  717   2HB   LYS  88           HB1      LYS  88   4.115   8.127   7.619
  718   1HG   LYS  88           HG2      LYS  88   5.964   6.628   7.697
  719   2HG   LYS  88           HG1      LYS  88   6.270   6.798   5.968
  720   1HD   LYS  88           HD2      LYS  88   7.470   8.700   6.254
  721   2HD   LYS  88           HD1      LYS  88   6.314   9.353   7.416
  722   1HE   LYS  88           HE2      LYS  88   7.386   8.402   9.229
  723   2HE   LYS  88           HE1      LYS  88   8.016   7.054   8.282
  724   1HZ   LYS  88           HZ2      LYS  88   9.268   9.064   7.109
  725   2HZ   LYS  88           HZ1      LYS  88   9.106   9.724   8.666
  726   3HZ   LYS  88           HZ3      LYS  88   9.908   8.245   8.454
  727    NH1  ARG  89           NH2      ARG  89  -2.067  13.298   1.033
  728    NH2  ARG  89           NH1      ARG  89  -3.129  11.964  -0.447
  729    H    ARG  89           HN       ARG  89   2.692   8.346   4.298
  730    HA   ARG  89           HA       ARG  89   0.318   9.190   5.616
  731   1HB   ARG  89           HB2      ARG  89   1.002  10.540   3.815
  732   2HB   ARG  89           HB1      ARG  89   1.201   9.160   2.737
  733   1HG   ARG  89           HG2      ARG  89  -1.066   8.990   2.305
  734   2HG   ARG  89           HG1      ARG  89  -1.520   9.704   3.853
  735   1HD   ARG  89           HD2      ARG  89  -1.390  11.838   3.058
  736   2HD   ARG  89           HD1      ARG  89   0.010  11.480   2.047
  737    HE   ARG  89           HE       ARG  89  -2.080  10.139   0.811
  738   1HH1  ARG  89          HH21      ARG  89  -1.468  13.423   1.824
  739   2HH1  ARG  89          HH22      ARG  89  -2.454  14.098   0.576
  740   1HH2  ARG  89          HH11      ARG  89  -3.348  11.053  -0.795
  741   2HH2  ARG  89          HH12      ARG  89  -3.510  12.774  -0.892
  742    H    LEU  90           HN       LEU  90   0.749   6.682   3.113
  743    HA   LEU  90           HA       LEU  90  -2.031   5.868   3.223
  744   1HB   LEU  90           HB2      LEU  90   0.124   5.406   1.513
  745   2HB   LEU  90           HB1      LEU  90  -0.204   3.827   2.232
  746    HG   LEU  90           HG       LEU  90  -2.672   4.270   1.702
  747   1HD1  LEU  90          HD11      LEU  90  -1.624   6.775   0.985
  748   2HD1  LEU  90          HD13      LEU  90  -2.020   5.990  -0.545
  749   3HD1  LEU  90          HD12      LEU  90  -3.263   6.196   0.688
  750   1HD2  LEU  90          HD22      LEU  90  -0.476   3.715  -0.255
  751   2HD2  LEU  90          HD21      LEU  90  -1.768   2.654   0.310
  752   3HD2  LEU  90          HD23      LEU  90  -2.113   3.906  -0.882
  753    H    ASP  91           HN       ASP  91   0.552   5.307   5.369
  754    HA   ASP  91           HA       ASP  91  -0.061   2.577   6.089
  755   1HB   ASP  91           HB2      ASP  91   2.091   3.335   6.726
  756   2HB   ASP  91           HB1      ASP  91   1.447   4.810   7.450
  757    NH1  ARG  92           NH2      ARG  92  -2.110   8.291  14.255
  758    NH2  ARG  92           NH1      ARG  92  -0.153   9.337  13.826
  759    H    ARG  92           HN       ARG  92  -0.844   5.697   7.674
  760    HA   ARG  92           HA       ARG  92  -2.739   4.296   9.450
  761   1HB   ARG  92           HB2      ARG  92  -1.697   7.116   9.260
  762   2HB   ARG  92           HB1      ARG  92  -3.096   6.734  10.264
  763   1HG   ARG  92           HG2      ARG  92  -1.348   4.738  10.970
  764   2HG   ARG  92           HG1      ARG  92  -0.252   6.090  10.685
  765   1HD   ARG  92           HD2      ARG  92  -2.672   6.818  12.196
  766   2HD   ARG  92           HD1      ARG  92  -1.630   5.663  13.026
  767    HE   ARG  92           HE       ARG  92   0.114   7.615  12.104
  768   1HH1  ARG  92          HH21      ARG  92  -2.771   7.567  14.068
  769   2HH1  ARG  92          HH22      ARG  92  -2.294   8.954  14.980
  770   1HH2  ARG  92          HH11      ARG  92   0.695   9.412  13.303
  771   2HH2  ARG  92          HH12      ARG  92  -0.354   9.995  14.551
  772    H    ASN  93           HN       ASN  93  -2.834   6.205   6.525
  773    HA   ASN  93           HA       ASN  93  -5.657   6.904   6.839
  774   1HB   ASN  93           HB2      ASN  93  -3.684   8.020   5.399
  775   2HB   ASN  93           HB1      ASN  93  -4.367   6.969   4.158
  776   1HD2  ASN  93          HD22      ASN  93  -6.489  10.203   5.460
  777   2HD2  ASN  93          HD21      ASN  93  -5.044   9.756   6.232
  778    H    LEU  94           HN       LEU  94  -3.829   4.334   5.263
  779    HA   LEU  94           HA       LEU  94  -5.940   3.379   3.588
  780   1HB   LEU  94           HB2      LEU  94  -3.545   2.704   3.382
  781   2HB   LEU  94           HB1      LEU  94  -3.721   1.754   4.858
  782    HG   LEU  94           HG       LEU  94  -5.722   0.634   3.648
  783   1HD1  LEU  94          HD12      LEU  94  -5.599   2.434   1.802
  784   2HD1  LEU  94          HD11      LEU  94  -4.209   1.535   1.194
  785   3HD1  LEU  94          HD13      LEU  94  -5.791   0.760   1.281
  786   1HD2  LEU  94          HD23      LEU  94  -2.799   0.250   3.250
  787   2HD2  LEU  94          HD22      LEU  94  -3.999  -0.861   3.910
  788   3HD2  LEU  94          HD21      LEU  94  -3.861  -0.648   2.166
  789    CH2  TRP  95           CH2      TRP  95  -5.645  -0.654  13.550
  790    H    TRP  95           HN       TRP  95  -4.810   1.928   6.676
  791    HA   TRP  95           HA       TRP  95  -7.402   0.539   6.905
  792   1HB   TRP  95           HB2      TRP  95  -6.337  -0.902   8.295
  793   2HB   TRP  95           HB1      TRP  95  -4.902  -0.229   7.527
  794    HD1  TRP  95           HD1      TRP  95  -4.166   2.240   8.866
  795    HE1  TRP  95           HE1      TRP  95  -3.749   2.475  11.403
  796    HE3  TRP  95           HE3      TRP  95  -6.747  -1.812  10.540
  797    HZ2  TRP  95           HZ2      TRP  95  -4.429   1.101  13.828
  798    HZ3  TRP  95           HZ3      TRP  95  -6.842  -2.339  12.954
  799    HH2  TRP  95           HH2      TRP  95  -5.694  -0.888  14.603
  800    H    GLY  96           HN       GLY  96  -6.022   3.451   8.065
  801   1HA   GLY  96           HA2      GLY  96  -7.132   3.746  10.630
  802   2HA   GLY  96           HA1      GLY  96  -6.935   5.087   9.502
  803    H    LEU  97           HN       LEU  97  -8.724   3.758   7.505
  804    HA   LEU  97           HA       LEU  97 -11.245   4.824   8.528
  805   1HB   LEU  97           HB2      LEU  97 -10.232   4.686   6.042
  806   2HB   LEU  97           HB1      LEU  97 -11.167   3.190   6.034
  807    HG   LEU  97           HG       LEU  97 -12.911   4.991   7.201
  808   1HD1  LEU  97          HD13      LEU  97 -10.933   6.540   5.930
  809   2HD1  LEU  97          HD12      LEU  97 -12.308   6.545   4.828
  810   3HD1  LEU  97          HD11      LEU  97 -12.510   7.093   6.492
  811   1HD2  LEU  97          HD22      LEU  97 -12.565   4.105   4.323
  812   2HD2  LEU  97          HD21      LEU  97 -13.580   3.360   5.558
  813   3HD2  LEU  97          HD23      LEU  97 -14.001   4.945   4.909
  814    H    ALA  98           HN       ALA  98  -9.883   1.642   7.813
  815    HA   ALA  98           HA       ALA  98 -12.115  -0.010   8.080
  816   1HB   ALA  98           HB3      ALA  98  -9.231  -0.365   8.878
  817   2HB   ALA  98           HB2      ALA  98 -10.409  -1.650   9.145
  818   3HB   ALA  98           HB1      ALA  98 -10.086  -1.073   7.509
  819    H    GLY  99           HN       GLY  99 -10.052   1.251  10.703
  820   1HA   GLY  99           HA2      GLY  99 -10.585   1.625  12.967
  821   2HA   GLY  99           HA1      GLY  99 -12.280   1.380  12.542
  822    H    LEU 100           HN       LEU 100  -9.292  -0.585  12.753
  823    HA   LEU 100           HA       LEU 100 -10.837  -2.586  14.334
  824   1HB   LEU 100           HB2      LEU 100  -9.940  -2.914  11.628
  825   2HB   LEU 100           HB1      LEU 100  -8.994  -3.985  12.658
  826    HG   LEU 100           HG       LEU 100 -11.094  -5.049  11.825
  827   1HD1  LEU 100          HD11      LEU 100 -10.917  -4.538  14.809
  828   2HD1  LEU 100          HD13      LEU 100 -11.888  -5.813  14.071
  829   3HD1  LEU 100          HD12      LEU 100 -10.131  -5.841  13.917
  830   1HD2  LEU 100          HD21      LEU 100 -12.274  -2.678  12.110
  831   2HD2  LEU 100          HD23      LEU 100 -13.195  -4.175  12.250
  832   3HD2  LEU 100          HD22      LEU 100 -12.662  -3.329  13.703
  833    H    ASN 101           HN       ASN 101  -8.714  -4.450  14.551
  834    HA   ASN 101           HA       ASN 101  -6.704  -2.807  16.033
  835   1HB   ASN 101           HB2      ASN 101  -7.190  -5.744  16.509
  836   2HB   ASN 101           HB1      ASN 101  -6.524  -4.541  17.614
  837   1HD2  ASN 101          HD22      ASN 101  -9.744  -3.246  18.545
  838   2HD2  ASN 101          HD21      ASN 101  -8.105  -2.827  18.399
  839    H    SER 102           HN       SER 102  -4.814  -4.922  16.347
  840    HA   SER 102           HA       SER 102  -3.313  -4.684  13.949
  841   1HB   SER 102           HB2      SER 102  -2.598  -5.462  16.354
  842   2HB   SER 102           HB1      SER 102  -2.990  -7.070  15.749
  843    HG   SER 102           HG       SER 102  -0.781  -6.421  15.399
  844    H    CYS 103           HN       CYS 103  -2.959  -6.176  12.229
  845    HA   CYS 103           HA       CYS 103  -4.904  -8.435  12.058
  846   1HB   CYS 103           HB2      CYS 103  -4.192  -6.601   9.748
  847   2HB   CYS 103           HB1      CYS 103  -5.400  -7.885   9.754
  848    HA   PRO 104           HA       PRO 104  -0.454  -9.625  11.468
  849   1HB   PRO 104           HB2      PRO 104  -1.234 -12.136  12.663
  850   2HB   PRO 104           HB1      PRO 104  -0.131 -10.911  13.306
  851   1HG   PRO 104           HG2      PRO 104  -2.802 -11.501  14.204
  852   2HG   PRO 104           HG1      PRO 104  -1.705 -10.258  14.817
  853   1HD   PRO 104           HD2      PRO 104  -4.082  -9.877  13.239
  854   2HD   PRO 104           HD1      PRO 104  -2.959  -8.636  13.833
  855    H    VAL 105           HN       VAL 105  -0.899  -9.742   9.182
  856    HA   VAL 105           HA       VAL 105  -2.558 -11.588   7.854
  857    HB   VAL 105           HB       VAL 105  -1.337  -9.764   6.697
  858   1HG1  VAL 105          HG12      VAL 105   0.819 -10.413   8.083
  859   2HG1  VAL 105          HG11      VAL 105   1.139 -11.460   6.700
  860   3HG1  VAL 105          HG13      VAL 105   0.978  -9.719   6.470
  861   1HG2  VAL 105          HG22      VAL 105  -2.053 -12.103   5.643
  862   2HG2  VAL 105          HG21      VAL 105  -1.161 -10.916   4.690
  863   3HG2  VAL 105          HG23      VAL 105  -0.311 -12.275   5.426
  864    H    LYS 106           HN       LYS 106  -2.538 -13.790   7.869
  865    HA   LYS 106           HA       LYS 106   0.022 -15.145   8.609
  866   1HB   LYS 106           HB2      LYS 106  -2.796 -15.583   9.339
  867   2HB   LYS 106           HB1      LYS 106  -1.941 -17.055   8.876
  868   1HG   LYS 106           HG2      LYS 106  -0.348 -15.309  10.610
  869   2HG   LYS 106           HG1      LYS 106  -1.838 -15.862  11.374
  870   1HD   LYS 106           HD2      LYS 106  -0.038 -17.789   9.911
  871   2HD   LYS 106           HD1      LYS 106   0.260 -17.369  11.598
  872   1HE   LYS 106           HE2      LYS 106  -2.456 -17.888  11.572
  873   2HE   LYS 106           HE1      LYS 106  -1.822 -19.084  10.443
  874   1HZ   LYS 106           HZ1      LYS 106  -0.032 -19.296  12.368
  875   2HZ   LYS 106           HZ3      LYS 106  -1.355 -18.799  13.305
  876   3HZ   LYS 106           HZ2      LYS 106  -1.469 -20.203  12.355
  877    H    GLU 107           HN       GLU 107  -2.945 -16.079   6.826
  878    HA   GLU 107           HA       GLU 107  -1.673 -17.989   5.166
  879   1HB   GLU 107           HB2      GLU 107  -4.120 -17.827   5.389
  880   2HB   GLU 107           HB1      GLU 107  -4.099 -16.274   4.552
  881   1HG   GLU 107           HG2      GLU 107  -4.192 -17.344   2.578
  882   2HG   GLU 107           HG1      GLU 107  -2.655 -18.130   2.943
  883    H    ALA 108           HN       ALA 108   0.287 -17.149   4.314
  884    HA   ALA 108           HA       ALA 108   0.091 -15.800   1.798
  885   1HB   ALA 108           HB2      ALA 108   0.612 -14.132   4.221
  886   2HB   ALA 108           HB1      ALA 108   1.539 -13.776   2.763
  887   3HB   ALA 108           HB3      ALA 108  -0.224 -13.709   2.727
  888    H    ASP 109           HN       ASP 109   1.935 -16.302   0.667
  889    HA   ASP 109           HA       ASP 109   4.143 -17.561   2.179
  890   1HB   ASP 109           HB2      ASP 109   3.125 -17.665  -0.587
  891   2HB   ASP 109           HB1      ASP 109   4.886 -17.662  -0.465
  892    H    GLN 110           HN       GLN 110   4.544 -15.643  -0.787
  893    HA   GLN 110           HA       GLN 110   5.569 -13.286   0.418
  894   1HB   GLN 110           HB2      GLN 110   8.018 -13.672   0.014
  895   2HB   GLN 110           HB1      GLN 110   7.358 -14.657   1.320
  896   1HG   GLN 110           HG2      GLN 110   6.929 -16.213  -0.937
  897   2HG   GLN 110           HG1      GLN 110   8.506 -15.485  -1.233
  898   1HE2  GLN 110          HE22      GLN 110   8.657 -18.632   0.995
  899   2HE2  GLN 110          HE21      GLN 110   7.717 -18.336  -0.388
  900    H    SER 111           HN       SER 111   4.367 -12.504  -1.430
  901    HA   SER 111           HA       SER 111   5.448 -13.182  -4.103
  902   1HB   SER 111           HB2      SER 111   3.553 -11.945  -4.983
  903   2HB   SER 111           HB1      SER 111   2.971 -13.018  -3.715
  904    HG   SER 111           HG       SER 111   2.486 -10.538  -3.817
  905    H    THR 112           HN       THR 112   6.716 -11.782  -5.268
  906    HA   THR 112           HA       THR 112   8.221  -9.779  -4.020
  907    HB   THR 112           HB       THR 112   8.933  -9.110  -6.227
  908    HG1  THR 112           HG1      THR 112   6.449 -10.206  -6.912
  909   1HG2  THR 112          HG22      THR 112   8.937 -11.735  -5.283
  910   2HG2  THR 112          HG21      THR 112   8.451 -11.882  -6.973
  911   3HG2  THR 112          HG23      THR 112   9.968 -11.083  -6.558
  912    H    LEU 113           HN       LEU 113   7.984  -7.572  -3.729
  913    HA   LEU 113           HA       LEU 113   5.442  -6.451  -3.384
  914   1HB   LEU 113           HB2      LEU 113   7.613  -5.516  -2.522
  915   2HB   LEU 113           HB1      LEU 113   7.922  -4.887  -4.141
  916    HG   LEU 113           HG       LEU 113   5.747  -3.654  -4.024
  917   1HD1  LEU 113          HD11      LEU 113   5.792  -4.789  -1.219
  918   2HD1  LEU 113          HD13      LEU 113   4.813  -3.392  -1.666
  919   3HD1  LEU 113          HD12      LEU 113   4.521  -4.954  -2.430
  920   1HD2  LEU 113          HD21      LEU 113   7.882  -3.154  -1.938
  921   2HD2  LEU 113          HD23      LEU 113   7.696  -2.373  -3.508
  922   3HD2  LEU 113          HD22      LEU 113   6.554  -2.024  -2.210
  923    H    GLU 114           HN       GLU 114   7.269  -6.778  -6.348
  924    HA   GLU 114           HA       GLU 114   6.072  -4.755  -7.909
  925   1HB   GLU 114           HB2      GLU 114   7.757  -6.944  -8.376
  926   2HB   GLU 114           HB1      GLU 114   6.350  -7.235  -9.399
  927   1HG   GLU 114           HG2      GLU 114   6.628  -5.216 -10.574
  928   2HG   GLU 114           HG1      GLU 114   7.643  -4.516  -9.312
  929    H    ASN 115           HN       ASN 115   5.024  -8.162  -7.622
  930    HA   ASN 115           HA       ASN 115   2.552  -7.711  -9.033
  931   1HB   ASN 115           HB2      ASN 115   3.881  -9.935  -8.513
  932   2HB   ASN 115           HB1      ASN 115   2.858  -9.959  -7.076
  933   1HD2  ASN 115          HD22      ASN 115   1.288 -11.144 -10.551
  934   2HD2  ASN 115          HD21      ASN 115   2.955 -10.970 -10.280
  935    H    PHE 116           HN       PHE 116   3.475  -7.357  -5.671
  936    HA   PHE 116           HA       PHE 116   0.848  -7.519  -4.534
  937   1HB   PHE 116           HB2      PHE 116   2.726  -7.543  -3.039
  938   2HB   PHE 116           HB1      PHE 116   3.341  -6.021  -3.684
  939    HD1  PHE 116           HD1      PHE 116   0.636  -7.578  -1.680
  940    HD2  PHE 116           HD2      PHE 116   2.453  -3.904  -2.965
  941    HE1  PHE 116           HE1      PHE 116  -0.702  -6.331  -0.005
  942    HE2  PHE 116           HE2      PHE 116   1.115  -2.657  -1.290
  943    HZ   PHE 116           HZ       PHE 116  -0.463  -3.870   0.189
  944    H    LEU 117           HN       LEU 117   2.730  -4.530  -5.088
  945    HA   LEU 117           HA       LEU 117   0.538  -2.757  -4.922
  946   1HB   LEU 117           HB2      LEU 117   1.970  -1.159  -6.145
  947   2HB   LEU 117           HB1      LEU 117   2.893  -2.010  -4.906
  948    HG   LEU 117           HG       LEU 117   3.259  -3.701  -6.985
  949   1HD1  LEU 117          HD11      LEU 117   1.983  -1.610  -8.226
  950   2HD1  LEU 117          HD13      LEU 117   3.678  -1.188  -8.466
  951   3HD1  LEU 117          HD12      LEU 117   3.065  -2.741  -9.036
  952   1HD2  LEU 117          HD22      LEU 117   4.751  -1.604  -5.655
  953   2HD2  LEU 117          HD21      LEU 117   5.336  -3.135  -6.304
  954   3HD2  LEU 117          HD23      LEU 117   5.235  -1.717  -7.347
  955    H    GLU 118           HN       GLU 118   1.525  -4.899  -7.506
  956    HA   GLU 118           HA       GLU 118   0.236  -3.606  -9.696
  957   1HB   GLU 118           HB2      GLU 118   1.795  -5.577  -9.854
  958   2HB   GLU 118           HB1      GLU 118   0.492  -6.591  -9.234
  959   1HG   GLU 118           HG2      GLU 118  -0.934  -5.694 -11.154
  960   2HG   GLU 118           HG1      GLU 118   0.559  -5.039 -11.826
  961    NH1  ARG 119           NH2      ARG 119  -5.027 -10.678 -10.290
  962    NH2  ARG 119           NH1      ARG 119  -4.661  -9.069 -11.834
  963    H    ARG 119           HN       ARG 119  -0.979  -6.245  -7.618
  964    HA   ARG 119           HA       ARG 119  -3.663  -6.149  -8.647
  965   1HB   ARG 119           HB2      ARG 119  -2.679  -7.158  -5.958
  966   2HB   ARG 119           HB1      ARG 119  -4.232  -7.539  -6.704
  967   1HG   ARG 119           HG2      ARG 119  -1.879  -8.046  -8.419
  968   2HG   ARG 119           HG1      ARG 119  -1.989  -9.071  -6.987
  969   1HD   ARG 119           HD2      ARG 119  -3.335 -10.320  -8.364
  970   2HD   ARG 119           HD1      ARG 119  -4.558  -9.186  -7.794
  971    HE   ARG 119           HE       ARG 119  -3.462  -7.937 -10.016
  972   1HH1  ARG 119          HH21      ARG 119  -4.923 -11.041  -9.366
  973   2HH1  ARG 119          HH22      ARG 119  -5.533 -11.205 -10.974
  974   1HH2  ARG 119          HH11      ARG 119  -4.269  -8.187 -12.094
  975   2HH2  ARG 119          HH12      ARG 119  -5.170  -9.607 -12.506
  976    H    LEU 120           HN       LEU 120  -1.978  -4.119  -6.377
  977    HA   LEU 120           HA       LEU 120  -4.405  -3.256  -4.997
  978   1HB   LEU 120           HB2      LEU 120  -1.546  -2.766  -4.784
  979   2HB   LEU 120           HB1      LEU 120  -2.461  -1.260  -4.677
  980    HG   LEU 120           HG       LEU 120  -3.987  -2.871  -3.103
  981   1HD1  LEU 120          HD13      LEU 120  -2.386  -4.746  -3.356
  982   2HD1  LEU 120          HD12      LEU 120  -1.110  -3.731  -2.685
  983   3HD1  LEU 120          HD11      LEU 120  -2.485  -4.197  -1.683
  984   1HD2  LEU 120          HD21      LEU 120  -1.567  -1.192  -2.389
  985   2HD2  LEU 120          HD23      LEU 120  -3.258  -0.691  -2.402
  986   3HD2  LEU 120          HD22      LEU 120  -2.685  -1.827  -1.181
  987    H    LYS 121           HN       LYS 121  -2.540  -2.236  -7.783
  988    HA   LYS 121           HA       LYS 121  -3.910   0.315  -8.146
  989   1HB   LYS 121           HB2      LYS 121  -1.663  -0.072  -9.080
  990   2HB   LYS 121           HB1      LYS 121  -2.290  -1.399 -10.057
  991   1HG   LYS 121           HG2      LYS 121  -3.740   1.159 -10.364
  992   2HG   LYS 121           HG1      LYS 121  -2.075   1.169 -10.950
  993   1HD   LYS 121           HD2      LYS 121  -3.815  -1.162 -11.659
  994   2HD   LYS 121           HD1      LYS 121  -4.056   0.357 -12.521
  995   1HE   LYS 121           HE2      LYS 121  -2.252  -0.068 -13.792
  996   2HE   LYS 121           HE1      LYS 121  -1.243  -0.130 -12.347
  997   1HZ   LYS 121           HZ3      LYS 121  -2.907  -2.429 -13.165
  998   2HZ   LYS 121           HZ2      LYS 121  -1.348  -2.196 -13.798
  999   3HZ   LYS 121           HZ1      LYS 121  -1.567  -2.410 -12.127
 1000    H    THR 122           HN       THR 122  -4.296  -2.978  -9.215
 1001    HA   THR 122           HA       THR 122  -6.261  -2.393 -11.261
 1002    HB   THR 122           HB       THR 122  -6.531  -5.087 -10.441
 1003    HG1  THR 122           HG1      THR 122  -4.314  -5.691 -10.479
 1004   1HG2  THR 122          HG22      THR 122  -4.953  -3.702 -12.618
 1005   2HG2  THR 122          HG21      THR 122  -5.192  -5.449 -12.557
 1006   3HG2  THR 122          HG23      THR 122  -6.578  -4.375 -12.741
 1007    H    ILE 123           HN       ILE 123  -6.462  -3.651  -7.953
 1008    HA   ILE 123           HA       ILE 123  -9.329  -3.926  -7.979
 1009    HB   ILE 123           HB       ILE 123  -7.455  -3.658  -5.615
 1010   1HG1  ILE 123          HG12      ILE 123  -6.992  -5.521  -7.311
 1011   2HG1  ILE 123          HG11      ILE 123  -7.279  -6.044  -5.651
 1012   1HG2  ILE 123          HG23      ILE 123 -10.354  -4.137  -5.932
 1013   2HG2  ILE 123          HG22      ILE 123  -9.531  -5.271  -4.860
 1014   3HG2  ILE 123          HG21      ILE 123  -9.458  -3.539  -4.536
 1015   1HD1  ILE 123          HD12      ILE 123  -9.445  -5.911  -7.765
 1016   2HD1  ILE 123          HD11      ILE 123  -8.540  -7.376  -7.387
 1017   3HD1  ILE 123          HD13      ILE 123  -9.567  -6.632  -6.161
 1018    H    MET 124           HN       MET 124  -7.164  -1.304  -6.942
 1019    HA   MET 124           HA       MET 124  -9.406   0.202  -5.814
 1020   1HB   MET 124           HB2      MET 124  -6.492   0.455  -5.867
 1021   2HB   MET 124           HB1      MET 124  -7.325   1.999  -6.044
 1022   1HG   MET 124           HG2      MET 124  -8.048   1.973  -3.901
 1023   2HG   MET 124           HG1      MET 124  -8.532   0.281  -4.000
 1024   1HE   MET 124           HE2      MET 124  -6.398   2.896  -3.077
 1025   2HE   MET 124           HE1      MET 124  -6.450   2.120  -1.496
 1026   3HE   MET 124           HE3      MET 124  -4.915   2.273  -2.360
 1027    NH1  ARG 125           NH2      ARG 125  -3.489   4.107 -13.465
 1028    NH2  ARG 125           NH1      ARG 125  -4.141   2.340 -14.714
 1029    H    ARG 125           HN       ARG 125  -7.268   0.669  -8.647
 1030    HA   ARG 125           HA       ARG 125  -8.726   2.987  -9.545
 1031   1HB   ARG 125           HB2      ARG 125  -6.340   1.785 -10.243
 1032   2HB   ARG 125           HB1      ARG 125  -7.356   1.491 -11.656
 1033   1HG   ARG 125           HG2      ARG 125  -7.736   3.792 -12.013
 1034   2HG   ARG 125           HG1      ARG 125  -7.230   4.218 -10.378
 1035   1HD   ARG 125           HD2      ARG 125  -5.479   4.820 -11.993
 1036   2HD   ARG 125           HD1      ARG 125  -4.913   3.532 -10.928
 1037    HE   ARG 125           HE       ARG 125  -5.968   2.171 -13.090
 1038   1HH1  ARG 125          HH21      ARG 125  -3.614   4.717 -12.686
 1039   2HH1  ARG 125          HH22      ARG 125  -2.715   4.246 -14.084
 1040   1HH2  ARG 125          HH11      ARG 125  -4.776   1.588 -14.892
 1041   2HH2  ARG 125          HH12      ARG 125  -3.363   2.492 -15.324
 1042    H    GLU 126           HN       GLU 126  -9.114  -0.466 -10.164
 1043    HA   GLU 126           HA       GLU 126 -11.068   0.092 -12.303
 1044   1HB   GLU 126           HB2      GLU 126  -9.297  -1.931 -11.976
 1045   2HB   GLU 126           HB1      GLU 126 -10.755  -2.679 -11.324
 1046   1HG   GLU 126           HG2      GLU 126 -11.930  -1.795 -13.446
 1047   2HG   GLU 126           HG1      GLU 126 -10.305  -1.547 -14.086
 1048    H    LYS 127           HN       LYS 127 -11.131  -1.251  -8.981
 1049    HA   LYS 127           HA       LYS 127 -14.038  -1.675  -9.234
 1050   1HB   LYS 127           HB2      LYS 127 -12.442  -3.245  -8.002
 1051   2HB   LYS 127           HB1      LYS 127 -12.404  -2.029  -6.724
 1052   1HG   LYS 127           HG2      LYS 127 -14.340  -2.842  -5.921
 1053   2HG   LYS 127           HG1      LYS 127 -15.130  -2.391  -7.432
 1054   1HD   LYS 127           HD2      LYS 127 -13.514  -4.920  -7.311
 1055   2HD   LYS 127           HD1      LYS 127 -15.152  -4.905  -6.658
 1056   1HE   LYS 127           HE2      LYS 127 -16.096  -4.807  -8.717
 1057   2HE   LYS 127           HE1      LYS 127 -14.926  -3.619  -9.292
 1058   1HZ   LYS 127           HZ1      LYS 127 -14.155  -6.437  -8.872
 1059   2HZ   LYS 127           HZ3      LYS 127 -14.885  -5.941 -10.319
 1060   3HZ   LYS 127           HZ2      LYS 127 -13.405  -5.260  -9.842
 1061    OH   TYR 128           OH       TYR 128 -11.927  -1.336  -1.482
 1062    H    TYR 128           HN       TYR 128 -11.890   0.631  -7.581
 1063    HA   TYR 128           HA       TYR 128 -14.226   1.777  -6.192
 1064   1HB   TYR 128           HB2      TYR 128 -11.302   2.550  -6.189
 1065   2HB   TYR 128           HB1      TYR 128 -12.542   3.423  -5.298
 1066    HD1  TYR 128           HD1      TYR 128 -11.383  -0.113  -5.834
 1067    HD2  TYR 128           HD2      TYR 128 -12.941   2.804  -3.094
 1068    HE1  TYR 128           HE1      TYR 128 -11.240  -1.766  -3.996
 1069    HE2  TYR 128           HE2      TYR 128 -12.795   1.147  -1.254
 1070    HH   TYR 128           HH       TYR 128 -11.120  -1.841  -1.601
 1071    H    SER 129           HN       SER 129 -13.509   1.932  -9.294
 1072    HA   SER 129           HA       SER 129 -13.383   4.810  -9.739
 1073   1HB   SER 129           HB2      SER 129 -13.475   2.363 -11.390
 1074   2HB   SER 129           HB1      SER 129 -14.304   3.747 -12.095
 1075    HG   SER 129           HG       SER 129 -12.406   4.501 -12.545
 1076    H    LYS 130           HN       LYS 130 -15.888   2.400  -9.322
 1077    HA   LYS 130           HA       LYS 130 -18.031   4.008 -10.432
 1078   1HB   LYS 130           HB2      LYS 130 -18.165   1.670  -8.504
 1079   2HB   LYS 130           HB1      LYS 130 -19.502   2.308  -9.464
 1080   1HG   LYS 130           HG2      LYS 130 -16.946   1.365 -10.764
 1081   2HG   LYS 130           HG1      LYS 130 -18.258   0.244 -10.396
 1082   1HD   LYS 130           HD2      LYS 130 -19.587   2.347 -11.598
 1083   2HD   LYS 130           HD1      LYS 130 -18.078   2.274 -12.508
 1084   1HE   LYS 130           HE2      LYS 130 -18.508  -0.281 -12.616
 1085   2HE   LYS 130           HE1      LYS 130 -20.161   0.121 -12.149
 1086   1HZ   LYS 130           HZ3      LYS 130 -19.103   1.761 -14.269
 1087   2HZ   LYS 130           HZ2      LYS 130 -19.229   0.115 -14.676
 1088   3HZ   LYS 130           HZ1      LYS 130 -20.599   0.972 -14.151
 1089    H    CYS 131           HN       CYS 131 -16.221   4.416  -7.618
 1090    HA   CYS 131           HA       CYS 131 -18.506   5.451  -6.037
 1091   1HB   CYS 131           HB2      CYS 131 -16.653   4.038  -5.007
 1092   2HB   CYS 131           HB1      CYS 131 -15.576   5.408  -5.273
 1093    H    SER 132           HN       SER 132 -17.634   6.786  -8.528
 1094    HA   SER 132           HA       SER 132 -17.410   9.493  -7.453
 1095   1HB   SER 132           HB2      SER 132 -15.324  10.079  -8.498
 1096   2HB   SER 132           HB1      SER 132 -15.026   8.624  -7.552
 1097    HG   SER 132           HG       SER 132 -15.732   7.637  -9.759
 1098    H    SER 133           HN       SER 133 -17.035  10.995  -9.594
 1099    HA   SER 133           HA       SER 133 -18.651   9.812 -11.807
 1100   1HB   SER 133           HB2      SER 133 -19.905  11.373 -10.093
 1101   2HB   SER 133           HB1      SER 133 -19.089  12.663 -10.971
 1102    HG   SER 133           HG       SER 133 -21.081  12.213 -11.930
   
  Start of MODEL           5
 Raw file had 1102 H/Q atoms
  Start of MODEL    5
    1   1H    GLU   1           HT2      GLU   1 -16.540   5.237  15.744
    2   2H    GLU   1           HT1      GLU   1 -16.804   5.723  17.351
    3   3H    GLU   1           HT3      GLU   1 -15.506   4.695  16.978
    4    HA   GLU   1           HA       GLU   1 -16.864   2.870  16.595
    5   1HB   GLU   1           HB2      GLU   1 -17.226   4.437  18.986
    6   2HB   GLU   1           HB1      GLU   1 -18.727   3.594  18.608
    7   1HG   GLU   1           HG2      GLU   1 -17.566   1.993  19.860
    8   2HG   GLU   1           HG1      GLU   1 -17.169   1.530  18.205
    9    H    ALA   2           HN       ALA   2 -17.840   3.371  14.475
   10    HA   ALA   2           HA       ALA   2 -20.690   3.231  14.513
   11   1HB   ALA   2           HB1      ALA   2 -19.496   5.950  13.925
   12   2HB   ALA   2           HB3      ALA   2 -21.110   5.481  13.391
   13   3HB   ALA   2           HB2      ALA   2 -20.737   5.551  15.112
   14    H    GLU   3           HN       GLU   3 -21.399   2.521  12.510
   15    HA   GLU   3           HA       GLU   3 -19.418   1.812  10.536
   16   1HB   GLU   3           HB2      GLU   3 -22.425   1.899  10.162
   17   2HB   GLU   3           HB1      GLU   3 -21.264   0.911   9.272
   18   1HG   GLU   3           HG2      GLU   3 -20.712   0.195  11.859
   19   2HG   GLU   3           HG1      GLU   3 -22.452   0.474  11.938
   20    H    ALA   4           HN       ALA   4 -18.660   3.047   8.879
   21    HA   ALA   4           HA       ALA   4 -19.769   5.739   8.487
   22   1HB   ALA   4           HB1      ALA   4 -17.286   4.315   7.818
   23   2HB   ALA   4           HB3      ALA   4 -17.845   5.396   6.540
   24   3HB   ALA   4           HB2      ALA   4 -17.544   6.025   8.160
   25    H    HIS   5           HN       HIS   5 -19.628   6.305   5.874
   26    HA   HIS   5           HA       HIS   5 -20.683   4.279   4.112
   27   1HB   HIS   5           HB2      HIS   5 -22.585   5.018   5.857
   28   2HB   HIS   5           HB1      HIS   5 -22.785   6.316   4.679
   29    HD1  HIS   5           HD1      HIS   5 -22.106   4.661   2.111
   30    HD2  HIS   5           HD2      HIS   5 -24.751   3.423   5.086
   31    HE1  HIS   5           HE1      HIS   5 -23.651   2.966   1.037
   32    H    LYS   6           HN       LYS   6 -18.664   6.337   3.988
   33    HA   LYS   6           HA       LYS   6 -19.612   7.706   1.548
   34   1HB   LYS   6           HB2      LYS   6 -19.739   9.078   3.926
   35   2HB   LYS   6           HB1      LYS   6 -18.144   9.536   3.331
   36   1HG   LYS   6           HG2      LYS   6 -19.186  10.131   1.134
   37   2HG   LYS   6           HG1      LYS   6 -20.769   9.789   1.832
   38   1HD   LYS   6           HD2      LYS   6 -18.995  11.648   3.343
   39   2HD   LYS   6           HD1      LYS   6 -19.716  12.256   1.853
   40   1HE   LYS   6           HE2      LYS   6 -21.613  12.633   3.008
   41   2HE   LYS   6           HE1      LYS   6 -21.787  10.886   3.177
   42   1HZ   LYS   6           HZ2      LYS   6 -20.219  11.116   5.131
   43   2HZ   LYS   6           HZ1      LYS   6 -20.508  12.788   5.046
   44   3HZ   LYS   6           HZ3      LYS   6 -21.793  11.723   5.345
   45    H    CYS   7           HN       CYS   7 -17.927   5.760   1.255
   46    HA   CYS   7           HA       CYS   7 -15.144   6.319   1.734
   47   1HB   CYS   7           HB2      CYS   7 -14.725   4.339   0.611
   48   2HB   CYS   7           HB1      CYS   7 -16.415   4.087   1.051
   49    H    ASP   8           HN       ASP   8 -17.355   7.650  -0.529
   50    HA   ASP   8           HA       ASP   8 -15.741   8.048  -2.810
   51   1HB   ASP   8           HB2      ASP   8 -18.125   8.607  -2.775
   52   2HB   ASP   8           HB1      ASP   8 -17.822   9.900  -1.613
   53    H    ILE   9           HN       ILE   9 -15.440   9.476   0.352
   54    HA   ILE   9           HA       ILE   9 -13.803  11.706  -0.690
   55    HB   ILE   9           HB       ILE   9 -14.659  10.922   2.106
   56   1HG1  ILE   9          HG12      ILE   9 -15.369  13.564   1.106
   57   2HG1  ILE   9          HG11      ILE   9 -15.974  12.289   0.047
   58   1HG2  ILE   9          HG21      ILE   9 -12.926  13.208   1.132
   59   2HG2  ILE   9          HG23      ILE   9 -13.685  13.168   2.724
   60   3HG2  ILE   9          HG22      ILE   9 -12.481  11.954   2.288
   61   1HD1  ILE   9          HD12      ILE   9 -16.725  11.154   2.290
   62   2HD1  ILE   9          HD11      ILE   9 -16.586  12.784   2.948
   63   3HD1  ILE   9          HD13      ILE   9 -17.698  12.462   1.618
   64    H    THR  10           HN       THR  10 -13.183   9.604   2.103
   65    HA   THR  10           HA       THR  10 -10.385   9.785   2.009
   66    HB   THR  10           HB       THR  10 -12.198   7.627   3.097
   67    HG1  THR  10           HG1      THR  10 -10.634   9.127   4.756
   68   1HG2  THR  10          HG22      THR  10  -9.231   7.765   2.913
   69   2HG2  THR  10          HG21      THR  10  -9.908   7.261   4.462
   70   3HG2  THR  10          HG23      THR  10 -10.290   6.358   2.996
   71    H    LEU  11           HN       LEU  11 -12.318   6.990   0.821
   72    HA   LEU  11           HA       LEU  11 -10.162   5.546  -0.247
   73   1HB   LEU  11           HB2      LEU  11 -12.961   5.324  -0.303
   74   2HB   LEU  11           HB1      LEU  11 -12.457   5.321  -1.994
   75    HG   LEU  11           HG       LEU  11 -10.797   3.552  -1.491
   76   1HD1  LEU  11          HD12      LEU  11 -11.828   4.039   1.281
   77   2HD1  LEU  11          HD11      LEU  11 -11.320   2.408   0.843
   78   3HD1  LEU  11          HD13      LEU  11 -10.176   3.745   0.737
   79   1HD2  LEU  11          HD23      LEU  11 -13.109   2.957  -2.205
   80   2HD2  LEU  11          HD22      LEU  11 -12.399   1.730  -1.159
   81   3HD2  LEU  11          HD21      LEU  11 -13.586   2.861  -0.510
   82    H    GLN  12           HN       GLN  12 -11.719   8.403  -1.607
   83    HA   GLN  12           HA       GLN  12 -10.658   8.003  -4.267
   84   1HB   GLN  12           HB2      GLN  12 -11.820   9.871  -4.786
   85   2HB   GLN  12           HB1      GLN  12 -12.458   9.754  -3.154
   86   1HG   GLN  12           HG2      GLN  12 -10.606  11.205  -2.345
   87   2HG   GLN  12           HG1      GLN  12 -10.040  11.369  -4.010
   88   1HE2  GLN  12          HE22      GLN  12 -12.121  14.313  -3.723
   89   2HE2  GLN  12          HE21      GLN  12 -10.545  13.772  -3.401
   90    H    GLU  13           HN       GLU  13  -9.505   9.800  -1.421
   91    HA   GLU  13           HA       GLU  13  -7.155  10.830  -2.762
   92   1HB   GLU  13           HB2      GLU  13  -8.115  11.776  -0.638
   93   2HB   GLU  13           HB1      GLU  13  -7.530  10.341   0.207
   94   1HG   GLU  13           HG2      GLU  13  -5.461  11.554  -1.459
   95   2HG   GLU  13           HG1      GLU  13  -6.076  12.673  -0.242
   96    H    ILE  14           HN       ILE  14  -7.947   7.813  -1.188
   97    HA   ILE  14           HA       ILE  14  -5.192   6.924  -0.904
   98    HB   ILE  14           HB       ILE  14  -7.894   5.604  -0.649
   99   1HG1  ILE  14          HG12      ILE  14  -5.659   5.749   1.372
  100   2HG1  ILE  14          HG11      ILE  14  -6.750   7.114   1.133
  101   1HG2  ILE  14          HG22      ILE  14  -5.244   4.337  -1.050
  102   2HG2  ILE  14          HG21      ILE  14  -6.174   3.727   0.312
  103   3HG2  ILE  14          HG23      ILE  14  -6.858   3.679  -1.310
  104   1HD1  ILE  14          HD12      ILE  14  -8.672   5.464   1.447
  105   2HD1  ILE  14          HD11      ILE  14  -7.462   4.305   1.999
  106   3HD1  ILE  14          HD13      ILE  14  -7.714   5.807   2.889
  107    H    ILE  15           HN       ILE  15  -7.628   6.830  -3.417
  108    HA   ILE  15           HA       ILE  15  -6.383   4.690  -4.939
  109    HB   ILE  15           HB       ILE  15  -8.630   6.578  -5.282
  110   1HG1  ILE  15          HG12      ILE  15  -9.608   4.502  -6.307
  111   2HG1  ILE  15          HG11      ILE  15  -8.068   3.695  -6.038
  112   1HG2  ILE  15          HG23      ILE  15  -6.989   5.560  -7.614
  113   2HG2  ILE  15          HG22      ILE  15  -8.678   6.038  -7.777
  114   3HG2  ILE  15          HG21      ILE  15  -7.472   7.224  -7.279
  115   1HD1  ILE  15          HD12      ILE  15  -8.419   4.575  -3.559
  116   2HD1  ILE  15          HD11      ILE  15 -10.114   4.587  -4.043
  117   3HD1  ILE  15          HD13      ILE  15  -9.190   3.086  -4.102
  118    H    LYS  16           HN       LYS  16  -6.439   8.247  -5.272
  119    HA   LYS  16           HA       LYS  16  -4.669   8.308  -7.528
  120   1HB   LYS  16           HB2      LYS  16  -5.234  10.407  -5.416
  121   2HB   LYS  16           HB1      LYS  16  -4.375  10.709  -6.928
  122   1HG   LYS  16           HG2      LYS  16  -6.417   9.766  -8.130
  123   2HG   LYS  16           HG1      LYS  16  -7.253   9.845  -6.579
  124   1HD   LYS  16           HD2      LYS  16  -5.832  12.246  -7.733
  125   2HD   LYS  16           HD1      LYS  16  -7.507  11.873  -8.146
  126   1HE   LYS  16           HE2      LYS  16  -7.852  11.704  -5.565
  127   2HE   LYS  16           HE1      LYS  16  -6.346  12.618  -5.470
  128   1HZ   LYS  16           HZ3      LYS  16  -8.250  13.649  -7.376
  129   2HZ   LYS  16           HZ2      LYS  16  -8.784  13.709  -5.764
  130   3HZ   LYS  16           HZ1      LYS  16  -7.330  14.467  -6.209
  131    H    THR  17           HN       THR  17  -4.070   8.415  -4.033
  132    HA   THR  17           HA       THR  17  -1.260   9.011  -4.269
  133    HB   THR  17           HB       THR  17  -2.596   7.537  -1.992
  134    HG1  THR  17           HG1      THR  17  -2.273  10.259  -1.843
  135   1HG2  THR  17          HG21      THR  17  -0.028   7.859  -2.198
  136   2HG2  THR  17          HG23      THR  17  -0.368   9.555  -1.853
  137   3HG2  THR  17          HG22      THR  17  -0.804   8.312  -0.680
  138    H    LEU  18           HN       LEU  18  -3.010   5.917  -3.803
  139    HA   LEU  18           HA       LEU  18  -0.741   4.250  -3.676
  140   1HB   LEU  18           HB2      LEU  18  -3.013   3.400  -3.226
  141   2HB   LEU  18           HB1      LEU  18  -3.435   3.620  -4.923
  142    HG   LEU  18           HG       LEU  18  -2.029   1.864  -5.632
  143   1HD1  LEU  18          HD11      LEU  18  -0.604   2.374  -3.038
  144   2HD1  LEU  18          HD13      LEU  18  -0.470   0.786  -3.791
  145   3HD1  LEU  18          HD12      LEU  18   0.064   2.220  -4.663
  146   1HD2  LEU  18          HD21      LEU  18  -3.797   1.380  -3.443
  147   2HD2  LEU  18          HD23      LEU  18  -3.351   0.285  -4.748
  148   3HD2  LEU  18          HD22      LEU  18  -2.406   0.319  -3.263
  149    H    ASN  19           HN       ASN  19  -2.549   5.426  -6.504
  150    HA   ASN  19           HA       ASN  19  -1.025   4.027  -8.478
  151   1HB   ASN  19           HB2      ASN  19  -3.042   4.985  -9.247
  152   2HB   ASN  19           HB1      ASN  19  -2.672   6.553  -8.528
  153   1HD2  ASN  19          HD22      ASN  19  -1.337   7.676 -11.580
  154   2HD2  ASN  19          HD21      ASN  19  -2.279   8.008 -10.206
  155    H    SER  20           HN       SER  20  -0.468   7.058  -6.761
  156    HA   SER  20           HA       SER  20   1.640   8.045  -8.430
  157   1HB   SER  20           HB2      SER  20   0.353   8.857  -6.059
  158   2HB   SER  20           HB1      SER  20   2.059   8.708  -5.645
  159    HG   SER  20           HG       SER  20   2.495  10.342  -6.905
  160    H    LEU  21           HN       LEU  21   1.643   5.780  -5.695
  161    HA   LEU  21           HA       LEU  21   4.497   5.674  -5.391
  162   1HB   LEU  21           HB2      LEU  21   2.181   4.048  -4.503
  163   2HB   LEU  21           HB1      LEU  21   3.722   3.193  -4.598
  164    HG   LEU  21           HG       LEU  21   3.958   5.852  -3.383
  165   1HD1  LEU  21          HD12      LEU  21   1.620   4.828  -2.685
  166   2HD1  LEU  21          HD11      LEU  21   2.615   3.802  -1.653
  167   3HD1  LEU  21          HD13      LEU  21   2.670   5.555  -1.469
  168   1HD2  LEU  21          HD21      LEU  21   4.837   3.022  -2.874
  169   2HD2  LEU  21          HD23      LEU  21   5.821   4.464  -3.126
  170   3HD2  LEU  21          HD22      LEU  21   4.993   4.219  -1.589
  171    H    THR  22           HN       THR  22   2.330   4.235  -7.723
  172    HA   THR  22           HA       THR  22   3.890   2.025  -8.570
  173    HB   THR  22           HB       THR  22   2.304   3.783 -10.448
  174    HG1  THR  22           HG1      THR  22   1.042   1.691  -9.184
  175   1HG2  THR  22          HG23      THR  22   3.686   1.730 -11.189
  176   2HG2  THR  22          HG22      THR  22   2.473   0.774 -10.340
  177   3HG2  THR  22          HG21      THR  22   1.997   1.799 -11.694
  178    H    GLU  23           HN       GLU  23   4.390   5.445  -9.066
  179    HA   GLU  23           HA       GLU  23   5.978   5.416 -11.400
  180   1HB   GLU  23           HB2      GLU  23   5.287   7.508 -10.366
  181   2HB   GLU  23           HB1      GLU  23   6.236   7.143  -8.924
  182   1HG   GLU  23           HG2      GLU  23   8.240   7.622  -9.949
  183   2HG   GLU  23           HG1      GLU  23   7.674   7.099 -11.536
  184    H    GLN  24           HN       GLN  24   7.064   5.110  -8.009
  185    HA   GLN  24           HA       GLN  24   9.727   4.229  -8.981
  186   1HB   GLN  24           HB2      GLN  24   9.418   5.924  -7.094
  187   2HB   GLN  24           HB1      GLN  24   8.844   4.575  -6.111
  188   1HG   GLN  24           HG2      GLN  24  10.997   4.116  -5.630
  189   2HG   GLN  24           HG1      GLN  24  11.201   3.640  -7.316
  190   1HE2  GLN  24          HE22      GLN  24  12.869   6.663  -8.243
  191   2HE2  GLN  24          HE21      GLN  24  11.997   5.334  -8.839
  192    H    LYS  25           HN       LYS  25   7.883   2.351  -9.647
  193    HA   LYS  25           HA       LYS  25   8.096   0.291  -7.500
  194   1HB   LYS  25           HB2      LYS  25   5.959   1.026  -9.286
  195   2HB   LYS  25           HB1      LYS  25   6.410  -0.654  -9.573
  196   1HG   LYS  25           HG2      LYS  25   4.683  -0.447  -7.801
  197   2HG   LYS  25           HG1      LYS  25   6.178  -1.154  -7.189
  198   1HD   LYS  25           HD2      LYS  25   6.375   1.693  -6.967
  199   2HD   LYS  25           HD1      LYS  25   4.841   1.186  -6.262
  200   1HE   LYS  25           HE2      LYS  25   6.008  -0.475  -4.874
  201   2HE   LYS  25           HE1      LYS  25   7.547  -0.007  -5.596
  202   1HZ   LYS  25           HZ3      LYS  25   6.416   2.339  -4.740
  203   2HZ   LYS  25           HZ2      LYS  25   6.096   1.235  -3.488
  204   3HZ   LYS  25           HZ1      LYS  25   7.694   1.504  -4.000
  205    H    THR  26           HN       THR  26  10.393   0.065  -8.241
  206    HA   THR  26           HA       THR  26  10.608  -2.139 -10.145
  207    HB   THR  26           HB       THR  26  11.928   0.526 -10.760
  208    HG1  THR  26           HG1      THR  26  10.631  -0.430 -12.805
  209   1HG2  THR  26          HG21      THR  26  12.199  -2.209 -12.032
  210   2HG2  THR  26          HG23      THR  26  12.781  -0.717 -12.773
  211   3HG2  THR  26          HG22      THR  26  13.471  -1.272 -11.248
  212    H    LEU  27           HN       LEU  27  12.574   0.415  -8.591
  213    HA   LEU  27           HA       LEU  27  14.646  -1.569  -7.904
  214   1HB   LEU  27           HB2      LEU  27  14.965   0.954  -8.585
  215   2HB   LEU  27           HB1      LEU  27  14.594   1.265  -6.889
  216    HG   LEU  27           HG       LEU  27  16.612  -0.849  -7.528
  217   1HD1  LEU  27          HD13      LEU  27  16.847   1.776  -8.545
  218   2HD1  LEU  27          HD12      LEU  27  17.884   1.714  -7.120
  219   3HD1  LEU  27          HD11      LEU  27  18.119   0.560  -8.433
  220   1HD2  LEU  27          HD22      LEU  27  15.987   1.090  -5.315
  221   2HD2  LEU  27          HD21      LEU  27  16.200  -0.659  -5.230
  222   3HD2  LEU  27          HD23      LEU  27  17.602   0.392  -5.436
  223    H    CYS  28           HN       CYS  28  12.298   0.514  -6.217
  224    HA   CYS  28           HA       CYS  28  13.000  -0.587  -3.612
  225   1HB   CYS  28           HB2      CYS  28  11.525   1.625  -4.536
  226   2HB   CYS  28           HB1      CYS  28  10.363   0.603  -3.690
  227    H    THR  29           HN       THR  29  11.224  -1.808  -6.227
  228    HA   THR  29           HA       THR  29   9.334  -3.336  -4.558
  229    HB   THR  29           HB       THR  29   8.478  -4.187  -6.666
  230    HG1  THR  29           HG1      THR  29   9.665  -4.201  -8.404
  231   1HG2  THR  29          HG21      THR  29   9.212  -1.253  -6.819
  232   2HG2  THR  29          HG23      THR  29   7.957  -2.031  -7.784
  233   3HG2  THR  29          HG22      THR  29   7.787  -1.933  -6.032
  234    H    GLU  30           HN       GLU  30  12.516  -3.627  -4.878
  235    HA   GLU  30           HA       GLU  30  12.632  -6.495  -5.551
  236   1HB   GLU  30           HB2      GLU  30  15.046  -6.207  -5.420
  237   2HB   GLU  30           HB1      GLU  30  14.377  -4.866  -6.352
  238   1HG   GLU  30           HG2      GLU  30  14.278  -3.623  -4.067
  239   2HG   GLU  30           HG1      GLU  30  15.412  -4.857  -3.524
  240    H    LEU  31           HN       LEU  31  11.086  -5.941  -3.263
  241    HA   LEU  31           HA       LEU  31  12.745  -7.188  -1.136
  242   1HB   LEU  31           HB2      LEU  31  10.650  -5.039  -0.655
  243   2HB   LEU  31           HB1      LEU  31  11.654  -5.818   0.564
  244    HG   LEU  31           HG       LEU  31  13.281  -4.659  -1.553
  245   1HD1  LEU  31          HD12      LEU  31  11.045  -3.174  -1.232
  246   2HD1  LEU  31          HD11      LEU  31  12.016  -2.534   0.093
  247   3HD1  LEU  31          HD13      LEU  31  12.624  -2.463  -1.561
  248   1HD2  LEU  31          HD21      LEU  31  13.856  -5.385   0.857
  249   2HD2  LEU  31          HD23      LEU  31  14.538  -3.860   0.292
  250   3HD2  LEU  31          HD22      LEU  31  13.129  -3.856   1.353
  251    H    THR  32           HN       THR  32  11.790  -9.190  -1.629
  252    HA   THR  32           HA       THR  32   9.183  -9.858  -2.255
  253    HB   THR  32           HB       THR  32   9.625 -11.987  -0.858
  254    HG1  THR  32           HG1      THR  32  11.312 -10.528   0.305
  255   1HG2  THR  32          HG22      THR  32  10.377 -11.225  -3.361
  256   2HG2  THR  32          HG21      THR  32  11.946 -11.601  -2.650
  257   3HG2  THR  32          HG23      THR  32  10.683 -12.829  -2.694
  258    H    VAL  33           HN       VAL  33   7.243 -10.137  -1.158
  259    HA   VAL  33           HA       VAL  33   7.171  -9.586   1.761
  260    HB   VAL  33           HB       VAL  33   5.300  -7.990   1.444
  261   1HG1  VAL  33          HG13      VAL  33   7.923  -7.436   1.258
  262   2HG1  VAL  33          HG12      VAL  33   7.417  -6.885  -0.339
  263   3HG1  VAL  33          HG11      VAL  33   6.688  -6.188   1.108
  264   1HG2  VAL  33          HG23      VAL  33   4.565  -8.934  -0.761
  265   2HG2  VAL  33          HG22      VAL  33   4.736  -7.179  -0.785
  266   3HG2  VAL  33          HG21      VAL  33   5.983  -8.196  -1.507
  267    H    THR  34           HN       THR  34   4.750  -9.961   2.493
  268    HA   THR  34           HA       THR  34   4.044 -12.630   1.696
  269    HB   THR  34           HB       THR  34   3.326 -10.837   3.757
  270    HG1  THR  34           HG1      THR  34   3.722 -13.082   3.907
  271   1HG2  THR  34          HG21      THR  34   1.412 -10.140   2.317
  272   2HG2  THR  34          HG23      THR  34   0.870 -11.820   2.276
  273   3HG2  THR  34          HG22      THR  34   0.895 -10.935   3.802
  274    H    ASP  35           HN       ASP  35   2.072 -13.293   0.585
  275    HA   ASP  35           HA       ASP  35   1.195 -11.284  -1.443
  276   1HB   ASP  35           HB2      ASP  35   2.304 -13.460  -2.199
  277   2HB   ASP  35           HB1      ASP  35   0.868 -14.291  -1.602
  278    H    ILE  36           HN       ILE  36  -0.351 -10.416   0.145
  279    HA   ILE  36           HA       ILE  36  -2.382 -11.996   1.380
  280    HB   ILE  36           HB       ILE  36  -3.513  -9.898   1.819
  281   1HG1  ILE  36          HG12      ILE  36  -1.635  -8.728  -0.263
  282   2HG1  ILE  36          HG11      ILE  36  -3.372  -8.960  -0.464
  283   1HG2  ILE  36          HG21      ILE  36  -1.184 -10.473   2.841
  284   2HG2  ILE  36          HG23      ILE  36  -0.588  -9.173   1.808
  285   3HG2  ILE  36          HG22      ILE  36  -1.806  -8.835   3.038
  286   1HD1  ILE  36          HD13      ILE  36  -3.786  -7.446   1.453
  287   2HD1  ILE  36          HD12      ILE  36  -2.049  -7.188   1.613
  288   3HD1  ILE  36          HD11      ILE  36  -2.894  -6.633   0.168
  289    H    PHE  37           HN       PHE  37  -2.017 -11.169  -1.940
  290    HA   PHE  37           HA       PHE  37  -4.936 -11.423  -2.423
  291   1HB   PHE  37           HB2      PHE  37  -2.723 -10.915  -4.431
  292   2HB   PHE  37           HB1      PHE  37  -4.457 -10.731  -4.696
  293    HD1  PHE  37           HD2      PHE  37  -5.706  -9.090  -3.076
  294    HD2  PHE  37           HD1      PHE  37  -1.461  -9.071  -3.732
  295    HE1  PHE  37           HE2      PHE  37  -5.588  -6.757  -2.243
  296    HE2  PHE  37           HE1      PHE  37  -1.343  -6.736  -2.901
  297    HZ   PHE  37           HZ       PHE  37  -3.409  -5.581  -2.156
  298    H    ALA  38           HN       ALA  38  -3.439 -13.722  -1.470
  299    HA   ALA  38           HA       ALA  38  -3.563 -15.467  -3.898
  300   1HB   ALA  38           HB2      ALA  38  -1.422 -15.104  -2.201
  301   2HB   ALA  38           HB1      ALA  38  -2.176 -16.557  -1.549
  302   3HB   ALA  38           HB3      ALA  38  -1.663 -16.512  -3.235
  303    H    ALA  39           HN       ALA  39  -4.649 -15.013  -0.589
  304    HA   ALA  39           HA       ALA  39  -6.423 -17.395  -0.947
  305   1HB   ALA  39           HB3      ALA  39  -4.546 -17.719   0.744
  306   2HB   ALA  39           HB2      ALA  39  -5.318 -16.463   1.713
  307   3HB   ALA  39           HB1      ALA  39  -6.177 -17.965   1.368
  308    H    SER  40           HN       SER  40  -7.559 -15.208  -1.822
  309    HA   SER  40           HA       SER  40  -9.275 -14.281   0.441
  310   1HB   SER  40           HB2      SER  40  -7.763 -12.675  -1.562
  311   2HB   SER  40           HB1      SER  40  -9.386 -12.124  -1.156
  312    HG   SER  40           HG       SER  40  -7.686 -12.899   0.922
  313    H    LYS  41           HN       LYS  41 -11.409 -14.607   0.034
  314    HA   LYS  41           HA       LYS  41 -12.283 -14.808  -2.814
  315   1HB   LYS  41           HB2      LYS  41 -13.082 -16.662  -0.551
  316   2HB   LYS  41           HB1      LYS  41 -13.752 -16.701  -2.182
  317   1HG   LYS  41           HG2      LYS  41 -11.672 -17.354  -3.134
  318   2HG   LYS  41           HG1      LYS  41 -10.785 -16.944  -1.665
  319   1HD   LYS  41           HD2      LYS  41 -10.940 -19.255  -1.449
  320   2HD   LYS  41           HD1      LYS  41 -12.379 -18.742  -0.567
  321   1HE   LYS  41           HE2      LYS  41 -12.805 -19.044  -3.464
  322   2HE   LYS  41           HE1      LYS  41 -12.379 -20.547  -2.644
  323   1HZ   LYS  41           HZ1      LYS  41 -14.132 -19.652  -0.928
  324   2HZ   LYS  41           HZ3      LYS  41 -14.724 -18.836  -2.292
  325   3HZ   LYS  41           HZ2      LYS  41 -14.610 -20.530  -2.302
  326    H    ASP  42           HN       ASP  42 -12.582 -12.936  -0.213
  327    HA   ASP  42           HA       ASP  42 -15.083 -11.810  -0.977
  328   1HB   ASP  42           HB2      ASP  42 -16.247 -12.442   1.274
  329   2HB   ASP  42           HB1      ASP  42 -16.278 -13.607  -0.050
  330    H    THR  43           HN       THR  43 -12.643 -10.667  -0.473
  331    HA   THR  43           HA       THR  43 -12.775  -9.538   2.271
  332    HB   THR  43           HB       THR  43 -10.588  -8.415   1.480
  333    HG1  THR  43           HG1      THR  43 -10.957  -8.796  -0.740
  334   1HG2  THR  43          HG22      THR  43 -11.026 -11.357   1.900
  335   2HG2  THR  43          HG21      THR  43  -9.402 -10.745   1.589
  336   3HG2  THR  43          HG23      THR  43 -10.304 -10.174   2.992
  337    H    THR  44           HN       THR  44 -13.472  -7.465   2.636
  338    HA   THR  44           HA       THR  44 -14.543  -5.953   0.347
  339    HB   THR  44           HB       THR  44 -15.326  -4.387   2.189
  340    HG1  THR  44           HG1      THR  44 -15.196  -5.543   4.298
  341   1HG2  THR  44          HG22      THR  44 -16.247  -6.952   1.433
  342   2HG2  THR  44          HG21      THR  44 -16.431  -6.856   3.184
  343   3HG2  THR  44          HG23      THR  44 -17.188  -5.645   2.150
  344    H    GLU  45           HN       GLU  45 -14.150  -3.353   0.850
  345    HA   GLU  45           HA       GLU  45 -11.343  -2.969   0.235
  346   1HB   GLU  45           HB2      GLU  45 -11.914  -0.540   0.287
  347   2HB   GLU  45           HB1      GLU  45 -13.015  -1.471  -0.730
  348   1HG   GLU  45           HG2      GLU  45 -14.175  -1.605   1.802
  349   2HG   GLU  45           HG1      GLU  45 -13.583   0.052   1.695
  350    H    LYS  46           HN       LYS  46 -13.266  -2.796   3.157
  351    HA   LYS  46           HA       LYS  46 -11.335  -1.268   4.684
  352   1HB   LYS  46           HB2      LYS  46 -13.389  -3.191   5.793
  353   2HB   LYS  46           HB1      LYS  46 -12.703  -1.770   6.580
  354   1HG   LYS  46           HG2      LYS  46 -13.716  -0.409   4.653
  355   2HG   LYS  46           HG1      LYS  46 -14.640  -1.862   4.265
  356   1HD   LYS  46           HD2      LYS  46 -15.739  -1.851   6.381
  357   2HD   LYS  46           HD1      LYS  46 -14.620  -0.655   7.037
  358   1HE   LYS  46           HE2      LYS  46 -16.313  -0.009   4.631
  359   2HE   LYS  46           HE1      LYS  46 -16.970   0.150   6.259
  360   1HZ   LYS  46           HZ3      LYS  46 -14.344   1.305   5.871
  361   2HZ   LYS  46           HZ2      LYS  46 -15.593   2.064   5.005
  362   3HZ   LYS  46           HZ1      LYS  46 -15.692   1.922   6.696
  363    H    GLU  47           HN       GLU  47 -12.148  -4.753   4.584
  364    HA   GLU  47           HA       GLU  47 -10.086  -5.550   6.400
  365   1HB   GLU  47           HB2      GLU  47 -11.747  -6.957   4.333
  366   2HB   GLU  47           HB1      GLU  47 -10.391  -7.805   5.074
  367   1HG   GLU  47           HG2      GLU  47 -11.305  -7.524   7.276
  368   2HG   GLU  47           HG1      GLU  47 -12.529  -6.398   6.690
  369    H    THR  48           HN       THR  48 -10.155  -5.773   2.819
  370    HA   THR  48           HA       THR  48  -7.498  -6.675   2.490
  371    HB   THR  48           HB       THR  48  -9.310  -5.023   0.733
  372    HG1  THR  48           HG1      THR  48  -9.238  -7.013  -0.444
  373   1HG2  THR  48          HG22      THR  48  -6.464  -5.908   0.256
  374   2HG2  THR  48          HG21      THR  48  -7.582  -5.613  -1.076
  375   3HG2  THR  48          HG23      THR  48  -7.163  -4.304   0.029
  376    H    PHE  49           HN       PHE  49  -8.715  -3.395   2.999
  377    HA   PHE  49           HA       PHE  49  -6.244  -2.060   2.335
  378   1HB   PHE  49           HB2      PHE  49  -8.761  -1.317   3.777
  379   2HB   PHE  49           HB1      PHE  49  -7.354  -0.271   3.949
  380    HD1  PHE  49           HD1      PHE  49  -8.262  -2.294   0.953
  381    HD2  PHE  49           HD2      PHE  49  -8.032   1.632   2.685
  382    HE1  PHE  49           HE1      PHE  49  -8.755  -1.291  -1.258
  383    HE2  PHE  49           HE2      PHE  49  -8.523   2.634   0.469
  384    HZ   PHE  49           HZ       PHE  49  -8.890   1.170  -1.499
  385    H    CYS  50           HN       CYS  50  -7.521  -3.493   5.298
  386    HA   CYS  50           HA       CYS  50  -5.517  -2.346   7.044
  387   1HB   CYS  50           HB2      CYS  50  -7.700  -3.252   7.843
  388   2HB   CYS  50           HB1      CYS  50  -7.153  -4.873   7.421
  389    NH1  ARG  51           NH2      ARG  51  -8.987  -9.526   5.948
  390    NH2  ARG  51           NH1      ARG  51  -8.491 -10.977   7.608
  391    H    ARG  51           HN       ARG  51  -5.847  -5.590   5.553
  392    HA   ARG  51           HA       ARG  51  -3.462  -6.703   6.587
  393   1HB   ARG  51           HB2      ARG  51  -5.185  -7.216   4.207
  394   2HB   ARG  51           HB1      ARG  51  -3.571  -7.930   4.204
  395   1HG   ARG  51           HG2      ARG  51  -4.247  -9.526   5.634
  396   2HG   ARG  51           HG1      ARG  51  -4.732  -8.296   6.802
  397   1HD   ARG  51           HD2      ARG  51  -6.893  -8.043   5.554
  398   2HD   ARG  51           HD1      ARG  51  -6.410  -9.391   4.525
  399    HE   ARG  51           HE       ARG  51  -6.166 -10.388   7.103
  400   1HH1  ARG  51          HH21      ARG  51  -8.704  -8.880   5.241
  401   2HH1  ARG  51          HH22      ARG  51  -9.959  -9.713   6.090
  402   1HH2  ARG  51          HH11      ARG  51  -7.817 -11.447   8.180
  403   2HH2  ARG  51          HH12      ARG  51  -9.467 -11.151   7.739
  404    H    ALA  52           HN       ALA  52  -3.939  -5.105   3.415
  405    HA   ALA  52           HA       ALA  52  -1.165  -5.108   2.725
  406   1HB   ALA  52           HB2      ALA  52  -3.096  -4.673   1.149
  407   2HB   ALA  52           HB1      ALA  52  -3.215  -3.059   1.850
  408   3HB   ALA  52           HB3      ALA  52  -1.751  -3.543   0.994
  409    H    ALA  53           HN       ALA  53  -3.065  -3.035   4.811
  410    HA   ALA  53           HA       ALA  53  -1.235  -0.800   4.830
  411   1HB   ALA  53           HB2      ALA  53  -3.542  -1.716   6.485
  412   2HB   ALA  53           HB1      ALA  53  -2.414  -0.587   7.238
  413   3HB   ALA  53           HB3      ALA  53  -3.242  -0.143   5.746
  414    H    THR  54           HN       THR  54  -1.404  -3.851   6.580
  415    HA   THR  54           HA       THR  54   0.548  -3.165   8.599
  416    HB   THR  54           HB       THR  54  -0.584  -5.740   7.517
  417    HG1  THR  54           HG1      THR  54  -0.459  -4.521  10.073
  418   1HG2  THR  54          HG23      THR  54   1.802  -5.408   9.344
  419   2HG2  THR  54          HG22      THR  54   0.837  -6.884   9.295
  420   3HG2  THR  54          HG21      THR  54   1.703  -6.348   7.855
  421    H    VAL  55           HN       VAL  55   0.709  -4.941   5.516
  422    HA   VAL  55           HA       VAL  55   3.541  -5.324   5.523
  423    HB   VAL  55           HB       VAL  55   1.610  -5.038   3.199
  424   1HG1  VAL  55          HG12      VAL  55   4.498  -5.908   3.378
  425   2HG1  VAL  55          HG11      VAL  55   3.454  -6.420   2.053
  426   3HG1  VAL  55          HG13      VAL  55   3.786  -4.707   2.302
  427   1HG2  VAL  55          HG22      VAL  55   1.591  -6.954   5.120
  428   2HG2  VAL  55          HG21      VAL  55   1.151  -7.271   3.442
  429   3HG2  VAL  55          HG23      VAL  55   2.776  -7.648   4.013
  430    H    LEU  56           HN       LEU  56   1.539  -2.548   4.822
  431    HA   LEU  56           HA       LEU  56   3.582  -1.068   3.383
  432   1HB   LEU  56           HB2      LEU  56   0.846  -0.567   4.399
  433   2HB   LEU  56           HB1      LEU  56   1.896   0.849   4.337
  434    HG   LEU  56           HG       LEU  56   2.292  -0.645   1.933
  435   1HD1  LEU  56          HD11      LEU  56  -0.488  -0.589   2.919
  436   2HD1  LEU  56          HD13      LEU  56  -0.281   0.038   1.284
  437   3HD1  LEU  56          HD12      LEU  56   0.245  -1.600   1.674
  438   1HD2  LEU  56          HD22      LEU  56   1.191   2.041   2.721
  439   2HD2  LEU  56          HD21      LEU  56   2.689   1.662   1.871
  440   3HD2  LEU  56          HD23      LEU  56   1.144   1.525   1.035
  441    NH1  ARG  57           NH2      ARG  57   5.609  -1.943  13.641
  442    NH2  ARG  57           NH1      ARG  57   5.339   0.007  14.751
  443    H    ARG  57           HN       ARG  57   2.567  -1.430   6.734
  444    HA   ARG  57           HA       ARG  57   4.000   0.757   7.864
  445   1HB   ARG  57           HB2      ARG  57   2.343  -0.931   8.990
  446   2HB   ARG  57           HB1      ARG  57   3.785  -1.913   9.252
  447   1HG   ARG  57           HG2      ARG  57   4.343   0.824   9.969
  448   2HG   ARG  57           HG1      ARG  57   2.894   0.277  10.811
  449   1HD   ARG  57           HD2      ARG  57   4.191  -1.804  11.469
  450   2HD   ARG  57           HD1      ARG  57   5.636  -1.008  10.843
  451    HE   ARG  57           HE       ARG  57   4.550   0.852  12.589
  452   1HH1  ARG  57          HH21      ARG  57   5.550  -2.486  12.805
  453   2HH1  ARG  57          HH22      ARG  57   5.946  -2.364  14.482
  454   1HH2  ARG  57          HH11      ARG  57   5.069   0.970  14.763
  455   2HH2  ARG  57          HH12      ARG  57   5.678  -0.429  15.585
  456    H    GLN  58           HN       GLN  58   4.949  -2.590   7.130
  457    HA   GLN  58           HA       GLN  58   7.675  -2.253   8.072
  458   1HB   GLN  58           HB2      GLN  58   6.061  -4.362   6.936
  459   2HB   GLN  58           HB1      GLN  58   7.613  -4.283   6.102
  460   1HG   GLN  58           HG2      GLN  58   8.474  -4.003   8.640
  461   2HG   GLN  58           HG1      GLN  58   7.018  -4.954   8.938
  462   1HE2  GLN  58          HE22      GLN  58   8.636  -7.914   7.975
  463   2HE2  GLN  58          HE21      GLN  58   7.488  -7.147   8.964
  464    H    PHE  59           HN       PHE  59   5.977  -1.536   5.108
  465    HA   PHE  59           HA       PHE  59   8.148  -1.461   3.278
  466   1HB   PHE  59           HB2      PHE  59   5.522  -1.084   3.022
  467   2HB   PHE  59           HB1      PHE  59   5.994   0.609   3.131
  468    HD1  PHE  59           HD2      PHE  59   8.484   0.848   1.733
  469    HD2  PHE  59           HD1      PHE  59   5.134  -1.681   0.811
  470    HE1  PHE  59           HE2      PHE  59   9.182   0.789  -0.644
  471    HE2  PHE  59           HE1      PHE  59   5.832  -1.735  -1.567
  472    HZ   PHE  59           HZ       PHE  59   7.855  -0.500  -2.294
  473    OH   TYR  60           OH       TYR  60   5.846   4.499  10.811
  474    H    TYR  60           HN       TYR  60   6.735   1.247   5.171
  475    HA   TYR  60           HA       TYR  60   9.089   2.899   4.508
  476   1HB   TYR  60           HB2      TYR  60   7.781   4.699   4.991
  477   2HB   TYR  60           HB1      TYR  60   6.472   3.534   4.790
  478    HD1  TYR  60           HD2      TYR  60   5.461   2.423   6.773
  479    HD2  TYR  60           HD1      TYR  60   8.354   5.574   7.160
  480    HE1  TYR  60           HE2      TYR  60   4.807   2.732   9.145
  481    HE2  TYR  60           HE1      TYR  60   7.700   5.884   9.532
  482    HH   TYR  60           HH       TYR  60   5.189   3.832  11.026
  483    H    SER  61           HN       SER  61   8.280   0.756   7.042
  484    HA   SER  61           HA       SER  61   9.771   2.332   9.049
  485   1HB   SER  61           HB2      SER  61   9.031   0.772  10.660
  486   2HB   SER  61           HB1      SER  61   7.669   0.936   9.558
  487    HG   SER  61           HG       SER  61   9.527  -1.157   9.839
  488    H    HIS  62           HN       HIS  62  10.047  -0.936   7.607
  489    HA   HIS  62           HA       HIS  62  12.835  -1.088   8.552
  490   1HB   HIS  62           HB2      HIS  62  10.766  -2.975   7.714
  491   2HB   HIS  62           HB1      HIS  62  12.340  -3.346   7.011
  492    HD1  HIS  62           HD1      HIS  62  10.682  -4.700   9.573
  493    HD2  HIS  62           HD2      HIS  62  14.210  -2.478   9.625
  494    HE1  HIS  62           HE1      HIS  62  11.880  -5.308  11.720
  495    H    HIS  63           HN       HIS  63  11.119  -1.297   5.408
  496    HA   HIS  63           HA       HIS  63  13.703  -1.051   3.997
  497   1HB   HIS  63           HB2      HIS  63  10.952  -1.153   2.750
  498   2HB   HIS  63           HB1      HIS  63  12.496  -1.583   2.013
  499    HD1  HIS  63           HD1      HIS  63  13.789  -3.533   3.717
  500    HD2  HIS  63           HD2      HIS  63   9.630  -3.465   3.445
  501    HE1  HIS  63           HE1      HIS  63  12.985  -5.815   4.467
  502    H    GLU  64           HN       GLU  64  12.939   1.280   5.520
  503    HA   GLU  64           HA       GLU  64  11.944   3.202   3.508
  504   1HB   GLU  64           HB2      GLU  64  11.170   4.256   5.334
  505   2HB   GLU  64           HB1      GLU  64  11.946   3.056   6.364
  506   1HG   GLU  64           HG2      GLU  64  14.048   4.346   6.302
  507   2HG   GLU  64           HG1      GLU  64  13.286   5.545   5.252
  508    H    LYS  65           HN       LYS  65  14.906   2.385   5.254
  509    HA   LYS  65           HA       LYS  65  16.436   3.934   3.246
  510   1HB   LYS  65           HB2      LYS  65  15.864   5.188   5.556
  511   2HB   LYS  65           HB1      LYS  65  17.288   4.287   6.078
  512   1HG   LYS  65           HG2      LYS  65  17.973   5.303   3.557
  513   2HG   LYS  65           HG1      LYS  65  17.123   6.625   4.355
  514   1HD   LYS  65           HD2      LYS  65  18.963   7.053   5.571
  515   2HD   LYS  65           HD1      LYS  65  18.847   5.448   6.292
  516   1HE   LYS  65           HE2      LYS  65  20.436   4.559   4.904
  517   2HE   LYS  65           HE1      LYS  65  19.958   5.569   3.540
  518   1HZ   LYS  65           HZ1      LYS  65  21.034   7.070   5.733
  519   2HZ   LYS  65           HZ3      LYS  65  22.142   5.953   5.100
  520   3HZ   LYS  65           HZ2      LYS  65  21.437   7.118   4.083
  521    H    ASP  66           HN       ASP  66  16.094   1.077   3.779
  522    HA   ASP  66           HA       ASP  66  18.498   0.158   5.154
  523   1HB   ASP  66           HB2      ASP  66  16.091  -1.015   4.355
  524   2HB   ASP  66           HB1      ASP  66  17.306  -1.769   3.321
  525    H    THR  67           HN       THR  67  19.763  -1.623   3.658
  526    HA   THR  67           HA       THR  67  21.089   0.016   1.632
  527    HB   THR  67           HB       THR  67  22.439  -2.185   1.349
  528    HG1  THR  67           HG1      THR  67  20.712  -3.382   2.438
  529   1HG2  THR  67          HG23      THR  67  23.227  -0.207   2.599
  530   2HG2  THR  67          HG22      THR  67  22.356  -0.767   4.027
  531   3HG2  THR  67          HG21      THR  67  23.713  -1.702   3.398
  532    NH1  ARG  68           NH2      ARG  68  18.844  -7.534   1.325
  533    NH2  ARG  68           NH1      ARG  68  18.902  -7.345   3.574
  534    H    ARG  68           HN       ARG  68  18.583  -2.386   1.640
  535    HA   ARG  68           HA       ARG  68  18.969  -3.425  -1.003
  536   1HB   ARG  68           HB2      ARG  68  16.646  -3.261   0.893
  537   2HB   ARG  68           HB1      ARG  68  16.376  -3.788  -0.770
  538   1HG   ARG  68           HG2      ARG  68  17.868  -5.630  -0.540
  539   2HG   ARG  68           HG1      ARG  68  18.539  -4.994   0.962
  540   1HD   ARG  68           HD2      ARG  68  15.788  -5.208   1.434
  541   2HD   ARG  68           HD1      ARG  68  16.204  -6.679   0.560
  542    HE   ARG  68           HE       ARG  68  16.790  -6.150   3.292
  543   1HH1  ARG  68          HH21      ARG  68  18.388  -7.390   0.451
  544   2HH1  ARG  68          HH22      ARG  68  19.705  -8.042   1.357
  545   1HH2  ARG  68          HH11      ARG  68  18.487  -7.041   4.431
  546   2HH2  ARG  68          HH12      ARG  68  19.758  -7.862   3.588
  547    H    CYS  69           HN       CYS  69  16.501  -1.030   0.058
  548    HA   CYS  69           HA       CYS  69  16.348  -0.054  -2.732
  549   1HB   CYS  69           HB2      CYS  69  14.290  -0.456  -1.295
  550   2HB   CYS  69           HB1      CYS  69  14.785   0.937  -0.335
  551    H    LEU  70           HN       LEU  70  18.827   0.489  -1.346
  552    HA   LEU  70           HA       LEU  70  18.674   3.329  -0.558
  553   1HB   LEU  70           HB2      LEU  70  20.349   1.176   0.134
  554   2HB   LEU  70           HB1      LEU  70  21.365   2.277  -0.798
  555    HG   LEU  70           HG       LEU  70  19.690   2.984   1.629
  556   1HD1  LEU  70          HD12      LEU  70  22.684   2.966   1.137
  557   2HD1  LEU  70          HD11      LEU  70  21.899   3.524   2.614
  558   3HD1  LEU  70          HD13      LEU  70  21.799   1.826   2.148
  559   1HD2  LEU  70          HD21      LEU  70  20.967   4.613  -0.506
  560   2HD2  LEU  70          HD23      LEU  70  19.573   4.983   0.508
  561   3HD2  LEU  70          HD22      LEU  70  21.206   5.172   1.149
  562    H    GLY  71           HN       GLY  71  20.982   1.613  -2.692
  563   1HA   GLY  71           HA2      GLY  71  20.936   2.214  -5.145
  564   2HA   GLY  71           HA1      GLY  71  20.654   3.877  -4.626
  565    H    ALA  72           HN       ALA  72  22.824   3.325  -6.263
  566    HA   ALA  72           HA       ALA  72  25.169   3.286  -4.425
  567   1HB   ALA  72           HB1      ALA  72  24.754   2.016  -6.849
  568   2HB   ALA  72           HB3      ALA  72  25.720   3.420  -7.305
  569   3HB   ALA  72           HB2      ALA  72  26.326   2.287  -6.098
  570    H    THR  73           HN       THR  73  23.504   5.268  -6.835
  571    HA   THR  73           HA       THR  73  25.528   7.365  -6.806
  572    HB   THR  73           HB       THR  73  23.647   8.698  -7.927
  573    HG1  THR  73           HG1      THR  73  21.774   7.757  -8.177
  574   1HG2  THR  73          HG23      THR  73  25.465   7.128  -8.998
  575   2HG2  THR  73          HG22      THR  73  24.080   6.093  -9.348
  576   3HG2  THR  73          HG21      THR  73  24.137   7.735  -9.989
  577    H    ALA  74           HN       ALA  74  24.808   9.661  -6.125
  578    HA   ALA  74           HA       ALA  74  23.861   9.489  -3.341
  579   1HB   ALA  74           HB1      ALA  74  24.888  11.819  -4.989
  580   2HB   ALA  74           HB3      ALA  74  24.471  11.910  -3.279
  581   3HB   ALA  74           HB2      ALA  74  25.805  10.886  -3.807
  582    H    GLN  75           HN       GLN  75  22.726  10.671  -6.455
  583    HA   GLN  75           HA       GLN  75  20.545  12.250  -5.426
  584   1HB   GLN  75           HB2      GLN  75  21.316  11.110  -8.075
  585   2HB   GLN  75           HB1      GLN  75  19.633  11.591  -7.857
  586   1HG   GLN  75           HG2      GLN  75  20.180  13.835  -7.504
  587   2HG   GLN  75           HG1      GLN  75  21.830  13.457  -7.008
  588   1HE2  GLN  75          HE22      GLN  75  23.100  13.840 -10.261
  589   2HE2  GLN  75          HE21      GLN  75  23.403  13.755  -8.593
  590    H    GLN  76           HN       GLN  76  20.947   8.832  -6.154
  591    HA   GLN  76           HA       GLN  76  18.208   8.062  -6.179
  592   1HB   GLN  76           HB2      GLN  76  20.770   6.760  -6.073
  593   2HB   GLN  76           HB1      GLN  76  19.691   6.010  -4.895
  594   1HG   GLN  76           HG2      GLN  76  18.141   5.369  -6.518
  595   2HG   GLN  76           HG1      GLN  76  18.683   6.598  -7.663
  596   1HE2  GLN  76          HE22      GLN  76  20.908   4.390  -9.242
  597   2HE2  GLN  76          HE21      GLN  76  19.974   5.804  -9.324
  598    H    PHE  77           HN       PHE  77  20.327   8.938  -3.533
  599    HA   PHE  77           HA       PHE  77  18.802   7.721  -1.421
  600   1HB   PHE  77           HB2      PHE  77  20.885   8.356  -0.658
  601   2HB   PHE  77           HB1      PHE  77  20.896   9.841  -1.610
  602    HD1  PHE  77           HD1      PHE  77  19.400   8.214   1.387
  603    HD2  PHE  77           HD2      PHE  77  20.114  11.897  -0.704
  604    HE1  PHE  77           HE1      PHE  77  18.601   9.489   3.359
  605    HE2  PHE  77           HE2      PHE  77  19.316  13.172   1.268
  606    HZ   PHE  77           HZ       PHE  77  18.559  11.967   3.299
  607    H    HIS  78           HN       HIS  78  18.899  11.128  -2.542
  608    HA   HIS  78           HA       HIS  78  16.812  12.078  -0.897
  609   1HB   HIS  78           HB2      HIS  78  18.425  13.289  -2.632
  610   2HB   HIS  78           HB1      HIS  78  17.026  13.116  -3.693
  611    HD1  HIS  78           HD1      HIS  78  15.282  13.332  -0.766
  612    HD2  HIS  78           HD2      HIS  78  17.633  16.160  -2.731
  613    HE1  HIS  78           HE1      HIS  78  14.529  15.599   0.075
  614    NH1  ARG  79           NH2      ARG  79  14.815  11.128  -9.633
  615    NH2  ARG  79           NH1      ARG  79  16.037   9.482 -10.577
  616    H    ARG  79           HN       ARG  79  16.624  10.676  -4.169
  617    HA   ARG  79           HA       ARG  79  13.841  10.985  -4.565
  618   1HB   ARG  79           HB2      ARG  79  15.993   9.432  -5.746
  619   2HB   ARG  79           HB1      ARG  79  14.503   8.493  -5.683
  620   1HG   ARG  79           HG2      ARG  79  13.675  11.033  -6.512
  621   2HG   ARG  79           HG1      ARG  79  15.184  10.760  -7.381
  622   1HD   ARG  79           HD2      ARG  79  13.378   8.432  -7.302
  623   2HD   ARG  79           HD1      ARG  79  12.733   9.812  -8.181
  624    HE   ARG  79           HE       ARG  79  14.752   8.010  -9.108
  625   1HH1  ARG  79          HH21      ARG  79  14.097  11.432  -9.011
  626   2HH1  ARG  79          HH22      ARG  79  15.288  11.795 -10.209
  627   1HH2  ARG  79          HH11      ARG  79  16.263   8.512 -10.672
  628   2HH2  ARG  79          HH12      ARG  79  16.496  10.161 -11.150
  629    H    HIS  80           HN       HIS  80  15.630   8.404  -2.897
  630    HA   HIS  80           HA       HIS  80  13.400   6.702  -2.399
  631   1HB   HIS  80           HB2      HIS  80  15.857   6.161  -2.027
  632   2HB   HIS  80           HB1      HIS  80  15.758   7.104  -0.541
  633    HD1  HIS  80           HD1      HIS  80  12.566   5.532  -1.025
  634    HD2  HIS  80           HD2      HIS  80  16.242   4.259   0.469
  635    HE1  HIS  80           HE1      HIS  80  12.103   3.441   0.321
  636    H    LYS  81           HN       LYS  81  14.669   9.499  -0.634
  637    HA   LYS  81           HA       LYS  81  13.135   9.312   1.720
  638   1HB   LYS  81           HB2      LYS  81  14.767  11.257   0.477
  639   2HB   LYS  81           HB1      LYS  81  13.230  12.052   0.822
  640   1HG   LYS  81           HG2      LYS  81  13.623  10.638   3.130
  641   2HG   LYS  81           HG1      LYS  81  15.282  11.035   2.686
  642   1HD   LYS  81           HD2      LYS  81  13.261  13.216   2.474
  643   2HD   LYS  81           HD1      LYS  81  13.753  12.726   4.095
  644   1HE   LYS  81           HE2      LYS  81  16.182  12.859   2.987
  645   2HE   LYS  81           HE1      LYS  81  15.361  14.009   1.931
  646   1HZ   LYS  81           HZ3      LYS  81  14.486  14.995   4.109
  647   2HZ   LYS  81           HZ2      LYS  81  15.743  14.128   4.855
  648   3HZ   LYS  81           HZ1      LYS  81  16.097  15.307   3.684
  649    H    GLN  82           HN       GLN  82  12.231  10.625  -1.449
  650    HA   GLN  82           HA       GLN  82   9.704  11.697  -0.704
  651   1HB   GLN  82           HB2      GLN  82  10.995  10.816  -3.232
  652   2HB   GLN  82           HB1      GLN  82   9.233  10.913  -3.248
  653   1HG   GLN  82           HG2      GLN  82   9.581  13.241  -2.135
  654   2HG   GLN  82           HG1      GLN  82  11.234  13.105  -2.738
  655   1HE2  GLN  82          HE22      GLN  82   8.215  13.928  -5.321
  656   2HE2  GLN  82          HE21      GLN  82   7.924  13.711  -3.662
  657    H    LEU  83           HN       LEU  83  10.559   8.436  -1.886
  658    HA   LEU  83           HA       LEU  83   7.945   7.351  -1.931
  659   1HB   LEU  83           HB2      LEU  83  10.045   6.231  -2.774
  660   2HB   LEU  83           HB1      LEU  83  10.457   5.873  -1.097
  661    HG   LEU  83           HG       LEU  83   7.775   5.065  -1.403
  662   1HD1  LEU  83          HD12      LEU  83   8.321   5.207  -3.892
  663   2HD1  LEU  83          HD11      LEU  83   9.475   3.901  -3.620
  664   3HD1  LEU  83          HD13      LEU  83   7.757   3.636  -3.324
  665   1HD2  LEU  83          HD23      LEU  83  10.412   3.573  -1.300
  666   2HD2  LEU  83          HD22      LEU  83   9.325   3.927   0.043
  667   3HD2  LEU  83          HD21      LEU  83   8.848   2.765  -1.195
  668    H    ILE  84           HN       ILE  84  10.191   7.811   0.766
  669    HA   ILE  84           HA       ILE  84   8.777   6.257   2.697
  670    HB   ILE  84           HB       ILE  84  10.333   8.787   3.271
  671   1HG1  ILE  84          HG12      ILE  84  11.821   7.575   1.901
  672   2HG1  ILE  84          HG11      ILE  84  12.249   7.048   3.528
  673   1HG2  ILE  84          HG21      ILE  84   9.651   6.278   4.813
  674   2HG2  ILE  84          HG23      ILE  84  10.952   7.362   5.309
  675   3HG2  ILE  84          HG22      ILE  84   9.291   7.950   5.243
  676   1HD1  ILE  84          HD11      ILE  84  10.467   5.174   3.109
  677   2HD1  ILE  84          HD13      ILE  84  10.712   5.571   1.408
  678   3HD1  ILE  84          HD12      ILE  84  12.068   5.012   2.386
  679    NH1  ARG  85           NH2      ARG  85   7.785  16.657   2.857
  680    NH2  ARG  85           NH1      ARG  85   7.094  16.539   5.004
  681    H    ARG  85           HN       ARG  85   8.445   9.680   1.760
  682    HA   ARG  85           HA       ARG  85   6.534  10.364   3.772
  683   1HB   ARG  85           HB2      ARG  85   7.151  11.494   1.044
  684   2HB   ARG  85           HB1      ARG  85   5.860  12.158   2.046
  685   1HG   ARG  85           HG2      ARG  85   7.671  12.242   3.917
  686   2HG   ARG  85           HG1      ARG  85   8.822  12.101   2.587
  687   1HD   ARG  85           HD2      ARG  85   8.594  14.296   2.165
  688   2HD   ARG  85           HD1      ARG  85   6.880  14.045   1.835
  689    HE   ARG  85           HE       ARG  85   7.029  14.123   4.603
  690   1HH1  ARG  85          HH21      ARG  85   8.024  16.218   1.992
  691   2HH1  ARG  85          HH22      ARG  85   7.839  17.652   2.939
  692   1HH2  ARG  85          HH11      ARG  85   6.799  16.002   5.794
  693   2HH2  ARG  85          HH12      ARG  85   7.152  17.535   5.068
  694    H    PHE  86           HN       PHE  86   5.968   9.573   0.330
  695    HA   PHE  86           HA       PHE  86   3.157   9.500   0.428
  696   1HB   PHE  86           HB2      PHE  86   5.250   8.442  -1.335
  697   2HB   PHE  86           HB1      PHE  86   3.779   7.467  -1.338
  698    HD1  PHE  86           HD1      PHE  86   4.870  11.057  -1.469
  699    HD2  PHE  86           HD2      PHE  86   2.006   8.105  -2.708
  700    HE1  PHE  86           HE1      PHE  86   3.755  12.743  -2.904
  701    HE2  PHE  86           HE2      PHE  86   0.891   9.791  -4.144
  702    HZ   PHE  86           HZ       PHE  86   1.763  12.110  -4.242
  703    H    LEU  87           HN       LEU  87   5.475   7.172   1.635
  704    HA   LEU  87           HA       LEU  87   3.577   4.979   1.861
  705   1HB   LEU  87           HB2      LEU  87   6.272   5.089   1.902
  706   2HB   LEU  87           HB1      LEU  87   5.959   5.076   3.638
  707    HG   LEU  87           HG       LEU  87   6.167   2.782   2.949
  708   1HD1  LEU  87          HD11      LEU  87   4.255   3.418   4.488
  709   2HD1  LEU  87          HD13      LEU  87   3.196   3.351   3.081
  710   3HD1  LEU  87          HD12      LEU  87   4.034   1.898   3.622
  711   1HD2  LEU  87          HD23      LEU  87   5.559   3.495   0.488
  712   2HD2  LEU  87          HD22      LEU  87   5.193   1.859   1.035
  713   3HD2  LEU  87          HD21      LEU  87   3.917   3.076   0.977
  714    H    LYS  88           HN       LYS  88   4.766   7.510   4.046
  715    HA   LYS  88           HA       LYS  88   3.559   6.485   6.429
  716   1HB   LYS  88           HB2      LYS  88   4.255   9.322   5.627
  717   2HB   LYS  88           HB1      LYS  88   3.766   8.844   7.252
  718   1HG   LYS  88           HG2      LYS  88   5.668   7.177   7.238
  719   2HG   LYS  88           HG1      LYS  88   6.212   7.913   5.730
  720   1HD   LYS  88           HD2      LYS  88   6.813   9.909   6.758
  721   2HD   LYS  88           HD1      LYS  88   5.674   9.686   8.087
  722   1HE   LYS  88           HE2      LYS  88   7.770   7.613   7.901
  723   2HE   LYS  88           HE1      LYS  88   8.363   9.230   8.283
  724   1HZ   LYS  88           HZ2      LYS  88   6.382   9.210   9.939
  725   2HZ   LYS  88           HZ1      LYS  88   6.515   7.522   9.799
  726   3HZ   LYS  88           HZ3      LYS  88   7.836   8.432  10.350
  727    NH1  ARG  89           NH2      ARG  89  -0.852  14.430   2.105
  728    NH2  ARG  89           NH1      ARG  89  -0.195  13.739   0.058
  729    H    ARG  89           HN       ARG  89   2.350   8.802   3.992
  730    HA   ARG  89           HA       ARG  89  -0.144   9.268   5.370
  731   1HB   ARG  89           HB2      ARG  89   0.351   9.570   2.402
  732   2HB   ARG  89           HB1      ARG  89  -0.826  10.435   3.391
  733   1HG   ARG  89           HG2      ARG  89   1.476  11.026   4.723
  734   2HG   ARG  89           HG1      ARG  89   2.078  10.909   3.069
  735   1HD   ARG  89           HD2      ARG  89  -0.378  12.522   3.777
  736   2HD   ARG  89           HD1      ARG  89   1.242  13.216   3.800
  737    HE   ARG  89           HE       ARG  89   1.063  12.038   1.301
  738   1HH1  ARG  89          HH21      ARG  89  -0.841  14.344   3.100
  739   2HH1  ARG  89          HH22      ARG  89  -1.392  15.152   1.676
  740   1HH2  ARG  89          HH11      ARG  89   0.327  13.114  -0.523
  741   2HH2  ARG  89          HH12      ARG  89  -0.742  14.467  -0.355
  742    H    LEU  90           HN       LEU  90   0.620   7.308   2.479
  743    HA   LEU  90           HA       LEU  90  -1.968   6.185   2.166
  744   1HB   LEU  90           HB2      LEU  90   0.182   6.063   0.649
  745   2HB   LEU  90           HB1      LEU  90   0.485   4.573   1.544
  746    HG   LEU  90           HG       LEU  90  -2.240   4.476   0.878
  747   1HD1  LEU  90          HD13      LEU  90  -0.613   5.878  -1.174
  748   2HD1  LEU  90          HD12      LEU  90  -1.664   4.587  -1.761
  749   3HD1  LEU  90          HD11      LEU  90  -2.348   5.946  -0.870
  750   1HD2  LEU  90          HD21      LEU  90  -0.454   2.662   0.966
  751   2HD2  LEU  90          HD23      LEU  90  -1.593   2.537  -0.374
  752   3HD2  LEU  90          HD22      LEU  90   0.027   3.177  -0.651
  753    H    ASP  91           HN       ASP  91   0.490   5.478   4.528
  754    HA   ASP  91           HA       ASP  91  -0.346   2.776   5.106
  755   1HB   ASP  91           HB2      ASP  91   1.793   3.253   5.903
  756   2HB   ASP  91           HB1      ASP  91   1.318   4.837   6.519
  757    NH1  ARG  92           NH2      ARG  92  -3.409  10.412  12.259
  758    NH2  ARG  92           NH1      ARG  92  -4.627  11.403  10.635
  759    H    ARG  92           HN       ARG  92  -0.691   5.634   7.229
  760    HA   ARG  92           HA       ARG  92  -2.739   4.441   8.823
  761   1HB   ARG  92           HB2      ARG  92  -1.433   6.298   9.679
  762   2HB   ARG  92           HB1      ARG  92  -2.015   7.352   8.390
  763   1HG   ARG  92           HG2      ARG  92  -4.309   7.167   9.242
  764   2HG   ARG  92           HG1      ARG  92  -3.767   6.059  10.502
  765   1HD   ARG  92           HD2      ARG  92  -3.411   7.867  11.800
  766   2HD   ARG  92           HD1      ARG  92  -2.069   8.273  10.732
  767    HE   ARG  92           HE       ARG  92  -4.289   9.295   9.429
  768   1HH1  ARG  92          HH21      ARG  92  -2.899   9.630  12.612
  769   2HH1  ARG  92          HH22      ARG  92  -3.497  11.238  12.815
  770   1HH2  ARG  92          HH11      ARG  92  -5.053  11.379   9.731
  771   2HH2  ARG  92          HH12      ARG  92  -4.709  12.220  11.205
  772    H    ASN  93           HN       ASN  93  -2.922   5.939   5.700
  773    HA   ASN  93           HA       ASN  93  -5.747   6.665   5.969
  774   1HB   ASN  93           HB2      ASN  93  -3.801   6.632   3.661
  775   2HB   ASN  93           HB1      ASN  93  -5.513   6.992   3.432
  776   1HD2  ASN  93          HD22      ASN  93  -5.216   9.971   5.625
  777   2HD2  ASN  93          HD21      ASN  93  -6.177   8.573   5.575
  778    H    LEU  94           HN       LEU  94  -3.901   3.927   4.754
  779    HA   LEU  94           HA       LEU  94  -6.044   2.709   3.277
  780   1HB   LEU  94           HB2      LEU  94  -3.339   2.058   4.027
  781   2HB   LEU  94           HB1      LEU  94  -4.384   0.667   4.323
  782    HG   LEU  94           HG       LEU  94  -5.355   1.209   1.959
  783   1HD1  LEU  94          HD11      LEU  94  -3.996   3.392   1.917
  784   2HD1  LEU  94          HD13      LEU  94  -2.588   2.374   1.617
  785   3HD1  LEU  94          HD12      LEU  94  -3.927   2.388   0.469
  786   1HD2  LEU  94          HD23      LEU  94  -3.658  -0.661   2.842
  787   2HD2  LEU  94          HD22      LEU  94  -4.019  -0.486   1.125
  788   3HD2  LEU  94          HD21      LEU  94  -2.542   0.209   1.791
  789    CH2  TRP  95           CH2      TRP  95  -5.791   2.015  13.486
  790    H    TRP  95           HN       TRP  95  -4.724   1.754   6.472
  791    HA   TRP  95           HA       TRP  95  -7.164   0.233   7.044
  792   1HB   TRP  95           HB2      TRP  95  -6.004  -0.650   8.841
  793   2HB   TRP  95           HB1      TRP  95  -4.665  -0.208   7.781
  794    HD1  TRP  95           HD1      TRP  95  -3.413   2.106   8.303
  795    HE1  TRP  95           HE1      TRP  95  -3.063   3.363  10.531
  796    HE3  TRP  95           HE3      TRP  95  -7.018  -0.124  11.131
  797    HZ2  TRP  95           HZ2      TRP  95  -4.178   3.408  13.170
  798    HZ3  TRP  95           HZ3      TRP  95  -7.358   0.538  13.494
  799    HH2  TRP  95           HH2      TRP  95  -5.944   2.300  14.517
  800    H    GLY  96           HN       GLY  96  -5.963   3.419   7.701
  801   1HA   GLY  96           HA2      GLY  96  -7.190   4.149  10.095
  802   2HA   GLY  96           HA1      GLY  96  -7.044   5.250   8.726
  803    H    LEU  97           HN       LEU  97  -8.705   3.796   6.909
  804    HA   LEU  97           HA       LEU  97 -11.348   4.530   8.013
  805   1HB   LEU  97           HB2      LEU  97 -10.688   5.253   5.716
  806   2HB   LEU  97           HB1      LEU  97 -10.591   3.558   5.238
  807    HG   LEU  97           HG       LEU  97 -13.093   3.768   6.449
  808   1HD1  LEU  97          HD13      LEU  97 -12.298   6.304   5.085
  809   2HD1  LEU  97          HD12      LEU  97 -13.932   5.700   4.803
  810   3HD1  LEU  97          HD11      LEU  97 -13.394   6.058   6.444
  811   1HD2  LEU  97          HD23      LEU  97 -11.960   3.446   3.735
  812   2HD2  LEU  97          HD22      LEU  97 -13.165   2.469   4.574
  813   3HD2  LEU  97          HD21      LEU  97 -13.643   3.970   3.780
  814    H    ALA  98           HN       ALA  98  -9.464   1.700   7.203
  815    HA   ALA  98           HA       ALA  98 -11.436  -0.262   6.877
  816   1HB   ALA  98           HB2      ALA  98  -8.774  -0.437   8.315
  817   2HB   ALA  98           HB1      ALA  98  -9.744  -1.835   7.854
  818   3HB   ALA  98           HB3      ALA  98  -9.073  -0.778   6.611
  819    H    GLY  99           HN       GLY  99  -9.911   0.726   9.955
  820   1HA   GLY  99           HA2      GLY  99 -11.085   1.013  12.035
  821   2HA   GLY  99           HA1      GLY  99 -12.469   0.166  11.341
  822    H    LEU 100           HN       LEU 100  -9.148  -1.003  11.172
  823    HA   LEU 100           HA       LEU 100  -9.726  -3.037  13.262
  824   1HB   LEU 100           HB2      LEU 100  -9.664  -3.526  10.397
  825   2HB   LEU 100           HB1      LEU 100  -8.409  -4.450  11.222
  826    HG   LEU 100           HG       LEU 100 -11.229  -4.375  12.284
  827   1HD1  LEU 100          HD11      LEU 100 -10.079  -6.241  10.189
  828   2HD1  LEU 100          HD13      LEU 100 -11.589  -6.523  11.054
  829   3HD1  LEU 100          HD12      LEU 100 -11.434  -5.133   9.979
  830   1HD2  LEU 100          HD23      LEU 100  -8.821  -6.186  12.560
  831   2HD2  LEU 100          HD22      LEU 100  -9.653  -5.286  13.829
  832   3HD2  LEU 100          HD21      LEU 100 -10.432  -6.680  13.081
  833    H    ASN 101           HN       ASN 101  -8.088  -2.127  14.567
  834    HA   ASN 101           HA       ASN 101  -5.488  -1.392  13.584
  835   1HB   ASN 101           HB2      ASN 101  -4.961  -0.931  15.798
  836   2HB   ASN 101           HB1      ASN 101  -6.721  -0.853  15.864
  837   1HD2  ASN 101          HD22      ASN 101  -4.863  -3.533  18.159
  838   2HD2  ASN 101          HD21      ASN 101  -4.090  -2.206  17.435
  839    H    SER 102           HN       SER 102  -6.847  -4.413  14.790
  840    HA   SER 102           HA       SER 102  -4.193  -5.706  14.771
  841   1HB   SER 102           HB2      SER 102  -6.554  -6.138  16.194
  842   2HB   SER 102           HB1      SER 102  -6.479  -7.489  15.067
  843    HG   SER 102           HG       SER 102  -5.322  -7.974  16.945
  844    H    CYS 103           HN       CYS 103  -3.412  -6.768  13.014
  845    HA   CYS 103           HA       CYS 103  -5.209  -8.133  11.142
  846   1HB   CYS 103           HB2      CYS 103  -3.823  -5.562  10.480
  847   2HB   CYS 103           HB1      CYS 103  -3.895  -6.811   9.236
  848    HA   PRO 104           HA       PRO 104  -0.932  -9.818  12.056
  849   1HB   PRO 104           HB2      PRO 104  -2.192 -12.370  12.426
  850   2HB   PRO 104           HB1      PRO 104  -1.405 -11.360  13.647
  851   1HG   PRO 104           HG2      PRO 104  -4.240 -11.834  13.293
  852   2HG   PRO 104           HG1      PRO 104  -3.441 -10.881  14.550
  853   1HD   PRO 104           HD2      PRO 104  -4.980  -9.899  12.336
  854   2HD   PRO 104           HD1      PRO 104  -4.104  -8.952  13.555
  855    H    VAL 105           HN       VAL 105  -0.605  -9.510   9.719
  856    HA   VAL 105           HA       VAL 105  -1.813 -11.275   7.778
  857    HB   VAL 105           HB       VAL 105   0.205  -9.153   7.780
  858   1HG1  VAL 105          HG13      VAL 105   0.630 -11.579   6.010
  859   2HG1  VAL 105          HG12      VAL 105   1.348  -9.998   5.706
  860   3HG1  VAL 105          HG11      VAL 105   1.774 -10.892   7.164
  861   1HG2  VAL 105          HG22      VAL 105  -1.925 -10.284   6.006
  862   2HG2  VAL 105          HG21      VAL 105  -1.723  -8.636   6.602
  863   3HG2  VAL 105          HG23      VAL 105  -0.712  -9.227   5.284
  864    H    LYS 106           HN       LYS 106  -1.311 -13.396   7.405
  865    HA   LYS 106           HA       LYS 106   1.357 -14.445   7.532
  866   1HB   LYS 106           HB2      LYS 106   0.175 -14.146  10.051
  867   2HB   LYS 106           HB1      LYS 106  -0.032 -15.855   9.662
  868   1HG   LYS 106           HG2      LYS 106   2.287 -16.211   9.439
  869   2HG   LYS 106           HG1      LYS 106   2.622 -14.491   9.244
  870   1HD   LYS 106           HD2      LYS 106   3.299 -15.150  11.482
  871   2HD   LYS 106           HD1      LYS 106   1.862 -14.136  11.612
  872   1HE   LYS 106           HE2      LYS 106   1.139 -16.929  11.274
  873   2HE   LYS 106           HE1      LYS 106   2.189 -16.711  12.675
  874   1HZ   LYS 106           HZ3      LYS 106   0.674 -14.807  13.284
  875   2HZ   LYS 106           HZ2      LYS 106  -0.404 -15.397  12.110
  876   3HZ   LYS 106           HZ1      LYS 106   0.017 -16.362  13.444
  877    H    GLU 107           HN       GLU 107  -0.919 -14.586   5.760
  878    HA   GLU 107           HA       GLU 107  -1.208 -17.545   5.685
  879   1HB   GLU 107           HB2      GLU 107  -3.621 -17.058   4.812
  880   2HB   GLU 107           HB1      GLU 107  -3.334 -17.014   6.551
  881   1HG   GLU 107           HG2      GLU 107  -3.496 -14.708   6.663
  882   2HG   GLU 107           HG1      GLU 107  -2.948 -14.485   5.000
  883    H    ALA 108           HN       ALA 108   0.624 -16.762   4.201
  884    HA   ALA 108           HA       ALA 108  -0.246 -17.164   1.516
  885   1HB   ALA 108           HB1      ALA 108  -0.825 -14.643   2.136
  886   2HB   ALA 108           HB3      ALA 108   0.891 -14.411   1.799
  887   3HB   ALA 108           HB2      ALA 108  -0.172 -15.062   0.552
  888    H    ASP 109           HN       ASP 109   1.697 -16.506   0.017
  889    HA   ASP 109           HA       ASP 109   4.159 -17.480   1.376
  890   1HB   ASP 109           HB2      ASP 109   2.982 -17.846  -1.293
  891   2HB   ASP 109           HB1      ASP 109   4.701 -17.451  -1.338
  892    H    GLN 110           HN       GLN 110   6.117 -16.515  -0.297
  893    HA   GLN 110           HA       GLN 110   5.875 -13.593   0.199
  894   1HB   GLN 110           HB2      GLN 110   8.332 -13.518   0.057
  895   2HB   GLN 110           HB1      GLN 110   7.801 -14.683   1.267
  896   1HG   GLN 110           HG2      GLN 110   7.943 -16.342  -0.829
  897   2HG   GLN 110           HG1      GLN 110   9.113 -15.143  -1.369
  898   1HE2  GLN 110          HE22      GLN 110  11.568 -16.682   0.624
  899   2HE2  GLN 110          HE21      GLN 110  11.132 -16.058  -0.894
  900    H    SER 111           HN       SER 111   4.832 -12.855  -1.639
  901    HA   SER 111           HA       SER 111   5.912 -13.590  -4.295
  902   1HB   SER 111           HB2      SER 111   3.992 -12.437  -5.195
  903   2HB   SER 111           HB1      SER 111   3.424 -13.416  -3.846
  904    HG   SER 111           HG       SER 111   3.300 -10.763  -4.178
  905    H    THR 112           HN       THR 112   7.179 -12.185  -5.492
  906    HA   THR 112           HA       THR 112   8.665 -10.152  -4.269
  907    HB   THR 112           HB       THR 112   9.251  -9.415  -6.550
  908    HG1  THR 112           HG1      THR 112   8.156 -10.639  -8.256
  909   1HG2  THR 112          HG21      THR 112   9.976 -11.671  -5.427
  910   2HG2  THR 112          HG23      THR 112   8.968 -12.402  -6.677
  911   3HG2  THR 112          HG22      THR 112  10.344 -11.397  -7.130
  912    H    LEU 113           HN       LEU 113   8.481  -7.899  -4.145
  913    HA   LEU 113           HA       LEU 113   5.926  -6.804  -3.708
  914   1HB   LEU 113           HB2      LEU 113   8.384  -5.928  -3.166
  915   2HB   LEU 113           HB1      LEU 113   8.095  -4.970  -4.618
  916    HG   LEU 113           HG       LEU 113   5.855  -5.053  -2.676
  917   1HD1  LEU 113          HD13      LEU 113   8.417  -4.636  -1.648
  918   2HD1  LEU 113          HD12      LEU 113   7.789  -3.009  -1.914
  919   3HD1  LEU 113          HD11      LEU 113   6.902  -4.141  -0.896
  920   1HD2  LEU 113          HD22      LEU 113   6.979  -3.330  -4.760
  921   2HD2  LEU 113          HD21      LEU 113   5.326  -3.419  -4.152
  922   3HD2  LEU 113          HD23      LEU 113   6.522  -2.429  -3.315
  923    H    GLU 114           HN       GLU 114   7.568  -7.266  -6.742
  924    HA   GLU 114           HA       GLU 114   6.411  -5.191  -8.274
  925   1HB   GLU 114           HB2      GLU 114   8.068  -7.234  -8.858
  926   2HB   GLU 114           HB1      GLU 114   6.571  -7.875  -9.535
  927   1HG   GLU 114           HG2      GLU 114   6.282  -5.653 -10.726
  928   2HG   GLU 114           HG1      GLU 114   7.923  -5.255 -10.218
  929    H    ASN 115           HN       ASN 115   5.176  -8.536  -7.963
  930    HA   ASN 115           HA       ASN 115   2.623  -7.831  -9.144
  931   1HB   ASN 115           HB2      ASN 115   3.759 -10.147  -9.091
  932   2HB   ASN 115           HB1      ASN 115   3.129 -10.277  -7.449
  933   1HD2  ASN 115          HD22      ASN 115   0.498 -11.730  -9.591
  934   2HD2  ASN 115          HD21      ASN 115   2.061 -12.145  -9.072
  935    H    PHE 116           HN       PHE 116   3.887  -7.464  -5.964
  936    HA   PHE 116           HA       PHE 116   1.367  -7.759  -4.549
  937   1HB   PHE 116           HB2      PHE 116   3.375  -7.953  -3.249
  938   2HB   PHE 116           HB1      PHE 116   3.992  -6.418  -3.859
  939    HD1  PHE 116           HD1      PHE 116   0.937  -7.756  -2.125
  940    HD2  PHE 116           HD2      PHE 116   3.772  -4.551  -2.499
  941    HE1  PHE 116           HE1      PHE 116  -0.175  -6.553  -0.260
  942    HE2  PHE 116           HE2      PHE 116   2.661  -3.349  -0.636
  943    HZ   PHE 116           HZ       PHE 116   0.687  -4.350   0.482
  944    H    LEU 117           HN       LEU 117   3.319  -4.816  -5.109
  945    HA   LEU 117           HA       LEU 117   1.236  -2.970  -4.624
  946   1HB   LEU 117           HB2      LEU 117   3.922  -2.837  -5.463
  947   2HB   LEU 117           HB1      LEU 117   2.998  -2.034  -6.732
  948    HG   LEU 117           HG       LEU 117   3.567  -0.370  -5.076
  949   1HD1  LEU 117          HD13      LEU 117   1.021  -0.842  -5.929
  950   2HD1  LEU 117          HD12      LEU 117   0.788  -0.862  -4.181
  951   3HD1  LEU 117          HD11      LEU 117   1.486   0.558  -4.962
  952   1HD2  LEU 117          HD23      LEU 117   2.386  -2.350  -3.107
  953   2HD2  LEU 117          HD22      LEU 117   4.057  -1.793  -3.180
  954   3HD2  LEU 117          HD21      LEU 117   2.776  -0.679  -2.700
  955    H    GLU 118           HN       GLU 118   1.994  -4.904  -7.456
  956    HA   GLU 118           HA       GLU 118   0.436  -3.497  -9.384
  957   1HB   GLU 118           HB2      GLU 118   2.022  -5.375  -9.885
  958   2HB   GLU 118           HB1      GLU 118   0.860  -6.495  -9.176
  959   1HG   GLU 118           HG2      GLU 118  -0.833  -5.756 -10.835
  960   2HG   GLU 118           HG1      GLU 118   0.374  -4.702 -11.572
  961    NH1  ARG 119           NH2      ARG 119  -5.078  -9.353 -10.360
  962    NH2  ARG 119           NH1      ARG 119  -3.859  -7.962 -11.657
  963    H    ARG 119           HN       ARG 119  -0.439  -6.240  -7.280
  964    HA   ARG 119           HA       ARG 119  -3.216  -6.276  -8.029
  965   1HB   ARG 119           HB2      ARG 119  -1.700  -7.333  -5.631
  966   2HB   ARG 119           HB1      ARG 119  -3.444  -7.540  -5.806
  967   1HG   ARG 119           HG2      ARG 119  -1.428  -8.400  -7.899
  968   2HG   ARG 119           HG1      ARG 119  -2.096  -9.482  -6.676
  969   1HD   ARG 119           HD2      ARG 119  -3.705  -9.876  -8.240
  970   2HD   ARG 119           HD1      ARG 119  -4.376  -8.348  -7.667
  971    HE   ARG 119           HE       ARG 119  -2.562  -7.580  -9.611
  972   1HH1  ARG 119          HH21      ARG 119  -5.265  -9.785  -9.479
  973   2HH1  ARG 119          HH22      ARG 119  -5.657  -9.564 -11.147
  974   1HH2  ARG 119          HH11      ARG 119  -3.100  -7.319 -11.770
  975   2HH2  ARG 119          HH12      ARG 119  -4.446  -8.184 -12.436
  976    H    LEU 120           HN       LEU 120  -1.414  -4.117  -6.010
  977    HA   LEU 120           HA       LEU 120  -3.664  -3.374  -4.306
  978   1HB   LEU 120           HB2      LEU 120  -0.869  -2.771  -4.461
  979   2HB   LEU 120           HB1      LEU 120  -1.760  -1.249  -4.498
  980    HG   LEU 120           HG       LEU 120  -2.058  -3.450  -2.433
  981   1HD1  LEU 120          HD11      LEU 120  -0.963  -0.624  -2.273
  982   2HD1  LEU 120          HD13      LEU 120  -1.198  -1.694  -0.893
  983   3HD1  LEU 120          HD12      LEU 120  -0.025  -2.111  -2.141
  984   1HD2  LEU 120          HD23      LEU 120  -3.882  -1.402  -3.293
  985   2HD2  LEU 120          HD22      LEU 120  -4.085  -2.572  -1.989
  986   3HD2  LEU 120          HD21      LEU 120  -3.323  -1.014  -1.666
  987    H    LYS 121           HN       LYS 121  -2.094  -2.019  -7.183
  988    HA   LYS 121           HA       LYS 121  -3.787   0.282  -7.464
  989   1HB   LYS 121           HB2      LYS 121  -1.518  -0.395  -8.628
  990   2HB   LYS 121           HB1      LYS 121  -2.583  -1.155  -9.809
  991   1HG   LYS 121           HG2      LYS 121  -3.705   0.960 -10.232
  992   2HG   LYS 121           HG1      LYS 121  -2.779   1.748  -8.954
  993   1HD   LYS 121           HD2      LYS 121  -1.895   2.141 -11.302
  994   2HD   LYS 121           HD1      LYS 121  -0.718   1.476 -10.167
  995   1HE   LYS 121           HE2      LYS 121  -0.992  -0.743 -11.052
  996   2HE   LYS 121           HE1      LYS 121  -2.383  -0.249 -12.017
  997   1HZ   LYS 121           HZ2      LYS 121   0.258   1.019 -12.380
  998   2HZ   LYS 121           HZ1      LYS 121  -0.134  -0.434 -13.169
  999   3HZ   LYS 121           HZ3      LYS 121  -1.052   0.962 -13.460
 1000    H    THR 122           HN       THR 122  -4.057  -3.063  -8.455
 1001    HA   THR 122           HA       THR 122  -6.260  -2.614 -10.296
 1002    HB   THR 122           HB       THR 122  -6.256  -5.323  -9.413
 1003    HG1  THR 122           HG1      THR 122  -3.854  -5.429 -10.167
 1004   1HG2  THR 122          HG23      THR 122  -6.643  -4.289 -11.705
 1005   2HG2  THR 122          HG22      THR 122  -4.891  -4.140 -11.836
 1006   3HG2  THR 122          HG21      THR 122  -5.632  -5.734 -11.688
 1007    H    ILE 123           HN       ILE 123  -6.066  -3.964  -7.012
 1008    HA   ILE 123           HA       ILE 123  -8.848  -4.442  -6.670
 1009    HB   ILE 123           HB       ILE 123  -6.678  -3.771  -4.674
 1010   1HG1  ILE 123          HG12      ILE 123  -6.393  -5.895  -5.908
 1011   2HG1  ILE 123          HG11      ILE 123  -6.771  -6.199  -4.213
 1012   1HG2  ILE 123          HG22      ILE 123  -9.579  -4.513  -4.298
 1013   2HG2  ILE 123          HG21      ILE 123  -8.375  -4.868  -3.059
 1014   3HG2  ILE 123          HG23      ILE 123  -8.675  -3.200  -3.544
 1015   1HD1  ILE 123          HD11      ILE 123  -9.214  -6.394  -4.923
 1016   2HD1  ILE 123          HD13      ILE 123  -8.635  -6.403  -6.589
 1017   3HD1  ILE 123          HD12      ILE 123  -8.155  -7.687  -5.481
 1018    H    MET 124           HN       MET 124  -6.931  -1.513  -6.299
 1019    HA   MET 124           HA       MET 124  -9.009  -0.026  -4.930
 1020   1HB   MET 124           HB2      MET 124  -6.669   1.053  -6.513
 1021   2HB   MET 124           HB1      MET 124  -7.611   1.918  -5.301
 1022   1HG   MET 124           HG2      MET 124  -6.490  -0.638  -4.358
 1023   2HG   MET 124           HG1      MET 124  -5.288   0.576  -4.785
 1024   1HE   MET 124           HE3      MET 124  -5.494   2.787  -4.434
 1025   2HE   MET 124           HE2      MET 124  -6.456   3.668  -3.250
 1026   3HE   MET 124           HE1      MET 124  -4.922   2.950  -2.768
 1027    NH1  ARG 125           NH2      ARG 125  -6.950   5.535 -12.258
 1028    NH2  ARG 125           NH1      ARG 125  -4.710   5.254 -12.187
 1029    H    ARG 125           HN       ARG 125  -7.796   0.155  -8.295
 1030    HA   ARG 125           HA       ARG 125  -9.778   2.036  -9.139
 1031   1HB   ARG 125           HB2      ARG 125  -8.322   0.005 -10.849
 1032   2HB   ARG 125           HB1      ARG 125  -9.078   1.498 -11.404
 1033   1HG   ARG 125           HG2      ARG 125  -7.097   1.804  -9.217
 1034   2HG   ARG 125           HG1      ARG 125  -6.443   1.307 -10.776
 1035   1HD   ARG 125           HD2      ARG 125  -8.042   3.248 -11.658
 1036   2HD   ARG 125           HD1      ARG 125  -7.817   3.851 -10.018
 1037    HE   ARG 125           HE       ARG 125  -5.246   3.239 -10.895
 1038   1HH1  ARG 125          HH21      ARG 125  -7.875   5.237 -12.026
 1039   2HH1  ARG 125          HH22      ARG 125  -6.819   6.373 -12.788
 1040   1HH2  ARG 125          HH11      ARG 125  -3.908   4.733 -11.897
 1041   2HH2  ARG 125          HH12      ARG 125  -4.595   6.094 -12.720
 1042    H    GLU 126           HN       GLU 126  -9.968  -1.437  -8.746
 1043    HA   GLU 126           HA       GLU 126 -12.353  -1.580 -10.477
 1044   1HB   GLU 126           HB2      GLU 126 -10.756  -3.634  -8.954
 1045   2HB   GLU 126           HB1      GLU 126 -12.295  -4.032  -9.722
 1046   1HG   GLU 126           HG2      GLU 126 -11.474  -3.459 -11.891
 1047   2HG   GLU 126           HG1      GLU 126 -10.042  -2.679 -11.218
 1048    H    LYS 127           HN       LYS 127 -11.627  -1.803  -6.994
 1049    HA   LYS 127           HA       LYS 127 -14.470  -2.342  -6.421
 1050   1HB   LYS 127           HB2      LYS 127 -11.998  -2.122  -4.710
 1051   2HB   LYS 127           HB1      LYS 127 -13.611  -2.241  -4.004
 1052   1HG   LYS 127           HG2      LYS 127 -13.934  -4.309  -5.495
 1053   2HG   LYS 127           HG1      LYS 127 -12.189  -4.254  -5.751
 1054   1HD   LYS 127           HD2      LYS 127 -12.115  -5.539  -3.869
 1055   2HD   LYS 127           HD1      LYS 127 -12.308  -3.995  -3.039
 1056   1HE   LYS 127           HE2      LYS 127 -14.371  -4.548  -2.310
 1057   2HE   LYS 127           HE1      LYS 127 -14.872  -5.068  -3.920
 1058   1HZ   LYS 127           HZ2      LYS 127 -12.996  -6.807  -2.550
 1059   2HZ   LYS 127           HZ1      LYS 127 -14.552  -6.731  -1.876
 1060   3HZ   LYS 127           HZ3      LYS 127 -14.353  -7.197  -3.495
 1061    OH   TYR 128           OH       TYR 128 -11.568   7.017  -8.708
 1062    H    TYR 128           HN       TYR 128 -12.126   0.265  -5.723
 1063    HA   TYR 128           HA       TYR 128 -13.954   1.917  -4.291
 1064   1HB   TYR 128           HB2      TYR 128 -12.097   3.130  -3.997
 1065   2HB   TYR 128           HB1      TYR 128 -11.255   2.058  -5.109
 1066    HD1  TYR 128           HD2      TYR 128 -11.560   2.580  -7.678
 1067    HD2  TYR 128           HD1      TYR 128 -12.353   5.387  -4.522
 1068    HE1  TYR 128           HE2      TYR 128 -11.324   4.449  -9.284
 1069    HE2  TYR 128           HE1      TYR 128 -12.113   7.258  -6.132
 1070    HH   TYR 128           HH       TYR 128 -12.351   7.567  -8.646
 1071    H    SER 129           HN       SER 129 -13.930   1.185  -7.643
 1072    HA   SER 129           HA       SER 129 -15.192   3.741  -8.403
 1073   1HB   SER 129           HB2      SER 129 -14.239   1.311  -9.872
 1074   2HB   SER 129           HB1      SER 129 -15.430   2.358 -10.639
 1075    HG   SER 129           HG       SER 129 -13.060   2.823 -10.909
 1076    H    LYS 130           HN       LYS 130 -16.496   1.668  -6.524
 1077    HA   LYS 130           HA       LYS 130 -19.157   1.864  -7.725
 1078   1HB   LYS 130           HB2      LYS 130 -17.926  -0.327  -8.539
 1079   2HB   LYS 130           HB1      LYS 130 -18.323  -0.907  -6.922
 1080   1HG   LYS 130           HG2      LYS 130 -20.661  -0.623  -7.283
 1081   2HG   LYS 130           HG1      LYS 130 -20.393   0.342  -8.736
 1082   1HD   LYS 130           HD2      LYS 130 -20.041  -1.493 -10.049
 1083   2HD   LYS 130           HD1      LYS 130 -19.191  -2.365  -8.774
 1084   1HE   LYS 130           HE2      LYS 130 -21.200  -3.576  -9.034
 1085   2HE   LYS 130           HE1      LYS 130 -21.510  -2.549  -7.634
 1086   1HZ   LYS 130           HZ1      LYS 130 -22.542  -0.932  -9.157
 1087   2HZ   LYS 130           HZ3      LYS 130 -22.344  -2.028 -10.435
 1088   3HZ   LYS 130           HZ2      LYS 130 -23.358  -2.422  -9.129
 1089    H    CYS 131           HN       CYS 131 -18.058   3.012  -5.409
 1090    HA   CYS 131           HA       CYS 131 -18.352   1.606  -2.993
 1091   1HB   CYS 131           HB2      CYS 131 -17.742   4.167  -3.612
 1092   2HB   CYS 131           HB1      CYS 131 -19.392   4.390  -3.031
 1093    H    SER 132           HN       SER 132 -20.866   3.490  -4.722
 1094    HA   SER 132           HA       SER 132 -22.888   1.811  -3.293
 1095   1HB   SER 132           HB2      SER 132 -24.221   4.160  -3.820
 1096   2HB   SER 132           HB1      SER 132 -23.506   3.738  -2.267
 1097    HG   SER 132           HG       SER 132 -22.822   5.794  -3.138
 1098    H    SER 133           HN       SER 133 -24.745   1.273  -4.530
 1099    HA   SER 133           HA       SER 133 -24.818   2.170  -7.356
 1100   1HB   SER 133           HB2      SER 133 -25.354  -0.631  -7.356
 1101   2HB   SER 133           HB1      SER 133 -24.045   0.221  -8.169
 1102    HG   SER 133           HG       SER 133 -22.828  -0.796  -6.791
   
  Start of MODEL           6
 Raw file had 1102 H/Q atoms
  Start of MODEL    6
    1   1H    GLU   1           HT2      GLU   1 -25.433  23.569   0.220
    2   2H    GLU   1           HT1      GLU   1 -25.829  23.492  -1.430
    3   3H    GLU   1           HT3      GLU   1 -26.202  22.190  -0.409
    4    HA   GLU   1           HA       GLU   1 -24.319  21.429  -1.470
    5   1HB   GLU   1           HB2      GLU   1 -22.294  23.042  -1.633
    6   2HB   GLU   1           HB1      GLU   1 -23.647  23.309  -2.733
    7   1HG   GLU   1           HG2      GLU   1 -24.404  25.181  -1.566
    8   2HG   GLU   1           HG1      GLU   1 -23.631  24.680  -0.062
    9    H    ALA   2           HN       ALA   2 -25.054  21.004   1.095
   10    HA   ALA   2           HA       ALA   2 -22.451  21.135   2.549
   11   1HB   ALA   2           HB1      ALA   2 -24.830  22.498   3.274
   12   2HB   ALA   2           HB3      ALA   2 -24.654  21.156   4.404
   13   3HB   ALA   2           HB2      ALA   2 -23.354  22.335   4.225
   14    H    GLU   3           HN       GLU   3 -23.589  18.975   0.976
   15    HA   GLU   3           HA       GLU   3 -24.557  17.041   3.003
   16   1HB   GLU   3           HB2      GLU   3 -24.486  17.162   0.022
   17   2HB   GLU   3           HB1      GLU   3 -24.426  15.564   0.768
   18   1HG   GLU   3           HG2      GLU   3 -26.597  15.665   1.394
   19   2HG   GLU   3           HG1      GLU   3 -26.421  17.309   2.010
   20    H    ALA   4           HN       ALA   4 -23.479  14.680   2.291
   21    HA   ALA   4           HA       ALA   4 -20.576  14.905   1.911
   22   1HB   ALA   4           HB1      ALA   4 -21.427  15.227   4.481
   23   2HB   ALA   4           HB3      ALA   4 -21.251  13.473   4.417
   24   3HB   ALA   4           HB2      ALA   4 -19.874  14.512   4.050
   25    H    HIS   5           HN       HIS   5 -19.582  12.746   1.698
   26    HA   HIS   5           HA       HIS   5 -21.582  10.556   1.328
   27   1HB   HIS   5           HB2      HIS   5 -19.777  11.787  -0.638
   28   2HB   HIS   5           HB1      HIS   5 -19.618  10.034  -0.552
   29    HD1  HIS   5           HD1      HIS   5 -20.761  10.177  -3.023
   30    HD2  HIS   5           HD2      HIS   5 -23.219  11.151   0.200
   31    HE1  HIS   5           HE1      HIS   5 -23.142  10.063  -3.878
   32    H    LYS   6           HN       LYS   6 -19.983   8.464   0.764
   33    HA   LYS   6           HA       LYS   6 -17.763   8.488   2.742
   34   1HB   LYS   6           HB2      LYS   6 -18.573   6.304   3.645
   35   2HB   LYS   6           HB1      LYS   6 -19.670   7.643   3.986
   36   1HG   LYS   6           HG2      LYS   6 -20.234   6.353   1.421
   37   2HG   LYS   6           HG1      LYS   6 -20.382   5.244   2.785
   38   1HD   LYS   6           HD2      LYS   6 -22.207   6.316   3.621
   39   2HD   LYS   6           HD1      LYS   6 -21.563   7.913   3.238
   40   1HE   LYS   6           HE2      LYS   6 -23.492   7.584   1.838
   41   2HE   LYS   6           HE1      LYS   6 -22.071   7.425   0.804
   42   1HZ   LYS   6           HZ2      LYS   6 -23.569   5.175   2.036
   43   2HZ   LYS   6           HZ1      LYS   6 -23.669   5.652   0.409
   44   3HZ   LYS   6           HZ3      LYS   6 -22.215   5.031   1.020
   45    H    CYS   7           HN       CYS   7 -17.098   8.593   0.226
   46    HA   CYS   7           HA       CYS   7 -15.690   6.168  -0.316
   47   1HB   CYS   7           HB2      CYS   7 -17.648   5.086  -1.043
   48   2HB   CYS   7           HB1      CYS   7 -18.308   6.558  -1.756
   49    H    ASP   8           HN       ASP   8 -17.162   9.083  -1.692
   50    HA   ASP   8           HA       ASP   8 -15.106   9.302  -3.764
   51   1HB   ASP   8           HB2      ASP   8 -17.675  10.429  -3.269
   52   2HB   ASP   8           HB1      ASP   8 -16.524  11.762  -3.371
   53    H    ILE   9           HN       ILE   9 -15.388  10.290  -0.456
   54    HA   ILE   9           HA       ILE   9 -13.441  12.478  -0.835
   55    HB   ILE   9           HB       ILE   9 -14.664  11.465   1.743
   56   1HG1  ILE   9          HG12      ILE   9 -15.634  13.376  -0.366
   57   2HG1  ILE   9          HG11      ILE   9 -16.542  12.163   0.536
   58   1HG2  ILE   9          HG23      ILE   9 -12.549  12.912   1.768
   59   2HG2  ILE   9          HG22      ILE   9 -13.545  14.196   1.083
   60   3HG2  ILE   9          HG21      ILE   9 -13.928  13.536   2.673
   61   1HD1  ILE   9          HD12      ILE   9 -16.018  13.583   2.622
   62   2HD1  ILE   9          HD11      ILE   9 -15.568  14.855   1.487
   63   3HD1  ILE   9          HD13      ILE   9 -17.213  14.221   1.492
   64    H    THR  10           HN       THR  10 -13.569   9.829   1.567
   65    HA   THR  10           HA       THR  10 -10.692   9.883   1.885
   66    HB   THR  10           HB       THR  10 -12.532   7.684   2.818
   67    HG1  THR  10           HG1      THR  10 -13.253   8.978   4.355
   68   1HG2  THR  10          HG22      THR  10  -9.886   7.824   3.044
   69   2HG2  THR  10          HG21      THR  10 -10.295   8.878   4.396
   70   3HG2  THR  10          HG23      THR  10 -10.883   7.215   4.364
   71    H    LEU  11           HN       LEU  11 -12.917   7.716   0.130
   72    HA   LEU  11           HA       LEU  11 -10.799   5.810  -0.434
   73   1HB   LEU  11           HB2      LEU  11 -13.578   5.783  -0.636
   74   2HB   LEU  11           HB1      LEU  11 -13.024   5.709  -2.310
   75    HG   LEU  11           HG       LEU  11 -11.502   3.839  -1.708
   76   1HD1  LEU  11          HD12      LEU  11 -12.306   4.653   0.971
   77   2HD1  LEU  11          HD11      LEU  11 -12.551   2.925   0.717
   78   3HD1  LEU  11          HD13      LEU  11 -10.956   3.636   0.471
   79   1HD2  LEU  11          HD21      LEU  11 -14.448   3.551  -1.077
   80   2HD2  LEU  11          HD23      LEU  11 -13.616   3.159  -2.584
   81   3HD2  LEU  11          HD22      LEU  11 -13.358   2.165  -1.150
   82    H    GLN  12           HN       GLN  12 -12.102   8.626  -2.141
   83    HA   GLN  12           HA       GLN  12 -10.695   7.994  -4.605
   84   1HB   GLN  12           HB2      GLN  12 -11.847   9.742  -5.448
   85   2HB   GLN  12           HB1      GLN  12 -12.661   9.817  -3.891
   86   1HG   GLN  12           HG2      GLN  12 -10.943  11.404  -3.071
   87   2HG   GLN  12           HG1      GLN  12 -10.139  11.338  -4.642
   88   1HE2  GLN  12          HE22      GLN  12 -13.086  12.928  -6.244
   89   2HE2  GLN  12          HE21      GLN  12 -12.211  11.489  -6.453
   90    H    GLU  13           HN       GLU  13 -10.016  10.045  -1.780
   91    HA   GLU  13           HA       GLU  13  -7.542  11.098  -2.821
   92   1HB   GLU  13           HB2      GLU  13  -8.912  11.005  -0.189
   93   2HB   GLU  13           HB1      GLU  13  -7.156  11.170  -0.132
   94   1HG   GLU  13           HG2      GLU  13  -8.469  12.884  -2.140
   95   2HG   GLU  13           HG1      GLU  13  -8.894  13.266  -0.472
   96    H    ILE  14           HN       ILE  14  -8.426   8.177  -1.072
   97    HA   ILE  14           HA       ILE  14  -5.717   7.335  -0.497
   98    HB   ILE  14           HB       ILE  14  -8.427   6.289  -0.174
   99   1HG1  ILE  14          HG12      ILE  14  -6.059   5.237   1.307
  100   2HG1  ILE  14          HG11      ILE  14  -6.424   6.955   1.474
  101   1HG2  ILE  14          HG22      ILE  14  -6.206   4.381  -0.967
  102   2HG2  ILE  14          HG21      ILE  14  -7.682   3.881  -0.146
  103   3HG2  ILE  14          HG23      ILE  14  -7.770   4.584  -1.760
  104   1HD1  ILE  14          HD12      ILE  14  -8.674   4.996   1.724
  105   2HD1  ILE  14          HD11      ILE  14  -7.558   5.168   3.079
  106   3HD1  ILE  14          HD13      ILE  14  -8.463   6.565   2.499
  107    H    ILE  15           HN       ILE  15  -7.889   7.009  -3.239
  108    HA   ILE  15           HA       ILE  15  -6.430   4.911  -4.578
  109    HB   ILE  15           HB       ILE  15  -8.410   7.001  -5.499
  110   1HG1  ILE  15          HG12      ILE  15  -8.717   4.023  -5.707
  111   2HG1  ILE  15          HG11      ILE  15  -8.900   4.787  -4.127
  112   1HG2  ILE  15          HG23      ILE  15  -6.665   5.175  -7.092
  113   2HG2  ILE  15          HG22      ILE  15  -8.347   5.338  -7.595
  114   3HG2  ILE  15          HG21      ILE  15  -7.311   6.763  -7.512
  115   1HD1  ILE  15          HD11      ILE  15 -10.360   6.443  -5.813
  116   2HD1  ILE  15          HD13      ILE  15 -10.707   4.827  -6.425
  117   3HD1  ILE  15          HD12      ILE  15 -11.032   5.218  -4.737
  118    H    LYS  16           HN       LYS  16  -6.360   8.465  -4.797
  119    HA   LYS  16           HA       LYS  16  -4.453   8.629  -6.912
  120   1HB   LYS  16           HB2      LYS  16  -5.715  10.434  -5.033
  121   2HB   LYS  16           HB1      LYS  16  -4.005  10.829  -5.213
  122   1HG   LYS  16           HG2      LYS  16  -4.256  11.501  -7.372
  123   2HG   LYS  16           HG1      LYS  16  -5.389  10.200  -7.743
  124   1HD   LYS  16           HD2      LYS  16  -6.344  12.329  -5.891
  125   2HD   LYS  16           HD1      LYS  16  -6.167  12.766  -7.591
  126   1HE   LYS  16           HE2      LYS  16  -7.404  10.371  -7.857
  127   2HE   LYS  16           HE1      LYS  16  -8.074  10.888  -6.310
  128   1HZ   LYS  16           HZ2      LYS  16  -8.130  13.117  -7.917
  129   2HZ   LYS  16           HZ1      LYS  16  -8.646  11.848  -8.922
  130   3HZ   LYS  16           HZ3      LYS  16  -9.457  12.158  -7.465
  131    H    THR  17           HN       THR  17  -4.016   8.629  -3.376
  132    HA   THR  17           HA       THR  17  -1.190   8.920  -3.368
  133    HB   THR  17           HB       THR  17  -2.619   7.184  -1.364
  134    HG1  THR  17           HG1      THR  17  -3.692   8.850  -0.617
  135   1HG2  THR  17          HG22      THR  17  -0.190   7.573  -1.141
  136   2HG2  THR  17          HG21      THR  17  -0.472   9.314  -1.144
  137   3HG2  THR  17          HG23      THR  17  -1.082   8.324   0.182
  138    H    LEU  18           HN       LEU  18  -3.207   5.991  -3.569
  139    HA   LEU  18           HA       LEU  18  -1.107   4.092  -3.426
  140   1HB   LEU  18           HB2      LEU  18  -3.573   3.602  -3.362
  141   2HB   LEU  18           HB1      LEU  18  -3.600   3.816  -5.112
  142    HG   LEU  18           HG       LEU  18  -1.413   2.085  -4.390
  143   1HD1  LEU  18          HD11      LEU  18  -3.370   1.802  -2.517
  144   2HD1  LEU  18          HD13      LEU  18  -3.911   0.654  -3.741
  145   3HD1  LEU  18          HD12      LEU  18  -2.304   0.496  -3.033
  146   1HD2  LEU  18          HD23      LEU  18  -3.309   2.373  -6.421
  147   2HD2  LEU  18          HD22      LEU  18  -2.068   1.124  -6.320
  148   3HD2  LEU  18          HD21      LEU  18  -3.684   0.812  -5.690
  149    H    ASN  19           HN       ASN  19  -2.373   5.962  -6.153
  150    HA   ASN  19           HA       ASN  19  -0.791   4.591  -8.158
  151   1HB   ASN  19           HB2      ASN  19  -2.897   6.014  -8.535
  152   2HB   ASN  19           HB1      ASN  19  -1.842   7.418  -8.370
  153   1HD2  ASN  19          HD22      ASN  19  -1.478   7.031 -11.906
  154   2HD2  ASN  19          HD21      ASN  19  -2.280   7.908 -10.694
  155    H    SER  20           HN       SER  20  -0.209   7.259  -5.959
  156    HA   SER  20           HA       SER  20   2.047   8.383  -7.340
  157   1HB   SER  20           HB2      SER  20   1.117   8.444  -4.472
  158   2HB   SER  20           HB1      SER  20   2.638   9.191  -4.952
  159    HG   SER  20           HG       SER  20   0.383  10.341  -5.055
  160    H    LEU  21           HN       LEU  21   1.776   5.875  -4.816
  161    HA   LEU  21           HA       LEU  21   4.626   5.485  -4.574
  162   1HB   LEU  21           HB2      LEU  21   2.235   3.790  -3.839
  163   2HB   LEU  21           HB1      LEU  21   3.889   3.233  -3.577
  164    HG   LEU  21           HG       LEU  21   2.983   5.931  -2.575
  165   1HD1  LEU  21          HD11      LEU  21   2.419   3.208  -1.476
  166   2HD1  LEU  21          HD13      LEU  21   2.867   4.477  -0.337
  167   3HD1  LEU  21          HD12      LEU  21   1.454   4.681  -1.372
  168   1HD2  LEU  21          HD22      LEU  21   5.448   4.922  -2.738
  169   2HD2  LEU  21          HD21      LEU  21   4.947   5.885  -1.346
  170   3HD2  LEU  21          HD23      LEU  21   4.962   4.124  -1.241
  171    H    THR  22           HN       THR  22   2.472   4.658  -7.103
  172    HA   THR  22           HA       THR  22   3.948   2.242  -7.897
  173    HB   THR  22           HB       THR  22   1.374   2.998  -8.288
  174    HG1  THR  22           HG1      THR  22   3.108   1.292  -9.688
  175   1HG2  THR  22          HG22      THR  22   2.284   4.800  -9.881
  176   2HG2  THR  22          HG21      THR  22   2.672   3.471 -10.973
  177   3HG2  THR  22          HG23      THR  22   0.998   3.765 -10.502
  178    H    GLU  23           HN       GLU  23   4.384   5.601  -8.329
  179    HA   GLU  23           HA       GLU  23   5.271   5.812 -10.991
  180   1HB   GLU  23           HB2      GLU  23   6.119   7.854 -10.373
  181   2HB   GLU  23           HB1      GLU  23   5.153   7.544  -8.931
  182   1HG   GLU  23           HG2      GLU  23   7.205   6.444  -7.921
  183   2HG   GLU  23           HG1      GLU  23   8.121   7.074  -9.291
  184    H    GLN  24           HN       GLN  24   6.892   4.423  -8.188
  185    HA   GLN  24           HA       GLN  24   9.073   3.524 -10.026
  186   1HB   GLN  24           HB2      GLN  24   9.547   5.346  -8.125
  187   2HB   GLN  24           HB1      GLN  24   9.665   3.899  -7.127
  188   1HG   GLN  24           HG2      GLN  24  11.826   3.876  -7.861
  189   2HG   GLN  24           HG1      GLN  24  11.119   3.123  -9.291
  190   1HE2  GLN  24          HE22      GLN  24  12.038   7.135  -9.512
  191   2HE2  GLN  24          HE21      GLN  24  11.576   6.480  -8.017
  192    H    LYS  25           HN       LYS  25   7.523   1.652 -10.152
  193    HA   LYS  25           HA       LYS  25   7.726  -0.109  -7.747
  194   1HB   LYS  25           HB2      LYS  25   5.822  -1.366  -8.789
  195   2HB   LYS  25           HB1      LYS  25   5.417   0.303  -8.390
  196   1HG   LYS  25           HG2      LYS  25   5.383   0.973 -10.610
  197   2HG   LYS  25           HG1      LYS  25   6.507  -0.289 -11.116
  198   1HD   LYS  25           HD2      LYS  25   3.868  -1.158 -10.026
  199   2HD   LYS  25           HD1      LYS  25   3.889  -0.453 -11.643
  200   1HE   LYS  25           HE2      LYS  25   5.480  -2.090 -12.418
  201   2HE   LYS  25           HE1      LYS  25   5.730  -2.698 -10.781
  202   1HZ   LYS  25           HZ2      LYS  25   3.003  -2.801 -11.267
  203   2HZ   LYS  25           HZ1      LYS  25   3.753  -3.433 -12.655
  204   3HZ   LYS  25           HZ3      LYS  25   4.079  -4.108 -11.133
  205    H    THR  26           HN       THR  26  10.036  -0.084  -9.118
  206    HA   THR  26           HA       THR  26  10.018  -2.741 -10.434
  207    HB   THR  26           HB       THR  26  10.215  -1.752 -12.468
  208    HG1  THR  26           HG1      THR  26  12.257  -1.813 -12.912
  209   1HG2  THR  26          HG22      THR  26  10.881   0.742 -10.897
  210   2HG2  THR  26          HG21      THR  26  10.926   0.703 -12.660
  211   3HG2  THR  26          HG23      THR  26   9.413   0.389 -11.809
  212    H    LEU  27           HN       LEU  27  12.072  -0.027  -9.346
  213    HA   LEU  27           HA       LEU  27  14.297  -1.868  -8.799
  214   1HB   LEU  27           HB2      LEU  27  14.315   0.705  -9.510
  215   2HB   LEU  27           HB1      LEU  27  14.255   0.938  -7.762
  216    HG   LEU  27           HG       LEU  27  16.187  -0.810  -7.698
  217   1HD1  LEU  27          HD11      LEU  27  15.730  -1.090 -10.315
  218   2HD1  LEU  27          HD13      LEU  27  16.861   0.261 -10.407
  219   3HD1  LEU  27          HD12      LEU  27  17.354  -1.250  -9.646
  220   1HD2  LEU  27          HD21      LEU  27  16.093   1.952  -7.697
  221   2HD2  LEU  27          HD23      LEU  27  17.524   0.988  -7.327
  222   3HD2  LEU  27          HD22      LEU  27  17.278   1.613  -8.958
  223    H    CYS  28           HN       CYS  28  12.122   0.200  -6.866
  224    HA   CYS  28           HA       CYS  28  13.106  -0.932  -4.362
  225   1HB   CYS  28           HB2      CYS  28  11.634   1.336  -5.065
  226   2HB   CYS  28           HB1      CYS  28  10.488   0.328  -4.179
  227    H    THR  29           HN       THR  29  10.958  -2.062  -6.751
  228    HA   THR  29           HA       THR  29   9.294  -3.582  -4.850
  229    HB   THR  29           HB       THR  29   8.283  -4.513  -6.964
  230    HG1  THR  29           HG1      THR  29  10.184  -4.158  -8.229
  231   1HG2  THR  29          HG23      THR  29   8.429  -1.527  -6.533
  232   2HG2  THR  29          HG22      THR  29   7.315  -2.273  -7.678
  233   3HG2  THR  29          HG21      THR  29   7.191  -2.642  -5.958
  234    H    GLU  30           HN       GLU  30  12.392  -3.956  -5.652
  235    HA   GLU  30           HA       GLU  30  12.287  -6.798  -6.429
  236   1HB   GLU  30           HB2      GLU  30  14.278  -4.640  -6.474
  237   2HB   GLU  30           HB1      GLU  30  14.941  -6.177  -5.919
  238   1HG   GLU  30           HG2      GLU  30  13.149  -6.225  -8.304
  239   2HG   GLU  30           HG1      GLU  30  14.781  -5.589  -8.517
  240    H    LEU  31           HN       LEU  31  11.053  -6.555  -4.049
  241    HA   LEU  31           HA       LEU  31  12.836  -8.024  -2.247
  242   1HB   LEU  31           HB2      LEU  31  12.063  -6.554  -0.290
  243   2HB   LEU  31           HB1      LEU  31  13.294  -5.868  -1.345
  244    HG   LEU  31           HG       LEU  31  10.851  -5.119  -2.519
  245   1HD1  LEU  31          HD13      LEU  31  10.694  -5.294   0.450
  246   2HD1  LEU  31          HD12      LEU  31  10.081  -3.819  -0.294
  247   3HD1  LEU  31          HD11      LEU  31   9.404  -5.381  -0.750
  248   1HD2  LEU  31          HD21      LEU  31  12.927  -3.742  -0.818
  249   2HD2  LEU  31          HD23      LEU  31  12.697  -3.644  -2.564
  250   3HD2  LEU  31          HD22      LEU  31  11.554  -2.852  -1.479
  251    H    THR  32           HN       THR  32  11.527  -9.774  -2.417
  252    HA   THR  32           HA       THR  32   8.823 -10.072  -2.714
  253    HB   THR  32           HB       THR  32   9.030 -12.198  -1.408
  254    HG1  THR  32           HG1      THR  32  10.556 -12.330   0.000
  255   1HG2  THR  32          HG23      THR  32   9.818 -11.869  -3.812
  256   2HG2  THR  32          HG22      THR  32  11.448 -11.721  -3.156
  257   3HG2  THR  32          HG21      THR  32  10.545 -13.221  -2.945
  258    H    VAL  33           HN       VAL  33   7.097 -10.647  -1.173
  259    HA   VAL  33           HA       VAL  33   7.293  -9.658   1.589
  260    HB   VAL  33           HB       VAL  33   5.329  -8.095   1.232
  261   1HG1  VAL  33          HG11      VAL  33   7.778  -7.390   1.386
  262   2HG1  VAL  33          HG13      VAL  33   7.765  -7.288  -0.375
  263   3HG1  VAL  33          HG12      VAL  33   6.703  -6.248   0.577
  264   1HG2  VAL  33          HG22      VAL  33   4.959  -9.238  -1.116
  265   2HG2  VAL  33          HG21      VAL  33   4.607  -7.521  -0.910
  266   3HG2  VAL  33          HG23      VAL  33   6.120  -8.029  -1.664
  267    H    THR  34           HN       THR  34   4.683  -9.657   2.308
  268    HA   THR  34           HA       THR  34   3.939 -12.455   1.875
  269    HB   THR  34           HB       THR  34   3.335 -10.381   3.806
  270    HG1  THR  34           HG1      THR  34   4.092 -12.676   3.963
  271   1HG2  THR  34          HG21      THR  34   0.976 -11.929   2.687
  272   2HG2  THR  34          HG23      THR  34   0.958 -11.012   4.192
  273   3HG2  THR  34          HG22      THR  34   1.183 -10.176   2.660
  274    H    ASP  35           HN       ASP  35   1.946 -13.143   0.918
  275    HA   ASP  35           HA       ASP  35   0.901 -11.205  -1.088
  276   1HB   ASP  35           HB2      ASP  35   1.814 -13.656  -1.590
  277   2HB   ASP  35           HB1      ASP  35   0.175 -14.107  -1.129
  278    H    ILE  36           HN       ILE  36  -0.550 -10.102   0.324
  279    HA   ILE  36           HA       ILE  36  -2.452 -11.472   1.995
  280    HB   ILE  36           HB       ILE  36  -3.422  -9.331   2.367
  281   1HG1  ILE  36          HG12      ILE  36  -2.155  -8.567  -0.280
  282   2HG1  ILE  36          HG11      ILE  36  -3.879  -8.645   0.092
  283   1HG2  ILE  36          HG21      ILE  36  -0.793  -9.745   2.754
  284   2HG2  ILE  36          HG23      ILE  36  -0.697  -8.367   1.657
  285   3HG2  ILE  36          HG22      ILE  36  -1.580  -8.224   3.176
  286   1HD1  ILE  36          HD11      ILE  36  -3.499  -6.867   1.839
  287   2HD1  ILE  36          HD13      ILE  36  -1.851  -6.706   1.235
  288   3HD1  ILE  36          HD12      ILE  36  -3.216  -6.321   0.187
  289    H    PHE  37           HN       PHE  37  -2.318 -11.138  -1.412
  290    HA   PHE  37           HA       PHE  37  -5.263 -11.282  -1.713
  291   1HB   PHE  37           HB2      PHE  37  -3.077 -11.188  -3.813
  292   2HB   PHE  37           HB1      PHE  37  -4.810 -11.070  -4.119
  293    HD1  PHE  37           HD2      PHE  37  -6.074  -9.213  -2.724
  294    HD2  PHE  37           HD1      PHE  37  -1.855  -9.225  -3.524
  295    HE1  PHE  37           HE2      PHE  37  -5.985  -6.773  -2.291
  296    HE2  PHE  37           HE1      PHE  37  -1.765  -6.784  -3.091
  297    HZ   PHE  37           HZ       PHE  37  -3.831  -5.560  -2.474
  298    H    ALA  38           HN       ALA  38  -3.758 -13.515  -0.504
  299    HA   ALA  38           HA       ALA  38  -4.340 -15.592  -2.577
  300   1HB   ALA  38           HB3      ALA  38  -1.872 -15.171  -1.702
  301   2HB   ALA  38           HB2      ALA  38  -2.430 -16.134  -0.335
  302   3HB   ALA  38           HB1      ALA  38  -2.465 -16.812  -1.962
  303    H    ALA  39           HN       ALA  39  -5.914 -14.324  -0.187
  304    HA   ALA  39           HA       ALA  39  -7.174 -16.813   0.630
  305   1HB   ALA  39           HB3      ALA  39  -5.256 -15.413   2.440
  306   2HB   ALA  39           HB2      ALA  39  -6.742 -16.037   3.155
  307   3HB   ALA  39           HB1      ALA  39  -5.639 -17.131   2.322
  308    H    SER  40           HN       SER  40  -9.186 -16.403   1.749
  309    HA   SER  40           HA       SER  40 -10.017 -13.846   2.693
  310   1HB   SER  40           HB2      SER  40 -10.214 -14.284  -0.217
  311   2HB   SER  40           HB1      SER  40 -11.712 -13.745   0.540
  312    HG   SER  40           HG       SER  40  -9.680 -12.267  -0.118
  313    H    LYS  41           HN       LYS  41 -12.385 -13.841   3.184
  314    HA   LYS  41           HA       LYS  41 -13.703 -16.485   2.860
  315   1HB   LYS  41           HB2      LYS  41 -12.403 -16.262   5.103
  316   2HB   LYS  41           HB1      LYS  41 -13.697 -15.155   5.563
  317   1HG   LYS  41           HG2      LYS  41 -15.194 -16.838   5.823
  318   2HG   LYS  41           HG1      LYS  41 -14.685 -17.630   4.333
  319   1HD   LYS  41           HD2      LYS  41 -12.570 -17.854   6.265
  320   2HD   LYS  41           HD1      LYS  41 -14.077 -18.396   7.002
  321   1HE   LYS  41           HE2      LYS  41 -13.094 -19.330   4.293
  322   2HE   LYS  41           HE1      LYS  41 -12.835 -20.218   5.794
  323   1HZ   LYS  41           HZ1      LYS  41 -15.456 -19.744   5.917
  324   2HZ   LYS  41           HZ3      LYS  41 -15.256 -19.875   4.238
  325   3HZ   LYS  41           HZ2      LYS  41 -14.784 -21.156   5.251
  326    H    ASP  42           HN       ASP  42 -14.086 -13.194   4.241
  327    HA   ASP  42           HA       ASP  42 -16.674 -12.999   2.815
  328   1HB   ASP  42           HB2      ASP  42 -16.518 -13.611   5.586
  329   2HB   ASP  42           HB1      ASP  42 -17.057 -11.937   5.455
  330    H    THR  43           HN       THR  43 -13.910 -11.663   2.849
  331    HA   THR  43           HA       THR  43 -14.988  -8.899   2.848
  332    HB   THR  43           HB       THR  43 -13.953  -8.994   5.012
  333    HG1  THR  43           HG1      THR  43 -13.430  -7.138   3.973
  334   1HG2  THR  43          HG23      THR  43 -12.544 -11.079   4.303
  335   2HG2  THR  43          HG22      THR  43 -11.347  -9.888   3.796
  336   3HG2  THR  43          HG21      THR  43 -11.858  -9.963   5.481
  337    H    THR  44           HN       THR  44 -13.480  -7.398   1.697
  338    HA   THR  44           HA       THR  44 -11.333  -8.546   0.108
  339    HB   THR  44           HB       THR  44 -13.409  -7.506  -1.719
  340    HG1  THR  44           HG1      THR  44 -14.883  -8.817  -1.042
  341   1HG2  THR  44          HG23      THR  44 -11.168  -8.457  -2.353
  342   2HG2  THR  44          HG22      THR  44 -11.731 -10.025  -1.775
  343   3HG2  THR  44          HG21      THR  44 -12.533  -9.249  -3.142
  344    H    GLU  45           HN       GLU  45 -11.673  -6.225   1.849
  345    HA   GLU  45           HA       GLU  45 -10.311  -4.303   0.249
  346   1HB   GLU  45           HB2      GLU  45 -11.964  -3.176  -0.759
  347   2HB   GLU  45           HB1      GLU  45 -13.166  -4.208   0.004
  348   1HG   GLU  45           HG2      GLU  45 -13.295  -2.747   1.930
  349   2HG   GLU  45           HG1      GLU  45 -11.922  -1.797   1.359
  350    H    LYS  46           HN       LYS  46 -12.637  -4.303   3.007
  351    HA   LYS  46           HA       LYS  46 -11.041  -2.362   4.442
  352   1HB   LYS  46           HB2      LYS  46 -12.589  -2.607   6.206
  353   2HB   LYS  46           HB1      LYS  46 -13.547  -2.902   4.755
  354   1HG   LYS  46           HG2      LYS  46 -13.057  -5.380   5.084
  355   2HG   LYS  46           HG1      LYS  46 -12.416  -4.955   6.670
  356   1HD   LYS  46           HD2      LYS  46 -14.994  -3.696   6.218
  357   2HD   LYS  46           HD1      LYS  46 -15.101  -5.447   6.032
  358   1HE   LYS  46           HE2      LYS  46 -13.731  -5.548   8.235
  359   2HE   LYS  46           HE1      LYS  46 -14.218  -3.865   8.439
  360   1HZ   LYS  46           HZ2      LYS  46 -16.319  -5.734   7.703
  361   2HZ   LYS  46           HZ1      LYS  46 -15.683  -5.911   9.269
  362   3HZ   LYS  46           HZ3      LYS  46 -16.355  -4.429   8.790
  363    H    GLU  47           HN       GLU  47 -11.255  -5.900   4.440
  364    HA   GLU  47           HA       GLU  47  -9.365  -6.149   6.648
  365   1HB   GLU  47           HB2      GLU  47 -10.701  -8.047   4.752
  366   2HB   GLU  47           HB1      GLU  47  -9.267  -8.588   5.624
  367   1HG   GLU  47           HG2      GLU  47 -10.925  -7.216   7.489
  368   2HG   GLU  47           HG1      GLU  47 -11.949  -8.348   6.609
  369    H    THR  48           HN       THR  48  -9.229  -5.945   3.150
  370    HA   THR  48           HA       THR  48  -6.500  -6.874   2.907
  371    HB   THR  48           HB       THR  48  -7.991  -5.021   1.030
  372    HG1  THR  48           HG1      THR  48  -8.537  -7.057   0.011
  373   1HG2  THR  48          HG21      THR  48  -5.381  -6.130   1.018
  374   2HG2  THR  48          HG23      THR  48  -6.312  -7.005  -0.197
  375   3HG2  THR  48          HG22      THR  48  -6.182  -5.248  -0.282
  376    H    PHE  49           HN       PHE  49  -7.972  -3.822   3.793
  377    HA   PHE  49           HA       PHE  49  -5.524  -2.287   3.272
  378   1HB   PHE  49           HB2      PHE  49  -8.033  -1.531   4.783
  379   2HB   PHE  49           HB1      PHE  49  -6.726  -0.428   4.397
  380    HD1  PHE  49           HD2      PHE  49  -6.135  -1.516   1.587
  381    HD2  PHE  49           HD1      PHE  49  -9.796  -0.523   3.596
  382    HE1  PHE  49           HE2      PHE  49  -7.218  -1.101  -0.601
  383    HE2  PHE  49           HE1      PHE  49 -10.884  -0.110   1.405
  384    HZ   PHE  49           HZ       PHE  49  -9.596  -0.405  -0.691
  385    H    CYS  50           HN       CYS  50  -7.132  -3.753   6.085
  386    HA   CYS  50           HA       CYS  50  -5.301  -2.528   7.984
  387   1HB   CYS  50           HB2      CYS  50  -6.265  -4.076   9.609
  388   2HB   CYS  50           HB1      CYS  50  -7.551  -3.391   8.636
  389    NH1  ARG  51           NH2      ARG  51  -7.721 -10.737   4.611
  390    NH2  ARG  51           NH1      ARG  51  -6.514 -10.552   2.712
  391    H    ARG  51           HN       ARG  51  -5.428  -5.618   6.232
  392    HA   ARG  51           HA       ARG  51  -3.145  -6.831   7.507
  393   1HB   ARG  51           HB2      ARG  51  -4.768  -7.309   5.035
  394   2HB   ARG  51           HB1      ARG  51  -3.165  -8.038   5.107
  395   1HG   ARG  51           HG2      ARG  51  -3.824  -9.580   6.622
  396   2HG   ARG  51           HG1      ARG  51  -4.669  -8.379   7.599
  397   1HD   ARG  51           HD2      ARG  51  -6.160 -10.166   6.593
  398   2HD   ARG  51           HD1      ARG  51  -6.628  -8.517   6.200
  399    HE   ARG  51           HE       ARG  51  -4.963  -9.268   4.107
  400   1HH1  ARG  51          HH21      ARG  51  -7.853 -10.549   5.582
  401   2HH1  ARG  51          HH22      ARG  51  -8.403 -11.272   4.114
  402   1HH2  ARG  51          HH11      ARG  51  -5.711 -10.213   2.223
  403   2HH2  ARG  51          HH12      ARG  51  -7.205 -11.089   2.227
  404    H    ALA  52           HN       ALA  52  -3.547  -5.311   4.308
  405    HA   ALA  52           HA       ALA  52  -0.773  -5.173   3.675
  406   1HB   ALA  52           HB1      ALA  52  -2.885  -4.761   2.192
  407   2HB   ALA  52           HB3      ALA  52  -2.748  -3.097   2.759
  408   3HB   ALA  52           HB2      ALA  52  -1.422  -3.836   1.861
  409    H    ALA  53           HN       ALA  53  -2.704  -3.323   5.890
  410    HA   ALA  53           HA       ALA  53  -1.099  -0.921   5.861
  411   1HB   ALA  53           HB1      ALA  53  -3.225  -2.084   7.606
  412   2HB   ALA  53           HB3      ALA  53  -2.182  -0.851   8.315
  413   3HB   ALA  53           HB2      ALA  53  -3.127  -0.484   6.871
  414    H    THR  54           HN       THR  54  -1.046  -3.953   7.714
  415    HA   THR  54           HA       THR  54   1.071  -3.097   9.503
  416    HB   THR  54           HB       THR  54  -0.484  -5.516   9.018
  417    HG1  THR  54           HG1      THR  54   1.031  -5.134  11.305
  418   1HG2  THR  54          HG21      THR  54   2.471  -5.806   9.621
  419   2HG2  THR  54          HG23      THR  54   1.278  -7.071   9.903
  420   3HG2  THR  54          HG22      THR  54   1.593  -6.510   8.263
  421    H    VAL  55           HN       VAL  55   1.020  -5.105   6.540
  422    HA   VAL  55           HA       VAL  55   3.840  -5.539   6.438
  423    HB   VAL  55           HB       VAL  55   1.886  -5.337   4.119
  424   1HG1  VAL  55          HG11      VAL  55   4.750  -6.070   4.387
  425   2HG1  VAL  55          HG13      VAL  55   3.773  -7.172   3.416
  426   3HG1  VAL  55          HG12      VAL  55   3.872  -5.465   2.983
  427   1HG2  VAL  55          HG22      VAL  55   1.565  -7.036   6.147
  428   2HG2  VAL  55          HG21      VAL  55   1.327  -7.565   4.481
  429   3HG2  VAL  55          HG23      VAL  55   2.843  -7.918   5.312
  430    H    LEU  56           HN       LEU  56   1.846  -2.791   5.570
  431    HA   LEU  56           HA       LEU  56   3.943  -1.462   4.041
  432   1HB   LEU  56           HB2      LEU  56   1.158  -0.936   4.734
  433   2HB   LEU  56           HB1      LEU  56   2.160   0.505   4.900
  434    HG   LEU  56           HG       LEU  56   3.113  -0.069   2.595
  435   1HD1  LEU  56          HD13      LEU  56   1.829  -2.431   2.908
  436   2HD1  LEU  56          HD12      LEU  56   0.598  -1.537   2.017
  437   3HD1  LEU  56          HD11      LEU  56   2.207  -1.745   1.328
  438   1HD2  LEU  56          HD21      LEU  56   1.417   1.726   3.068
  439   2HD2  LEU  56          HD23      LEU  56   1.277   1.035   1.453
  440   3HD2  LEU  56          HD22      LEU  56   0.147   0.553   2.718
  441    NH1  ARG  57           NH2      ARG  57   1.502   0.803  14.062
  442    NH2  ARG  57           NH1      ARG  57   2.806   2.634  13.845
  443    H    ARG  57           HN       ARG  57   2.869  -1.578   7.381
  444    HA   ARG  57           HA       ARG  57   4.189   0.742   8.363
  445   1HB   ARG  57           HB2      ARG  57   3.436  -1.906   9.597
  446   2HB   ARG  57           HB1      ARG  57   4.375  -0.727  10.515
  447   1HG   ARG  57           HG2      ARG  57   2.508   0.946   9.675
  448   2HG   ARG  57           HG1      ARG  57   1.561  -0.532   9.506
  449   1HD   ARG  57           HD2      ARG  57   1.078  -0.150  11.705
  450   2HD   ARG  57           HD1      ARG  57   2.633  -0.939  11.964
  451    HE   ARG  57           HE       ARG  57   3.293   1.728  11.617
  452   1HH1  ARG  57          HH21      ARG  57   1.122  -0.046  13.698
  453   2HH1  ARG  57          HH22      ARG  57   1.252   1.103  14.984
  454   1HH2  ARG  57          HH11      ARG  57   3.434   3.196  13.307
  455   2HH2  ARG  57          HH12      ARG  57   2.546   2.919  14.767
  456    H    GLN  58           HN       GLN  58   5.305  -2.603   7.900
  457    HA   GLN  58           HA       GLN  58   7.990  -2.099   8.838
  458   1HB   GLN  58           HB2      GLN  58   6.719  -4.243   7.134
  459   2HB   GLN  58           HB1      GLN  58   8.464  -4.202   7.390
  460   1HG   GLN  58           HG2      GLN  58   8.232  -4.462   9.743
  461   2HG   GLN  58           HG1      GLN  58   6.507  -4.100   9.688
  462   1HE2  GLN  58          HE22      GLN  58   7.788  -7.887   8.973
  463   2HE2  GLN  58          HE21      GLN  58   8.890  -6.635   9.289
  464    H    PHE  59           HN       PHE  59   6.337  -1.811   5.745
  465    HA   PHE  59           HA       PHE  59   8.510  -1.521   3.975
  466   1HB   PHE  59           HB2      PHE  59   5.860  -1.338   3.677
  467   2HB   PHE  59           HB1      PHE  59   6.210   0.384   3.752
  468    HD1  PHE  59           HD2      PHE  59   8.200   1.205   2.219
  469    HD2  PHE  59           HD1      PHE  59   6.027  -2.452   1.639
  470    HE1  PHE  59           HE2      PHE  59   8.921   1.153  -0.152
  471    HE2  PHE  59           HE1      PHE  59   6.744  -2.503  -0.733
  472    HZ   PHE  59           HZ       PHE  59   8.191  -0.700  -1.629
  473    OH   TYR  60           OH       TYR  60   5.827   3.853  11.685
  474    H    TYR  60           HN       TYR  60   6.976   0.993   6.018
  475    HA   TYR  60           HA       TYR  60   9.124   2.846   5.230
  476   1HB   TYR  60           HB2      TYR  60   7.744   4.557   5.904
  477   2HB   TYR  60           HB1      TYR  60   6.519   3.324   5.615
  478    HD1  TYR  60           HD2      TYR  60   5.533   2.058   7.505
  479    HD2  TYR  60           HD1      TYR  60   8.315   5.270   8.140
  480    HE1  TYR  60           HE2      TYR  60   4.857   2.174   9.889
  481    HE2  TYR  60           HE1      TYR  60   7.638   5.385  10.523
  482    HH   TYR  60           HH       TYR  60   4.888   3.658  11.736
  483    H    SER  61           HN       SER  61   8.648   0.612   7.734
  484    HA   SER  61           HA       SER  61  10.169   2.211   9.694
  485   1HB   SER  61           HB2      SER  61   8.512  -0.208   9.752
  486   2HB   SER  61           HB1      SER  61   9.969  -0.338  10.732
  487    HG   SER  61           HG       SER  61   8.513   0.636  12.033
  488    H    HIS  62           HN       HIS  62  10.553  -1.093   8.424
  489    HA   HIS  62           HA       HIS  62  13.455  -0.919   8.920
  490   1HB   HIS  62           HB2      HIS  62  11.647  -3.190   8.071
  491   2HB   HIS  62           HB1      HIS  62  13.392  -3.353   8.275
  492    HD1  HIS  62           HD1      HIS  62  12.486  -5.097  10.230
  493    HD2  HIS  62           HD2      HIS  62  12.030  -1.019  10.965
  494    HE1  HIS  62           HE1      HIS  62  12.114  -4.855  12.724
  495    H    HIS  63           HN       HIS  63  11.335  -1.688   6.129
  496    HA   HIS  63           HA       HIS  63  13.360  -2.087   4.233
  497   1HB   HIS  63           HB2      HIS  63  11.296  -2.598   3.361
  498   2HB   HIS  63           HB1      HIS  63  10.524  -1.183   4.070
  499    HD1  HIS  63           HD1      HIS  63  13.090  -1.981   1.365
  500    HD2  HIS  63           HD2      HIS  63  10.207   0.887   2.263
  501    HE1  HIS  63           HE1      HIS  63  13.013  -0.403  -0.612
  502    H    GLU  64           HN       GLU  64  12.341   0.920   5.691
  503    HA   GLU  64           HA       GLU  64  13.786   2.473   3.631
  504   1HB   GLU  64           HB2      GLU  64  11.712   3.452   4.448
  505   2HB   GLU  64           HB1      GLU  64  12.278   3.350   6.112
  506   1HG   GLU  64           HG2      GLU  64  12.485   5.610   4.680
  507   2HG   GLU  64           HG1      GLU  64  13.683   5.165   5.890
  508    H    LYS  65           HN       LYS  65  15.581   0.836   4.650
  509    HA   LYS  65           HA       LYS  65  17.548   2.505   5.875
  510   1HB   LYS  65           HB2      LYS  65  15.768   1.769   7.761
  511   2HB   LYS  65           HB1      LYS  65  16.823   0.355   7.803
  512   1HG   LYS  65           HG2      LYS  65  18.725   2.221   7.800
  513   2HG   LYS  65           HG1      LYS  65  17.432   3.195   8.502
  514   1HD   LYS  65           HD2      LYS  65  17.408   2.002  10.447
  515   2HD   LYS  65           HD1      LYS  65  17.728   0.472   9.629
  516   1HE   LYS  65           HE2      LYS  65  19.922   0.621  10.101
  517   2HE   LYS  65           HE1      LYS  65  20.009   2.216   9.356
  518   1HZ   LYS  65           HZ1      LYS  65  18.729   2.091  11.960
  519   2HZ   LYS  65           HZ3      LYS  65  20.398   1.792  11.946
  520   3HZ   LYS  65           HZ2      LYS  65  19.794   3.253  11.324
  521    H    ASP  66           HN       ASP  66  17.311   0.642   3.684
  522    HA   ASP  66           HA       ASP  66  19.485  -1.246   4.458
  523   1HB   ASP  66           HB2      ASP  66  16.926  -2.123   4.069
  524   2HB   ASP  66           HB1      ASP  66  17.572  -2.245   2.434
  525    H    THR  67           HN       THR  67  20.732  -1.976   2.524
  526    HA   THR  67           HA       THR  67  20.948   0.239   0.580
  527    HB   THR  67           HB       THR  67  22.702  -2.211   0.920
  528    HG1  THR  67           HG1      THR  67  23.474   0.340   1.709
  529   1HG2  THR  67          HG22      THR  67  22.638   0.023  -0.965
  530   2HG2  THR  67          HG21      THR  67  24.183  -0.108  -0.126
  531   3HG2  THR  67          HG23      THR  67  23.557  -1.480  -1.039
  532    NH1  ARG  68           NH2      ARG  68  16.365  -8.337  -2.401
  533    NH2  ARG  68           NH1      ARG  68  15.248  -8.732  -0.479
  534    H    ARG  68           HN       ARG  68  18.907  -2.228   0.629
  535    HA   ARG  68           HA       ARG  68  19.485  -3.525  -1.908
  536   1HB   ARG  68           HB2      ARG  68  17.153  -3.510  -0.006
  537   2HB   ARG  68           HB1      ARG  68  16.984  -4.223  -1.610
  538   1HG   ARG  68           HG2      ARG  68  19.460  -5.100  -0.425
  539   2HG   ARG  68           HG1      ARG  68  18.128  -5.423   0.683
  540   1HD   ARG  68           HD2      ARG  68  17.570  -6.060  -2.148
  541   2HD   ARG  68           HD1      ARG  68  18.811  -7.060  -1.392
  542    HE   ARG  68           HE       ARG  68  16.741  -7.026   0.458
  543   1HH1  ARG  68          HH21      ARG  68  17.072  -7.854  -2.916
  544   2HH1  ARG  68          HH22      ARG  68  15.799  -9.021  -2.860
  545   1HH2  ARG  68          HH11      ARG  68  15.096  -8.549   0.493
  546   2HH2  ARG  68          HH12      ARG  68  14.690  -9.415  -0.951
  547    H    CYS  69           HN       CYS  69  17.090  -1.082  -0.843
  548    HA   CYS  69           HA       CYS  69  16.410  -0.552  -3.671
  549   1HB   CYS  69           HB2      CYS  69  14.646  -0.631  -1.865
  550   2HB   CYS  69           HB1      CYS  69  15.351   0.841  -1.197
  551    H    LEU  70           HN       LEU  70  18.257   0.882  -1.049
  552    HA   LEU  70           HA       LEU  70  18.447   3.547  -1.966
  553   1HB   LEU  70           HB2      LEU  70  20.504   1.801  -0.587
  554   2HB   LEU  70           HB1      LEU  70  20.743   3.522  -0.883
  555    HG   LEU  70           HG       LEU  70  18.458   2.310   0.702
  556   1HD1  LEU  70          HD12      LEU  70  21.160   3.115   1.400
  557   2HD1  LEU  70          HD11      LEU  70  19.972   4.089   2.265
  558   3HD1  LEU  70          HD13      LEU  70  19.941   2.330   2.405
  559   1HD2  LEU  70          HD22      LEU  70  18.982   4.987  -0.434
  560   2HD2  LEU  70          HD21      LEU  70  17.461   4.268   0.095
  561   3HD2  LEU  70          HD23      LEU  70  18.552   4.990   1.276
  562    H    GLY  71           HN       GLY  71  20.951   1.049  -2.550
  563   1HA   GLY  71           HA2      GLY  71  21.830   0.536  -4.760
  564   2HA   GLY  71           HA1      GLY  71  21.213   2.088  -5.328
  565    H    ALA  72           HN       ALA  72  22.764   3.606  -5.623
  566    HA   ALA  72           HA       ALA  72  24.842   4.069  -3.645
  567   1HB   ALA  72           HB2      ALA  72  25.425   2.118  -5.560
  568   2HB   ALA  72           HB1      ALA  72  26.211   3.574  -6.170
  569   3HB   ALA  72           HB3      ALA  72  26.595   2.975  -4.557
  570    H    THR  73           HN       THR  73  22.742   5.574  -5.013
  571    HA   THR  73           HA       THR  73  24.463   7.597  -6.393
  572    HB   THR  73           HB       THR  73  21.799   8.034  -7.187
  573    HG1  THR  73           HG1      THR  73  21.796   5.712  -8.204
  574   1HG2  THR  73          HG22      THR  73  23.977   8.297  -8.458
  575   2HG2  THR  73          HG21      THR  73  23.943   6.554  -8.726
  576   3HG2  THR  73          HG23      THR  73  22.661   7.573  -9.382
  577    H    ALA  74           HN       ALA  74  23.725   9.847  -6.090
  578    HA   ALA  74           HA       ALA  74  22.737  10.253  -3.344
  579   1HB   ALA  74           HB2      ALA  74  24.013  11.978  -5.443
  580   2HB   ALA  74           HB1      ALA  74  23.114  12.746  -4.133
  581   3HB   ALA  74           HB3      ALA  74  24.500  11.716  -3.768
  582    H    GLN  75           HN       GLN  75  21.706  10.908  -6.673
  583    HA   GLN  75           HA       GLN  75  19.401  12.475  -6.007
  584   1HB   GLN  75           HB2      GLN  75  18.628  11.938  -8.276
  585   2HB   GLN  75           HB1      GLN  75  20.345  12.340  -8.297
  586   1HG   GLN  75           HG2      GLN  75  20.799   9.837  -8.096
  587   2HG   GLN  75           HG1      GLN  75  19.086   9.594  -8.437
  588   1HE2  GLN  75          HE22      GLN  75  21.498  10.072 -11.535
  589   2HE2  GLN  75          HE21      GLN  75  21.974   9.537  -9.995
  590    H    GLN  76           HN       GLN  76  19.903   8.982  -6.366
  591    HA   GLN  76           HA       GLN  76  17.159   8.213  -6.163
  592   1HB   GLN  76           HB2      GLN  76  19.359   6.830  -6.710
  593   2HB   GLN  76           HB1      GLN  76  19.298   6.486  -4.981
  594   1HG   GLN  76           HG2      GLN  76  17.850   4.833  -5.535
  595   2HG   GLN  76           HG1      GLN  76  16.671   6.126  -5.756
  596   1HE2  GLN  76          HE22      GLN  76  17.791   3.997  -8.948
  597   2HE2  GLN  76          HE21      GLN  76  18.099   3.523  -7.349
  598    H    PHE  77           HN       PHE  77  19.442   9.299  -3.750
  599    HA   PHE  77           HA       PHE  77  18.091   8.144  -1.472
  600   1HB   PHE  77           HB2      PHE  77  20.400   9.766  -1.936
  601   2HB   PHE  77           HB1      PHE  77  19.395  10.575  -0.733
  602    HD1  PHE  77           HD2      PHE  77  18.411   9.035   1.159
  603    HD2  PHE  77           HD1      PHE  77  21.819   8.035  -1.256
  604    HE1  PHE  77           HE2      PHE  77  19.149   7.406   2.877
  605    HE2  PHE  77           HE1      PHE  77  22.558   6.405   0.460
  606    HZ   PHE  77           HZ       PHE  77  21.222   6.090   2.527
  607    H    HIS  78           HN       HIS  78  18.059  11.442  -2.872
  608    HA   HIS  78           HA       HIS  78  16.112  12.520  -1.111
  609   1HB   HIS  78           HB2      HIS  78  17.338  14.002  -2.569
  610   2HB   HIS  78           HB1      HIS  78  16.740  13.168  -4.004
  611    HD1  HIS  78           HD1      HIS  78  14.463  13.852  -4.896
  612    HD2  HIS  78           HD2      HIS  78  15.279  15.523  -1.165
  613    HE1  HIS  78           HE1      HIS  78  12.618  15.525  -4.440
  614    NH1  ARG  79           NH2      ARG  79  10.051  11.338  -8.834
  615    NH2  ARG  79           NH1      ARG  79  10.421  13.564  -8.774
  616    H    ARG  79           HN       ARG  79  15.693  10.921  -4.268
  617    HA   ARG  79           HA       ARG  79  12.837  11.109  -4.308
  618   1HB   ARG  79           HB2      ARG  79  14.865   9.385  -5.695
  619   2HB   ARG  79           HB1      ARG  79  13.153   8.978  -5.827
  620   1HG   ARG  79           HG2      ARG  79  13.857  11.835  -6.246
  621   2HG   ARG  79           HG1      ARG  79  14.374  10.710  -7.503
  622   1HD   ARG  79           HD2      ARG  79  12.214  10.149  -8.090
  623   2HD   ARG  79           HD1      ARG  79  11.584  10.454  -6.471
  624    HE   ARG  79           HE       ARG  79  12.342  12.961  -7.368
  625   1HH1  ARG  79          HH21      ARG  79  10.296  10.405  -8.575
  626   2HH1  ARG  79          HH22      ARG  79   9.252  11.496  -9.414
  627   1HH2  ARG  79          HH11      ARG  79  10.959  14.349  -8.464
  628   2HH2  ARG  79          HH12      ARG  79   9.618  13.705  -9.352
  629    H    HIS  80           HN       HIS  80  15.038   8.909  -2.702
  630    HA   HIS  80           HA       HIS  80  13.195   6.780  -2.188
  631   1HB   HIS  80           HB2      HIS  80  15.851   7.197  -1.673
  632   2HB   HIS  80           HB1      HIS  80  15.157   7.373  -0.062
  633    HD1  HIS  80           HD1      HIS  80  13.261   5.329   0.437
  634    HD2  HIS  80           HD2      HIS  80  16.356   4.552  -2.245
  635    HE1  HIS  80           HE1      HIS  80  13.436   2.808   0.255
  636    H    LYS  81           HN       LYS  81  14.093   9.639  -0.238
  637    HA   LYS  81           HA       LYS  81  12.365   9.115   1.952
  638   1HB   LYS  81           HB2      LYS  81  14.195  10.954   1.623
  639   2HB   LYS  81           HB1      LYS  81  12.864  11.914   0.975
  640   1HG   LYS  81           HG2      LYS  81  11.862  12.140   3.013
  641   2HG   LYS  81           HG1      LYS  81  12.291  10.505   3.516
  642   1HD   LYS  81           HD2      LYS  81  13.500  12.172   4.869
  643   2HD   LYS  81           HD1      LYS  81  14.625  11.236   3.883
  644   1HE   LYS  81           HE2      LYS  81  15.135  13.016   2.526
  645   2HE   LYS  81           HE1      LYS  81  13.522  13.716   2.661
  646   1HZ   LYS  81           HZ2      LYS  81  14.062  14.369   4.941
  647   2HZ   LYS  81           HZ1      LYS  81  15.635  13.757   4.748
  648   3HZ   LYS  81           HZ3      LYS  81  15.119  15.077   3.817
  649    H    GLN  82           HN       GLN  82  11.645  10.252  -1.269
  650    HA   GLN  82           HA       GLN  82   9.070  11.426  -0.584
  651   1HB   GLN  82           HB2      GLN  82  10.613  10.858  -3.055
  652   2HB   GLN  82           HB1      GLN  82   8.858  10.890  -3.234
  653   1HG   GLN  82           HG2      GLN  82  10.196  13.077  -1.680
  654   2HG   GLN  82           HG1      GLN  82  10.248  13.126  -3.444
  655   1HE2  GLN  82          HE22      GLN  82   7.115  14.789  -3.177
  656   2HE2  GLN  82          HE21      GLN  82   8.766  14.973  -3.526
  657    H    LEU  83           HN       LEU  83  10.197   8.260  -1.678
  658    HA   LEU  83           HA       LEU  83   7.540   7.197  -2.148
  659   1HB   LEU  83           HB2      LEU  83   9.616   6.270  -3.182
  660   2HB   LEU  83           HB1      LEU  83  10.125   5.714  -1.587
  661    HG   LEU  83           HG       LEU  83   7.384   4.918  -2.277
  662   1HD1  LEU  83          HD12      LEU  83   9.655   4.377  -4.120
  663   2HD1  LEU  83          HD11      LEU  83   8.626   3.001  -3.717
  664   3HD1  LEU  83          HD13      LEU  83   7.924   4.441  -4.455
  665   1HD2  LEU  83          HD23      LEU  83   9.861   3.786  -1.048
  666   2HD2  LEU  83          HD22      LEU  83   8.205   3.775  -0.444
  667   3HD2  LEU  83          HD21      LEU  83   8.689   2.648  -1.711
  668    H    ILE  84           HN       ILE  84   9.924   6.679   0.455
  669    HA   ILE  84           HA       ILE  84   8.280   5.078   2.119
  670    HB   ILE  84           HB       ILE  84  10.397   7.043   3.045
  671   1HG1  ILE  84          HG12      ILE  84  11.429   5.754   1.312
  672   2HG1  ILE  84          HG11      ILE  84  11.896   4.994   2.830
  673   1HG2  ILE  84          HG23      ILE  84   8.807   5.633   4.634
  674   2HG2  ILE  84          HG22      ILE  84   9.921   4.332   4.213
  675   3HG2  ILE  84          HG21      ILE  84  10.526   5.793   4.991
  676   1HD1  ILE  84          HD11      ILE  84  10.031   3.366   2.560
  677   2HD1  ILE  84          HD13      ILE  84   9.669   4.081   0.990
  678   3HD1  ILE  84          HD12      ILE  84  11.209   3.268   1.253
  679    NH1  ARG  85           NH2      ARG  85   6.517  15.832   2.173
  680    NH2  ARG  85           NH1      ARG  85   4.419  15.470   1.418
  681    H    ARG  85           HN       ARG  85   8.660   8.618   1.967
  682    HA   ARG  85           HA       ARG  85   7.012   9.232   4.215
  683   1HB   ARG  85           HB2      ARG  85   8.477  10.892   3.084
  684   2HB   ARG  85           HB1      ARG  85   7.410  10.852   1.680
  685   1HG   ARG  85           HG2      ARG  85   5.515  11.526   3.216
  686   2HG   ARG  85           HG1      ARG  85   6.721  11.785   4.478
  687   1HD   ARG  85           HD2      ARG  85   7.191  13.815   3.635
  688   2HD   ARG  85           HD1      ARG  85   7.620  13.085   2.087
  689    HE   ARG  85           HE       ARG  85   4.856  13.139   2.038
  690   1HH1  ARG  85          HH21      ARG  85   7.371  15.501   2.570
  691   2HH1  ARG  85          HH22      ARG  85   6.420  16.802   1.947
  692   1HH2  ARG  85          HH11      ARG  85   3.655  14.849   1.237
  693   2HH2  ARG  85          HH12      ARG  85   4.335  16.441   1.199
  694    H    PHE  86           HN       PHE  86   6.224   8.901   0.758
  695    HA   PHE  86           HA       PHE  86   3.468   9.540   0.930
  696   1HB   PHE  86           HB2      PHE  86   5.246   8.391  -1.016
  697   2HB   PHE  86           HB1      PHE  86   3.761   7.441  -0.965
  698    HD1  PHE  86           HD1      PHE  86   5.210  10.762  -1.634
  699    HD2  PHE  86           HD2      PHE  86   1.602   8.430  -1.534
  700    HE1  PHE  86           HE1      PHE  86   4.027  12.537  -2.899
  701    HE2  PHE  86           HE2      PHE  86   0.420  10.206  -2.800
  702    HZ   PHE  86           HZ       PHE  86   1.633  12.260  -3.482
  703    H    LEU  87           HN       LEU  87   5.187   6.523   1.608
  704    HA   LEU  87           HA       LEU  87   2.816   4.902   1.893
  705   1HB   LEU  87           HB2      LEU  87   5.378   4.244   1.684
  706   2HB   LEU  87           HB1      LEU  87   5.311   4.313   3.446
  707    HG   LEU  87           HG       LEU  87   3.026   2.902   2.271
  708   1HD1  LEU  87          HD12      LEU  87   5.130   2.410   0.761
  709   2HD1  LEU  87          HD11      LEU  87   5.629   1.414   2.128
  710   3HD1  LEU  87          HD13      LEU  87   4.108   1.079   1.302
  711   1HD2  LEU  87          HD23      LEU  87   4.971   2.655   4.515
  712   2HD2  LEU  87          HD22      LEU  87   3.214   2.505   4.529
  713   3HD2  LEU  87          HD21      LEU  87   4.209   1.165   3.957
  714    H    LYS  88           HN       LYS  88   4.684   6.942   4.091
  715    HA   LYS  88           HA       LYS  88   3.506   6.081   6.539
  716   1HB   LYS  88           HB2      LYS  88   4.762   8.666   5.627
  717   2HB   LYS  88           HB1      LYS  88   4.039   8.536   7.231
  718   1HG   LYS  88           HG2      LYS  88   5.490   6.280   7.265
  719   2HG   LYS  88           HG1      LYS  88   6.476   7.214   6.140
  720   1HD   LYS  88           HD2      LYS  88   5.566   8.273   8.827
  721   2HD   LYS  88           HD1      LYS  88   7.123   7.485   8.570
  722   1HE   LYS  88           HE2      LYS  88   7.974   9.432   7.832
  723   2HE   LYS  88           HE1      LYS  88   6.802   9.432   6.515
  724   1HZ   LYS  88           HZ1      LYS  88   6.127  10.357   9.244
  725   2HZ   LYS  88           HZ3      LYS  88   6.746  11.401   8.060
  726   3HZ   LYS  88           HZ2      LYS  88   5.261  10.616   7.806
  727    NH1  ARG  89           NH2      ARG  89  -1.502  14.312   1.567
  728    NH2  ARG  89           NH1      ARG  89  -2.139  13.115  -0.239
  729    H    ARG  89           HN       ARG  89   2.475   8.546   4.182
  730    HA   ARG  89           HA       ARG  89   0.225   9.456   5.732
  731   1HB   ARG  89           HB2      ARG  89   1.146  10.789   3.885
  732   2HB   ARG  89           HB1      ARG  89   0.684   9.531   2.736
  733   1HG   ARG  89           HG2      ARG  89  -1.578   9.999   2.917
  734   2HG   ARG  89           HG1      ARG  89  -1.419  10.652   4.547
  735   1HD   ARG  89           HD2      ARG  89  -1.463  12.700   3.598
  736   2HD   ARG  89           HD1      ARG  89   0.157  12.346   2.995
  737    HE   ARG  89           HE       ARG  89  -1.535  11.176   1.132
  738   1HH1  ARG  89          HH21      ARG  89  -1.149  14.363   2.500
  739   2HH1  ARG  89          HH22      ARG  89  -1.724  15.155   1.076
  740   1HH2  ARG  89          HH11      ARG  89  -2.277  12.235  -0.694
  741   2HH2  ARG  89          HH12      ARG  89  -2.356  13.965  -0.719
  742    H    LEU  90           HN       LEU  90   0.467   7.151   3.017
  743    HA   LEU  90           HA       LEU  90  -2.317   6.437   3.069
  744   1HB   LEU  90           HB2      LEU  90  -0.702   6.020   1.163
  745   2HB   LEU  90           HB1      LEU  90  -0.036   4.692   2.112
  746    HG   LEU  90           HG       LEU  90  -2.288   3.658   2.220
  747   1HD1  LEU  90          HD12      LEU  90  -2.995   6.236   0.957
  748   2HD1  LEU  90          HD11      LEU  90  -3.769   4.823   0.240
  749   3HD1  LEU  90          HD13      LEU  90  -3.979   5.166   1.957
  750   1HD2  LEU  90          HD23      LEU  90  -1.191   4.331  -0.521
  751   2HD2  LEU  90          HD22      LEU  90  -0.854   2.894   0.445
  752   3HD2  LEU  90          HD21      LEU  90  -2.454   3.129  -0.258
  753    H    ASP  91           HN       ASP  91   0.226   5.673   5.249
  754    HA   ASP  91           HA       ASP  91  -0.631   3.036   6.007
  755   1HB   ASP  91           HB2      ASP  91   1.470   4.718   6.700
  756   2HB   ASP  91           HB1      ASP  91   0.515   4.621   8.180
  757    NH1  ARG  92           NH2      ARG  92  -0.331   5.631  13.312
  758    NH2  ARG  92           NH1      ARG  92   0.913   7.367  12.578
  759    H    ARG  92           HN       ARG  92  -1.437   6.294   7.231
  760    HA   ARG  92           HA       ARG  92  -3.364   5.099   9.125
  761   1HB   ARG  92           HB2      ARG  92  -1.798   7.337   9.287
  762   2HB   ARG  92           HB1      ARG  92  -3.351   8.029   8.819
  763   1HG   ARG  92           HG2      ARG  92  -3.533   7.960  11.155
  764   2HG   ARG  92           HG1      ARG  92  -4.321   6.456  10.675
  765   1HD   ARG  92           HD2      ARG  92  -2.763   6.002  12.502
  766   2HD   ARG  92           HD1      ARG  92  -2.160   5.256  11.022
  767    HE   ARG  92           HE       ARG  92  -0.959   7.754  11.047
  768   1HH1  ARG  92          HH21      ARG  92  -1.158   5.073  13.274
  769   2HH1  ARG  92          HH22      ARG  92   0.389   5.407  13.969
  770   1HH2  ARG  92          HH11      ARG  92   1.038   8.151  11.968
  771   2HH2  ARG  92          HH12      ARG  92   1.624   7.130  13.240
  772    H    ASN  93           HN       ASN  93  -3.386   6.494   5.943
  773    HA   ASN  93           HA       ASN  93  -6.215   7.253   6.027
  774   1HB   ASN  93           HB2      ASN  93  -4.145   7.023   3.841
  775   2HB   ASN  93           HB1      ASN  93  -5.842   7.319   3.463
  776   1HD2  ASN  93          HD22      ASN  93  -5.361  10.760   3.985
  777   2HD2  ASN  93          HD21      ASN  93  -6.024   9.525   3.027
  778    H    LEU  94           HN       LEU  94  -4.414   4.781   4.195
  779    HA   LEU  94           HA       LEU  94  -6.606   3.265   3.278
  780   1HB   LEU  94           HB2      LEU  94  -4.106   3.035   2.729
  781   2HB   LEU  94           HB1      LEU  94  -3.978   2.082   4.204
  782    HG   LEU  94           HG       LEU  94  -6.068   0.829   3.091
  783   1HD1  LEU  94          HD13      LEU  94  -4.947   2.492   0.985
  784   2HD1  LEU  94          HD12      LEU  94  -4.879   0.781   0.564
  785   3HD1  LEU  94          HD11      LEU  94  -6.422   1.526   0.978
  786   1HD2  LEU  94          HD23      LEU  94  -3.897  -0.158   3.809
  787   2HD2  LEU  94          HD22      LEU  94  -4.446  -0.833   2.277
  788   3HD2  LEU  94          HD21      LEU  94  -3.174   0.384   2.296
  789    CH2  TRP  95           CH2      TRP  95  -2.540   0.244  13.168
  790    H    TRP  95           HN       TRP  95  -4.743   2.972   6.268
  791    HA   TRP  95           HA       TRP  95  -6.188   0.783   7.430
  792   1HB   TRP  95           HB2      TRP  95  -3.977   1.428   8.194
  793   2HB   TRP  95           HB1      TRP  95  -4.498   3.064   8.515
  794    HD1  TRP  95           HD1      TRP  95  -7.116   2.069  10.386
  795    HE1  TRP  95           HE1      TRP  95  -6.587   1.360  12.766
  796    HE3  TRP  95           HE3      TRP  95  -2.190   0.963   9.850
  797    HZ2  TRP  95           HZ2      TRP  95  -4.369   0.437  14.280
  798    HZ3  TRP  95           HZ3      TRP  95  -0.878   0.161  11.800
  799    HH2  TRP  95           HH2      TRP  95  -1.975  -0.112  14.011
  800    H    GLY  96           HN       GLY  96  -6.623   4.293   7.441
  801   1HA   GLY  96           HA2      GLY  96  -8.417   4.833   9.435
  802   2HA   GLY  96           HA1      GLY  96  -8.582   5.553   7.837
  803    H    LEU  97           HN       LEU  97  -9.251   3.238   6.372
  804    HA   LEU  97           HA       LEU  97 -12.033   2.876   7.320
  805   1HB   LEU  97           HB2      LEU  97 -10.588   2.469   4.731
  806   2HB   LEU  97           HB1      LEU  97 -12.055   1.535   5.024
  807    HG   LEU  97           HG       LEU  97 -12.845   4.022   5.839
  808   1HD1  LEU  97          HD13      LEU  97 -10.800   4.324   3.632
  809   2HD1  LEU  97          HD12      LEU  97 -12.093   5.499   3.876
  810   3HD1  LEU  97          HD11      LEU  97 -10.907   5.218   5.150
  811   1HD2  LEU  97          HD21      LEU  97 -13.826   2.286   4.168
  812   2HD2  LEU  97          HD23      LEU  97 -14.229   3.986   3.927
  813   3HD2  LEU  97          HD22      LEU  97 -12.987   3.224   2.933
  814    H    ALA  98           HN       ALA  98  -9.062   1.060   6.945
  815    HA   ALA  98           HA       ALA  98 -10.248  -1.558   7.212
  816   1HB   ALA  98           HB3      ALA  98  -7.687  -0.493   6.659
  817   2HB   ALA  98           HB2      ALA  98  -7.505  -1.508   8.089
  818   3HB   ALA  98           HB1      ALA  98  -8.191  -2.177   6.616
  819    H    GLY  99           HN       GLY  99  -7.869  -0.157   9.451
  820   1HA   GLY  99           HA2      GLY  99  -8.136   0.071  11.855
  821   2HA   GLY  99           HA1      GLY  99  -9.563  -0.975  11.762
  822    H    LEU 100           HN       LEU 100  -6.091  -0.896  11.725
  823    HA   LEU 100           HA       LEU 100  -5.765  -3.760  11.378
  824   1HB   LEU 100           HB2      LEU 100  -4.155  -2.045  10.540
  825   2HB   LEU 100           HB1      LEU 100  -3.758  -1.666  12.207
  826    HG   LEU 100           HG       LEU 100  -2.836  -3.852  12.575
  827   1HD1  LEU 100          HD11      LEU 100  -4.411  -4.493  10.161
  828   2HD1  LEU 100          HD13      LEU 100  -2.806  -5.218  10.200
  829   3HD1  LEU 100          HD12      LEU 100  -3.944  -5.531  11.507
  830   1HD2  LEU 100          HD21      LEU 100  -1.935  -2.062  10.541
  831   2HD2  LEU 100          HD23      LEU 100  -0.966  -3.119  11.569
  832   3HD2  LEU 100          HD22      LEU 100  -1.571  -3.707  10.019
  833    H    ASN 101           HN       ASN 101  -6.923  -2.177  13.996
  834    HA   ASN 101           HA       ASN 101  -5.288  -3.132  16.135
  835   1HB   ASN 101           HB2      ASN 101  -8.282  -2.641  15.983
  836   2HB   ASN 101           HB1      ASN 101  -7.423  -3.009  17.479
  837   1HD2  ASN 101          HD22      ASN 101  -5.502   0.153  17.188
  838   2HD2  ASN 101          HD21      ASN 101  -5.131  -1.496  17.343
  839    H    SER 102           HN       SER 102  -8.488  -4.501  15.354
  840    HA   SER 102           HA       SER 102  -7.445  -7.190  16.024
  841   1HB   SER 102           HB2      SER 102 -10.256  -6.249  15.383
  842   2HB   SER 102           HB1      SER 102  -9.821  -7.872  15.908
  843    HG   SER 102           HG       SER 102  -9.179  -5.530  17.369
  844    H    CYS 103           HN       CYS 103  -6.100  -6.961  13.902
  845    HA   CYS 103           HA       CYS 103  -7.712  -8.170  11.713
  846   1HB   CYS 103           HB2      CYS 103  -7.590  -5.877  11.035
  847   2HB   CYS 103           HB1      CYS 103  -5.889  -5.768  11.473
  848    HA   PRO 104           HA       PRO 104  -3.956 -10.630  12.779
  849   1HB   PRO 104           HB2      PRO 104  -5.377 -12.821  11.520
  850   2HB   PRO 104           HB1      PRO 104  -4.922 -12.639  13.220
  851   1HG   PRO 104           HG2      PRO 104  -7.550 -12.399  12.091
  852   2HG   PRO 104           HG1      PRO 104  -7.075 -12.148  13.775
  853   1HD   PRO 104           HD2      PRO 104  -7.864 -10.153  11.852
  854   2HD   PRO 104           HD1      PRO 104  -7.371  -9.904  13.539
  855    H    VAL 105           HN       VAL 105  -2.660  -9.651  11.189
  856    HA   VAL 105           HA       VAL 105  -3.082  -9.548   8.432
  857    HB   VAL 105           HB       VAL 105  -0.577  -9.456   8.219
  858   1HG1  VAL 105          HG12      VAL 105  -2.321  -7.772   9.869
  859   2HG1  VAL 105          HG11      VAL 105  -0.612  -7.600  10.273
  860   3HG1  VAL 105          HG13      VAL 105  -1.162  -7.313   8.623
  861   1HG2  VAL 105          HG23      VAL 105  -0.825 -10.719  10.835
  862   2HG2  VAL 105          HG22      VAL 105   0.595 -10.563   9.803
  863   3HG2  VAL 105          HG21      VAL 105   0.167  -9.263  10.915
  864    H    LYS 106           HN       LYS 106  -3.888 -11.410   7.445
  865    HA   LYS 106           HA       LYS 106  -2.707 -14.030   7.888
  866   1HB   LYS 106           HB2      LYS 106  -5.032 -13.023   6.624
  867   2HB   LYS 106           HB1      LYS 106  -4.108 -13.845   5.366
  868   1HG   LYS 106           HG2      LYS 106  -4.531 -15.141   8.054
  869   2HG   LYS 106           HG1      LYS 106  -5.759 -15.261   6.794
  870   1HD   LYS 106           HD2      LYS 106  -2.895 -15.899   6.142
  871   2HD   LYS 106           HD1      LYS 106  -3.894 -17.104   6.953
  872   1HE   LYS 106           HE2      LYS 106  -5.100 -17.526   5.081
  873   2HE   LYS 106           HE1      LYS 106  -5.237 -15.814   4.680
  874   1HZ   LYS 106           HZ2      LYS 106  -2.585 -16.939   4.402
  875   2HZ   LYS 106           HZ1      LYS 106  -3.739 -17.557   3.318
  876   3HZ   LYS 106           HZ3      LYS 106  -3.436 -15.889   3.372
  877    H    GLU 107           HN       GLU 107  -0.539 -14.077   7.348
  878    HA   GLU 107           HA       GLU 107   0.388 -12.858   4.828
  879   1HB   GLU 107           HB2      GLU 107   1.729 -14.213   7.155
  880   2HB   GLU 107           HB1      GLU 107   2.607 -13.928   5.654
  881   1HG   GLU 107           HG2      GLU 107   1.969 -11.511   5.801
  882   2HG   GLU 107           HG1      GLU 107   1.250 -11.839   7.377
  883    H    ALA 108           HN       ALA 108   0.587 -13.906   2.986
  884    HA   ALA 108           HA       ALA 108   0.087 -16.812   2.880
  885   1HB   ALA 108           HB2      ALA 108  -0.945 -15.110   1.278
  886   2HB   ALA 108           HB1      ALA 108   0.668 -14.926   0.589
  887   3HB   ALA 108           HB3      ALA 108  -0.149 -16.488   0.517
  888    H    ASP 109           HN       ASP 109   1.729 -17.181   0.504
  889    HA   ASP 109           HA       ASP 109   4.220 -17.882   1.795
  890   1HB   ASP 109           HB2      ASP 109   2.892 -18.627  -0.559
  891   2HB   ASP 109           HB1      ASP 109   4.364 -17.827  -1.113
  892    H    GLN 110           HN       GLN 110   6.273 -17.188   0.183
  893    HA   GLN 110           HA       GLN 110   6.422 -14.272   0.606
  894   1HB   GLN 110           HB2      GLN 110   8.269 -16.322   0.846
  895   2HB   GLN 110           HB1      GLN 110   8.733 -15.555  -0.672
  896   1HG   GLN 110           HG2      GLN 110   9.908 -14.247   0.849
  897   2HG   GLN 110           HG1      GLN 110   8.409 -13.329   0.712
  898   1HE2  GLN 110          HE22      GLN 110   8.822 -13.639   4.333
  899   2HE2  GLN 110          HE21      GLN 110   9.438 -12.726   3.041
  900    H    SER 111           HN       SER 111   4.981 -13.586  -1.082
  901    HA   SER 111           HA       SER 111   5.480 -14.336  -3.856
  902   1HB   SER 111           HB2      SER 111   3.791 -12.592  -4.360
  903   2HB   SER 111           HB1      SER 111   3.223 -13.683  -3.099
  904    HG   SER 111           HG       SER 111   4.412 -11.123  -2.750
  905    H    THR 112           HN       THR 112   5.470 -12.001  -5.269
  906    HA   THR 112           HA       THR 112   8.042 -10.746  -4.419
  907    HB   THR 112           HB       THR 112   8.271 -10.108  -6.825
  908    HG1  THR 112           HG1      THR 112   5.724 -10.805  -6.846
  909   1HG2  THR 112          HG21      THR 112   8.479 -12.693  -5.636
  910   2HG2  THR 112          HG23      THR 112   7.939 -12.904  -7.302
  911   3HG2  THR 112          HG22      THR 112   9.430 -12.025  -6.963
  912    H    LEU 113           HN       LEU 113   8.150  -8.492  -4.256
  913    HA   LEU 113           HA       LEU 113   5.723  -7.110  -3.674
  914   1HB   LEU 113           HB2      LEU 113   8.064  -6.540  -2.847
  915   2HB   LEU 113           HB1      LEU 113   8.335  -5.780  -4.415
  916    HG   LEU 113           HG       LEU 113   6.368  -4.320  -4.035
  917   1HD1  LEU 113          HD13      LEU 113   6.199  -6.005  -1.557
  918   2HD1  LEU 113          HD12      LEU 113   5.655  -4.329  -1.489
  919   3HD1  LEU 113          HD11      LEU 113   4.904  -5.454  -2.621
  920   1HD2  LEU 113          HD21      LEU 113   8.865  -4.060  -2.966
  921   2HD2  LEU 113          HD23      LEU 113   7.618  -2.819  -2.851
  922   3HD2  LEU 113          HD22      LEU 113   7.873  -3.940  -1.514
  923    H    GLU 114           HN       GLU 114   7.208  -7.767  -6.718
  924    HA   GLU 114           HA       GLU 114   6.267  -5.425  -8.119
  925   1HB   GLU 114           HB2      GLU 114   7.671  -7.852  -8.761
  926   2HB   GLU 114           HB1      GLU 114   6.347  -7.632  -9.905
  927   1HG   GLU 114           HG2      GLU 114   7.116  -5.288 -10.286
  928   2HG   GLU 114           HG1      GLU 114   8.493  -5.600  -9.230
  929    H    ASN 115           HN       ASN 115   4.977  -8.720  -7.725
  930    HA   ASN 115           HA       ASN 115   2.535  -8.138  -9.182
  931   1HB   ASN 115           HB2      ASN 115   3.370 -10.398  -7.353
  932   2HB   ASN 115           HB1      ASN 115   1.773 -10.322  -8.098
  933   1HD2  ASN 115          HD22      ASN 115   3.461 -12.197 -10.659
  934   2HD2  ASN 115          HD21      ASN 115   2.521 -12.367  -9.256
  935    H    PHE 116           HN       PHE 116   3.585  -7.581  -5.917
  936    HA   PHE 116           HA       PHE 116   0.929  -7.545  -4.735
  937   1HB   PHE 116           HB2      PHE 116   2.906  -7.878  -3.325
  938   2HB   PHE 116           HB1      PHE 116   3.542  -6.307  -3.812
  939    HD1  PHE 116           HD1      PHE 116   0.398  -7.798  -2.393
  940    HD2  PHE 116           HD2      PHE 116   3.129  -4.482  -2.426
  941    HE1  PHE 116           HE1      PHE 116  -0.905  -6.706  -0.586
  942    HE2  PHE 116           HE2      PHE 116   1.827  -3.390  -0.621
  943    HZ   PHE 116           HZ       PHE 116  -0.190  -4.501   0.300
  944    H    LEU 117           HN       LEU 117   3.196  -5.028  -5.854
  945    HA   LEU 117           HA       LEU 117   1.418  -2.832  -5.327
  946   1HB   LEU 117           HB2      LEU 117   4.049  -3.209  -6.413
  947   2HB   LEU 117           HB1      LEU 117   3.127  -2.186  -7.515
  948    HG   LEU 117           HG       LEU 117   4.290  -0.859  -5.763
  949   1HD1  LEU 117          HD12      LEU 117   1.530  -0.769  -6.491
  950   2HD1  LEU 117          HD11      LEU 117   1.656  -0.305  -4.794
  951   3HD1  LEU 117          HD13      LEU 117   2.575   0.571  -6.019
  952   1HD2  LEU 117          HD21      LEU 117   3.892  -2.831  -4.064
  953   2HD2  LEU 117          HD23      LEU 117   3.904  -1.168  -3.478
  954   3HD2  LEU 117          HD22      LEU 117   2.371  -1.997  -3.748
  955    H    GLU 118           HN       GLU 118   1.896  -4.989  -8.072
  956    HA   GLU 118           HA       GLU 118   0.365  -3.517  -9.988
  957   1HB   GLU 118           HB2      GLU 118   1.483  -5.224 -11.047
  958   2HB   GLU 118           HB1      GLU 118   1.308  -6.324  -9.678
  959   1HG   GLU 118           HG2      GLU 118  -0.898  -6.908 -10.279
  960   2HG   GLU 118           HG1      GLU 118  -1.075  -5.507 -11.336
  961    NH1  ARG 119           NH2      ARG 119  -4.688 -11.909  -7.672
  962    NH2  ARG 119           NH1      ARG 119  -2.809 -13.161  -7.714
  963    H    ARG 119           HN       ARG 119  -0.621  -6.352  -8.050
  964    HA   ARG 119           HA       ARG 119  -3.393  -6.187  -8.655
  965   1HB   ARG 119           HB2      ARG 119  -2.079  -7.218  -6.121
  966   2HB   ARG 119           HB1      ARG 119  -3.717  -7.588  -6.657
  967   1HG   ARG 119           HG2      ARG 119  -1.889  -8.111  -8.813
  968   2HG   ARG 119           HG1      ARG 119  -1.318  -8.937  -7.362
  969   1HD   ARG 119           HD2      ARG 119  -4.001  -9.463  -7.242
  970   2HD   ARG 119           HD1      ARG 119  -3.737  -9.437  -8.986
  971    HE   ARG 119           HE       ARG 119  -1.671 -11.011  -8.030
  972   1HH1  ARG 119          HH21      ARG 119  -5.148 -11.024  -7.718
  973   2HH1  ARG 119          HH22      ARG 119  -5.227 -12.741  -7.541
  974   1HH2  ARG 119          HH11      ARG 119  -1.816 -13.236  -7.795
  975   2HH2  ARG 119          HH12      ARG 119  -3.363 -13.984  -7.585
  976    H    LEU 120           HN       LEU 120  -1.418  -4.251  -6.529
  977    HA   LEU 120           HA       LEU 120  -3.529  -3.341  -4.785
  978   1HB   LEU 120           HB2      LEU 120  -0.720  -2.800  -5.188
  979   2HB   LEU 120           HB1      LEU 120  -1.606  -1.281  -5.043
  980    HG   LEU 120           HG       LEU 120  -1.766  -3.607  -3.101
  981   1HD1  LEU 120          HD13      LEU 120   0.213  -1.671  -3.349
  982   2HD1  LEU 120          HD12      LEU 120  -0.860  -1.001  -2.121
  983   3HD1  LEU 120          HD11      LEU 120  -0.142  -2.596  -1.890
  984   1HD2  LEU 120          HD21      LEU 120  -3.477  -1.313  -3.608
  985   2HD2  LEU 120          HD23      LEU 120  -3.728  -2.662  -2.501
  986   3HD2  LEU 120          HD22      LEU 120  -2.808  -1.250  -1.978
  987    H    LYS 121           HN       LYS 121  -2.019  -1.917  -7.695
  988    HA   LYS 121           HA       LYS 121  -3.721   0.379  -7.846
  989   1HB   LYS 121           HB2      LYS 121  -1.532  -0.284  -9.178
  990   2HB   LYS 121           HB1      LYS 121  -2.689  -0.976 -10.315
  991   1HG   LYS 121           HG2      LYS 121  -3.785   1.155 -10.611
  992   2HG   LYS 121           HG1      LYS 121  -2.842   1.877  -9.305
  993   1HD   LYS 121           HD2      LYS 121  -1.836   2.569 -11.389
  994   2HD   LYS 121           HD1      LYS 121  -0.761   1.383 -10.648
  995   1HE   LYS 121           HE2      LYS 121  -2.014  -0.374 -12.060
  996   2HE   LYS 121           HE1      LYS 121  -2.655   0.994 -12.968
  997   1HZ   LYS 121           HZ3      LYS 121  -0.215   1.705 -13.126
  998   2HZ   LYS 121           HZ2      LYS 121   0.143   0.100 -12.698
  999   3HZ   LYS 121           HZ1      LYS 121  -0.742   0.430 -14.111
 1000    H    THR 122           HN       THR 122  -3.822  -2.638  -9.678
 1001    HA   THR 122           HA       THR 122  -6.179  -2.341 -11.109
 1002    HB   THR 122           HB       THR 122  -6.262  -4.992 -10.139
 1003    HG1  THR 122           HG1      THR 122  -4.229  -4.504  -9.187
 1004   1HG2  THR 122          HG21      THR 122  -6.596  -4.237 -12.467
 1005   2HG2  THR 122          HG23      THR 122  -4.885  -3.821 -12.572
 1006   3HG2  THR 122          HG22      THR 122  -5.372  -5.504 -12.380
 1007    H    ILE 123           HN       ILE 123  -5.896  -3.373  -7.738
 1008    HA   ILE 123           HA       ILE 123  -8.691  -3.918  -7.362
 1009    HB   ILE 123           HB       ILE 123  -6.467  -3.278  -5.419
 1010   1HG1  ILE 123          HG12      ILE 123  -6.575  -5.457  -6.825
 1011   2HG1  ILE 123          HG11      ILE 123  -6.351  -5.612  -5.082
 1012   1HG2  ILE 123          HG23      ILE 123  -9.396  -3.685  -5.005
 1013   2HG2  ILE 123          HG22      ILE 123  -8.296  -4.449  -3.858
 1014   3HG2  ILE 123          HG21      ILE 123  -8.259  -2.701  -4.086
 1015   1HD1  ILE 123          HD11      ILE 123  -9.120  -5.610  -6.266
 1016   2HD1  ILE 123          HD13      ILE 123  -8.163  -7.090  -6.235
 1017   3HD1  ILE 123          HD12      ILE 123  -8.576  -6.275  -4.726
 1018    H    MET 124           HN       MET 124  -6.746  -1.022  -6.581
 1019    HA   MET 124           HA       MET 124  -8.829   0.446  -5.333
 1020   1HB   MET 124           HB2      MET 124  -6.489   1.515  -6.930
 1021   2HB   MET 124           HB1      MET 124  -7.467   2.445  -5.795
 1022   1HG   MET 124           HG2      MET 124  -5.952  -0.061  -5.017
 1023   2HG   MET 124           HG1      MET 124  -5.296   1.567  -4.842
 1024   1HE   MET 124           HE2      MET 124  -5.138   2.530  -3.109
 1025   2HE   MET 124           HE1      MET 124  -6.601   3.493  -2.952
 1026   3HE   MET 124           HE3      MET 124  -6.047   2.491  -1.604
 1027    NH1  ARG 125           NH2      ARG 125  -8.185  -0.338 -15.312
 1028    NH2  ARG 125           NH1      ARG 125  -6.664   1.241 -15.850
 1029    H    ARG 125           HN       ARG 125  -7.809   0.523  -8.757
 1030    HA   ARG 125           HA       ARG 125  -9.894   2.414  -9.464
 1031   1HB   ARG 125           HB2      ARG 125  -7.768   2.279 -10.708
 1032   2HB   ARG 125           HB1      ARG 125  -8.183   0.646 -11.233
 1033   1HG   ARG 125           HG2      ARG 125 -10.416   2.299 -11.829
 1034   2HG   ARG 125           HG1      ARG 125  -8.979   3.154 -12.390
 1035   1HD   ARG 125           HD2      ARG 125  -9.139   0.234 -12.977
 1036   2HD   ARG 125           HD1      ARG 125 -10.198   1.302 -13.897
 1037    HE   ARG 125           HE       ARG 125  -7.719   2.530 -14.050
 1038   1HH1  ARG 125          HH21      ARG 125  -8.951  -0.658 -14.758
 1039   2HH1  ARG 125          HH22      ARG 125  -7.810  -0.928 -16.025
 1040   1HH2  ARG 125          HH11      ARG 125  -6.258   2.143 -15.706
 1041   2HH2  ARG 125          HH12      ARG 125  -6.302   0.638 -16.562
 1042    H    GLU 126           HN       GLU 126  -9.394  -0.997 -10.358
 1043    HA   GLU 126           HA       GLU 126 -11.702  -1.521 -11.765
 1044   1HB   GLU 126           HB2      GLU 126  -9.986  -3.208 -11.440
 1045   2HB   GLU 126           HB1      GLU 126 -10.374  -3.315  -9.721
 1046   1HG   GLU 126           HG2      GLU 126 -12.090  -4.724 -10.118
 1047   2HG   GLU 126           HG1      GLU 126 -12.752  -3.661 -11.361
 1048    H    LYS 127           HN       LYS 127 -11.480  -1.529  -8.186
 1049    HA   LYS 127           HA       LYS 127 -14.370  -2.129  -8.040
 1050   1HB   LYS 127           HB2      LYS 127 -12.163  -2.613  -6.369
 1051   2HB   LYS 127           HB1      LYS 127 -13.142  -1.430  -5.504
 1052   1HG   LYS 127           HG2      LYS 127 -14.981  -3.282  -6.571
 1053   2HG   LYS 127           HG1      LYS 127 -13.653  -4.248  -5.931
 1054   1HD   LYS 127           HD2      LYS 127 -13.847  -3.213  -3.761
 1055   2HD   LYS 127           HD1      LYS 127 -15.001  -2.029  -4.374
 1056   1HE   LYS 127           HE2      LYS 127 -16.514  -3.981  -4.971
 1057   2HE   LYS 127           HE1      LYS 127 -15.415  -5.009  -4.053
 1058   1HZ   LYS 127           HZ3      LYS 127 -15.802  -3.079  -2.295
 1059   2HZ   LYS 127           HZ2      LYS 127 -17.285  -2.983  -3.118
 1060   3HZ   LYS 127           HZ1      LYS 127 -16.807  -4.442  -2.389
 1061    OH   TYR 128           OH       TYR 128 -11.533  -0.777  -1.684
 1062    H    TYR 128           HN       TYR 128 -12.202   0.564  -7.143
 1063    HA   TYR 128           HA       TYR 128 -14.549   2.189  -6.397
 1064   1HB   TYR 128           HB2      TYR 128 -11.664   3.076  -6.458
 1065   2HB   TYR 128           HB1      TYR 128 -12.993   3.771  -5.529
 1066    HD1  TYR 128           HD2      TYR 128 -14.344   1.290  -4.601
 1067    HD2  TYR 128           HD1      TYR 128 -10.177   2.314  -4.750
 1068    HE1  TYR 128           HE2      TYR 128 -13.892  -0.297  -2.754
 1069    HE2  TYR 128           HE1      TYR 128  -9.722   0.722  -2.900
 1070    HH   TYR 128           HH       TYR 128 -11.205  -1.593  -2.070
 1071    H    SER 129           HN       SER 129 -13.965   1.405  -9.291
 1072    HA   SER 129           HA       SER 129 -13.393   4.045 -10.490
 1073   1HB   SER 129           HB2      SER 129 -12.417   2.342 -11.779
 1074   2HB   SER 129           HB1      SER 129 -13.792   1.262 -11.571
 1075    HG   SER 129           HG       SER 129 -14.706   2.158 -13.239
 1076    H    LYS 130           HN       LYS 130 -16.089   1.901  -9.825
 1077    HA   LYS 130           HA       LYS 130 -17.911   3.911 -11.080
 1078   1HB   LYS 130           HB2      LYS 130 -17.687   1.144 -11.570
 1079   2HB   LYS 130           HB1      LYS 130 -19.150   1.330 -10.607
 1080   1HG   LYS 130           HG2      LYS 130 -18.899   3.380 -12.691
 1081   2HG   LYS 130           HG1      LYS 130 -18.959   1.744 -13.344
 1082   1HD   LYS 130           HD2      LYS 130 -20.898   2.075 -11.207
 1083   2HD   LYS 130           HD1      LYS 130 -21.142   3.275 -12.477
 1084   1HE   LYS 130           HE2      LYS 130 -21.067   1.429 -14.166
 1085   2HE   LYS 130           HE1      LYS 130 -20.985   0.270 -12.840
 1086   1HZ   LYS 130           HZ1      LYS 130 -23.076   1.638 -12.056
 1087   2HZ   LYS 130           HZ3      LYS 130 -23.216   1.939 -13.718
 1088   3HZ   LYS 130           HZ2      LYS 130 -23.216   0.340 -13.143
 1089    H    CYS 131           HN       CYS 131 -16.940   4.203  -8.415
 1090    HA   CYS 131           HA       CYS 131 -18.550   3.091  -6.384
 1091   1HB   CYS 131           HB2      CYS 131 -16.564   4.522  -5.952
 1092   2HB   CYS 131           HB1      CYS 131 -17.474   5.926  -6.511
 1093    H    SER 132           HN       SER 132 -19.122   6.054  -8.303
 1094    HA   SER 132           HA       SER 132 -21.689   6.584  -7.079
 1095   1HB   SER 132           HB2      SER 132 -20.120   7.656  -9.357
 1096   2HB   SER 132           HB1      SER 132 -21.867   7.840  -9.480
 1097    HG   SER 132           HG       SER 132 -21.490   9.499  -8.229
 1098    H    SER 133           HN       SER 133 -23.638   5.666  -7.558
 1099    HA   SER 133           HA       SER 133 -23.710   3.737  -9.827
 1100   1HB   SER 133           HB2      SER 133 -25.311   4.017  -7.287
 1101   2HB   SER 133           HB1      SER 133 -25.901   3.041  -8.629
 1102    HG   SER 133           HG       SER 133 -24.593   1.557  -7.949
   
  Start of MODEL           7
 Raw file had 1102 H/Q atoms
  Start of MODEL    7
    1   1H    GLU   1           HT1      GLU   1 -21.435  20.837   8.361
    2   2H    GLU   1           HT3      GLU   1 -21.026  22.011   9.517
    3   3H    GLU   1           HT2      GLU   1 -21.878  22.459   8.116
    4    HA   GLU   1           HA       GLU   1 -20.057  22.377   6.777
    5   1HB   GLU   1           HB2      GLU   1 -19.402  24.141   8.143
    6   2HB   GLU   1           HB1      GLU   1 -19.280  23.121   9.577
    7   1HG   GLU   1           HG2      GLU   1 -17.200  22.233   8.919
    8   2HG   GLU   1           HG1      GLU   1 -17.425  22.713   7.237
    9    H    ALA   2           HN       ALA   2 -19.433  20.433   9.701
   10    HA   ALA   2           HA       ALA   2 -17.258  18.976   8.393
   11   1HB   ALA   2           HB3      ALA   2 -17.711  19.470  10.972
   12   2HB   ALA   2           HB2      ALA   2 -18.593  17.947  10.863
   13   3HB   ALA   2           HB1      ALA   2 -16.877  18.004  10.458
   14    H    GLU   3           HN       GLU   3 -17.575  17.264   7.063
   15    HA   GLU   3           HA       GLU   3 -19.468  15.178   7.565
   16   1HB   GLU   3           HB2      GLU   3 -20.949  17.153   6.772
   17   2HB   GLU   3           HB1      GLU   3 -20.248  16.854   5.181
   18   1HG   GLU   3           HG2      GLU   3 -22.170  15.509   5.146
   19   2HG   GLU   3           HG1      GLU   3 -20.912  14.369   5.626
   20    H    ALA   4           HN       ALA   4 -17.550  13.984   7.091
   21    HA   ALA   4           HA       ALA   4 -16.799  13.978   4.194
   22   1HB   ALA   4           HB1      ALA   4 -15.153  14.389   6.420
   23   2HB   ALA   4           HB3      ALA   4 -14.861  12.711   5.961
   24   3HB   ALA   4           HB2      ALA   4 -14.620  14.003   4.785
   25    H    HIS   5           HN       HIS   5 -17.018  12.037   3.137
   26    HA   HIS   5           HA       HIS   5 -18.125   9.780   4.704
   27   1HB   HIS   5           HB2      HIS   5 -18.861  10.798   2.290
   28   2HB   HIS   5           HB1      HIS   5 -17.784   9.499   1.775
   29    HD1  HIS   5           HD1      HIS   5 -18.614   7.114   2.030
   30    HD2  HIS   5           HD2      HIS   5 -21.105   9.875   3.915
   31    HE1  HIS   5           HE1      HIS   5 -20.675   5.837   2.762
   32    H    LYS   6           HN       LYS   6 -17.268   7.581   4.304
   33    HA   LYS   6           HA       LYS   6 -14.307   7.666   3.997
   34   1HB   LYS   6           HB2      LYS   6 -16.235   5.901   5.452
   35   2HB   LYS   6           HB1      LYS   6 -14.713   5.196   4.905
   36   1HG   LYS   6           HG2      LYS   6 -13.616   6.176   6.604
   37   2HG   LYS   6           HG1      LYS   6 -14.175   7.763   6.074
   38   1HD   LYS   6           HD2      LYS   6 -15.996   7.755   7.509
   39   2HD   LYS   6           HD1      LYS   6 -16.097   5.995   7.539
   40   1HE   LYS   6           HE2      LYS   6 -15.271   6.762   9.695
   41   2HE   LYS   6           HE1      LYS   6 -13.959   5.945   8.844
   42   1HZ   LYS   6           HZ3      LYS   6 -13.697   8.481   7.994
   43   2HZ   LYS   6           HZ2      LYS   6 -14.225   8.718   9.592
   44   3HZ   LYS   6           HZ1      LYS   6 -12.827   7.804   9.283
   45    H    CYS   7           HN       CYS   7 -15.232   7.876   1.545
   46    HA   CYS   7           HA       CYS   7 -14.426   5.477   0.224
   47   1HB   CYS   7           HB2      CYS   7 -16.998   5.241   1.188
   48   2HB   CYS   7           HB1      CYS   7 -17.262   5.781  -0.470
   49    H    ASP   8           HN       ASP   8 -16.350   8.456   0.014
   50    HA   ASP   8           HA       ASP   8 -16.020   8.657  -2.872
   51   1HB   ASP   8           HB2      ASP   8 -17.933   9.659  -1.537
   52   2HB   ASP   8           HB1      ASP   8 -16.794  10.881  -0.973
   53    H    ILE   9           HN       ILE   9 -14.921  10.941  -0.341
   54    HA   ILE   9           HA       ILE   9 -12.715  11.745  -2.131
   55    HB   ILE   9           HB       ILE   9 -14.262  13.008  -0.080
   56   1HG1  ILE   9          HG12      ILE   9 -11.981  14.015  -1.810
   57   2HG1  ILE   9          HG11      ILE   9 -13.678  13.947  -2.287
   58   1HG2  ILE   9          HG21      ILE   9 -11.264  13.089   0.403
   59   2HG2  ILE   9          HG23      ILE   9 -12.462  14.104   1.203
   60   3HG2  ILE   9          HG22      ILE   9 -12.460  12.365   1.483
   61   1HD1  ILE   9          HD13      ILE   9 -14.002  15.329  -0.036
   62   2HD1  ILE   9          HD12      ILE   9 -12.324  15.778  -0.347
   63   3HD1  ILE   9          HD11      ILE   9 -13.570  16.136  -1.543
   64    H    THR  10           HN       THR  10 -13.198   9.808   0.738
   65    HA   THR  10           HA       THR  10 -10.434   9.893   1.610
   66    HB   THR  10           HB       THR  10 -12.622   7.879   2.193
   67    HG1  THR  10           HG1      THR  10 -12.698   9.094   4.156
   68   1HG2  THR  10          HG22      THR  10  -9.812   8.237   3.183
   69   2HG2  THR  10          HG21      THR  10 -11.043   7.610   4.280
   70   3HG2  THR  10          HG23      THR  10 -10.671   6.749   2.785
   71    H    LEU  11           HN       LEU  11 -12.335   7.301   0.008
   72    HA   LEU  11           HA       LEU  11  -9.973   5.720  -0.516
   73   1HB   LEU  11           HB2      LEU  11 -12.843   5.500  -0.943
   74   2HB   LEU  11           HB1      LEU  11 -11.933   4.891  -2.323
   75    HG   LEU  11           HG       LEU  11 -10.474   3.702  -0.489
   76   1HD1  LEU  11          HD13      LEU  11 -11.700   4.937   1.354
   77   2HD1  LEU  11          HD12      LEU  11 -13.112   3.953   0.974
   78   3HD1  LEU  11          HD11      LEU  11 -11.633   3.187   1.552
   79   1HD2  LEU  11          HD23      LEU  11 -12.245   2.771  -2.207
   80   2HD2  LEU  11          HD22      LEU  11 -11.684   1.744  -0.887
   81   3HD2  LEU  11          HD21      LEU  11 -13.241   2.563  -0.767
   82    H    GLN  12           HN       GLN  12 -11.551   8.322  -2.237
   83    HA   GLN  12           HA       GLN  12 -10.446   7.722  -4.841
   84   1HB   GLN  12           HB2      GLN  12 -12.358   9.251  -4.563
   85   2HB   GLN  12           HB1      GLN  12 -11.338  10.375  -3.666
   86   1HG   GLN  12           HG2      GLN  12 -11.437  11.182  -5.924
   87   2HG   GLN  12           HG1      GLN  12  -9.837  10.470  -5.717
   88   1HE2  GLN  12          HE22      GLN  12 -10.355   8.029  -8.207
   89   2HE2  GLN  12          HE21      GLN  12  -9.269   8.785  -7.142
   90    H    GLU  13           HN       GLU  13  -9.471  10.114  -2.356
   91    HA   GLU  13           HA       GLU  13  -7.032  10.835  -3.667
   92   1HB   GLU  13           HB2      GLU  13  -8.330  11.798  -1.497
   93   2HB   GLU  13           HB1      GLU  13  -7.077  10.851  -0.692
   94   1HG   GLU  13           HG2      GLU  13  -5.771  12.683  -1.005
   95   2HG   GLU  13           HG1      GLU  13  -5.646  12.116  -2.671
   96    H    ILE  14           HN       ILE  14  -7.898   8.218  -1.483
   97    HA   ILE  14           HA       ILE  14  -5.278   7.305  -0.827
   98    HB   ILE  14           HB       ILE  14  -7.980   6.384  -0.526
   99   1HG1  ILE  14          HG12      ILE  14  -5.683   4.948   0.726
  100   2HG1  ILE  14          HG11      ILE  14  -5.832   6.676   1.052
  101   1HG2  ILE  14          HG23      ILE  14  -6.033   4.260  -1.493
  102   2HG2  ILE  14          HG22      ILE  14  -7.621   3.949  -0.798
  103   3HG2  ILE  14          HG21      ILE  14  -7.489   4.784  -2.342
  104   1HD1  ILE  14          HD12      ILE  14  -8.439   5.588   1.275
  105   2HD1  ILE  14          HD11      ILE  14  -7.366   4.499   2.154
  106   3HD1  ILE  14          HD13      ILE  14  -7.423   6.210   2.574
  107    H    ILE  15           HN       ILE  15  -7.338   6.803  -3.632
  108    HA   ILE  15           HA       ILE  15  -5.751   4.745  -4.859
  109    HB   ILE  15           HB       ILE  15  -8.024   6.473  -5.590
  110   1HG1  ILE  15          HG12      ILE  15  -7.322   3.657  -6.448
  111   2HG1  ILE  15          HG11      ILE  15  -8.023   4.023  -4.873
  112   1HG2  ILE  15          HG21      ILE  15  -6.056   5.469  -7.656
  113   2HG2  ILE  15          HG23      ILE  15  -7.730   5.866  -8.038
  114   3HG2  ILE  15          HG22      ILE  15  -6.642   7.119  -7.441
  115   1HD1  ILE  15          HD11      ILE  15  -9.948   5.094  -5.977
  116   2HD1  ILE  15          HD13      ILE  15  -9.252   4.719  -7.552
  117   3HD1  ILE  15          HD12      ILE  15  -9.775   3.415  -6.487
  118    H    LYS  16           HN       LYS  16  -5.920   8.276  -5.423
  119    HA   LYS  16           HA       LYS  16  -3.972   8.420  -7.463
  120   1HB   LYS  16           HB2      LYS  16  -5.337  10.358  -6.747
  121   2HB   LYS  16           HB1      LYS  16  -4.443  10.418  -5.228
  122   1HG   LYS  16           HG2      LYS  16  -2.491  10.352  -7.264
  123   2HG   LYS  16           HG1      LYS  16  -3.710  11.508  -7.803
  124   1HD   LYS  16           HD2      LYS  16  -2.281  11.522  -5.129
  125   2HD   LYS  16           HD1      LYS  16  -2.045  12.670  -6.447
  126   1HE   LYS  16           HE2      LYS  16  -4.593  13.112  -6.233
  127   2HE   LYS  16           HE1      LYS  16  -4.447  12.330  -4.659
  128   1HZ   LYS  16           HZ3      LYS  16  -2.352  14.178  -4.982
  129   2HZ   LYS  16           HZ2      LYS  16  -3.823  14.957  -5.322
  130   3HZ   LYS  16           HZ1      LYS  16  -3.595  14.178  -3.829
  131    H    THR  17           HN       THR  17  -3.575   8.277  -3.954
  132    HA   THR  17           HA       THR  17  -0.709   8.650  -3.978
  133    HB   THR  17           HB       THR  17  -2.213   7.120  -1.859
  134    HG1  THR  17           HG1      THR  17  -3.279   8.845  -1.341
  135   1HG2  THR  17          HG22      THR  17   0.268   7.422  -1.723
  136   2HG2  THR  17          HG21      THR  17   0.013   9.166  -1.707
  137   3HG2  THR  17          HG23      THR  17  -0.598   8.173  -0.383
  138    H    LEU  18           HN       LEU  18  -2.856   5.875  -4.211
  139    HA   LEU  18           HA       LEU  18  -0.989   3.788  -3.789
  140   1HB   LEU  18           HB2      LEU  18  -3.626   3.830  -4.292
  141   2HB   LEU  18           HB1      LEU  18  -3.054   3.433  -5.913
  142    HG   LEU  18           HG       LEU  18  -3.474   1.374  -4.663
  143   1HD1  LEU  18          HD13      LEU  18  -1.427   1.671  -6.209
  144   2HD1  LEU  18          HD12      LEU  18  -0.478   1.731  -4.725
  145   3HD1  LEU  18          HD11      LEU  18  -1.418   0.291  -5.111
  146   1HD2  LEU  18          HD22      LEU  18  -2.935   2.654  -2.432
  147   2HD2  LEU  18          HD21      LEU  18  -2.598   0.926  -2.544
  148   3HD2  LEU  18          HD23      LEU  18  -1.289   2.093  -2.729
  149    H    ASN  19           HN       ASN  19  -1.728   5.676  -6.702
  150    HA   ASN  19           HA       ASN  19   0.030   4.075  -8.393
  151   1HB   ASN  19           HB2      ASN  19  -2.014   5.507  -9.109
  152   2HB   ASN  19           HB1      ASN  19  -0.897   6.871  -9.034
  153   1HD2  ASN  19          HD22      ASN  19  -0.751   5.483 -12.503
  154   2HD2  ASN  19          HD21      ASN  19  -1.964   6.179 -11.540
  155    H    SER  20           HN       SER  20   0.324   7.070  -6.539
  156    HA   SER  20           HA       SER  20   2.784   7.965  -7.700
  157   1HB   SER  20           HB2      SER  20   2.243   8.431  -4.798
  158   2HB   SER  20           HB1      SER  20   2.812   9.557  -6.027
  159    HG   SER  20           HG       SER  20   0.774  10.150  -5.935
  160    H    LEU  21           HN       LEU  21   2.103   5.561  -5.209
  161    HA   LEU  21           HA       LEU  21   4.861   5.382  -4.311
  162   1HB   LEU  21           HB2      LEU  21   2.372   3.757  -3.893
  163   2HB   LEU  21           HB1      LEU  21   3.936   3.074  -3.443
  164    HG   LEU  21           HG       LEU  21   3.492   5.866  -2.574
  165   1HD1  LEU  21          HD13      LEU  21   1.552   3.756  -1.997
  166   2HD1  LEU  21          HD12      LEU  21   2.276   4.421  -0.533
  167   3HD1  LEU  21          HD11      LEU  21   1.453   5.486  -1.674
  168   1HD2  LEU  21          HD21      LEU  21   4.791   3.349  -1.635
  169   2HD2  LEU  21          HD23      LEU  21   5.418   4.997  -1.653
  170   3HD2  LEU  21          HD22      LEU  21   4.281   4.501  -0.400
  171    H    THR  22           HN       THR  22   3.044   3.982  -6.946
  172    HA   THR  22           HA       THR  22   4.967   1.819  -7.385
  173    HB   THR  22           HB       THR  22   3.652   1.805  -9.684
  174    HG1  THR  22           HG1      THR  22   1.591   2.850  -8.173
  175   1HG2  THR  22          HG22      THR  22   3.521   0.097  -7.894
  176   2HG2  THR  22          HG21      THR  22   2.340   1.094  -7.047
  177   3HG2  THR  22          HG23      THR  22   1.945   0.405  -8.621
  178    H    GLU  23           HN       GLU  23   5.266   5.097  -7.826
  179    HA   GLU  23           HA       GLU  23   6.281   5.345 -10.471
  180   1HB   GLU  23           HB2      GLU  23   6.122   6.965  -8.128
  181   2HB   GLU  23           HB1      GLU  23   7.791   7.011  -8.697
  182   1HG   GLU  23           HG2      GLU  23   6.721   8.752  -9.893
  183   2HG   GLU  23           HG1      GLU  23   6.784   7.413 -11.040
  184    H    GLN  24           HN       GLN  24   7.841   4.365  -7.446
  185    HA   GLN  24           HA       GLN  24  10.403   3.900  -8.870
  186   1HB   GLN  24           HB2      GLN  24   9.530   3.961  -5.995
  187   2HB   GLN  24           HB1      GLN  24  11.004   3.096  -6.430
  188   1HG   GLN  24           HG2      GLN  24  11.559   5.305  -7.757
  189   2HG   GLN  24           HG1      GLN  24  10.399   6.028  -6.641
  190   1HE2  GLN  24          HE22      GLN  24  13.807   6.144  -5.065
  191   2HE2  GLN  24          HE21      GLN  24  13.155   6.748  -6.511
  192    H    LYS  25           HN       LYS  25   8.553   2.256  -9.941
  193    HA   LYS  25           HA       LYS  25   8.476  -0.295  -8.482
  194   1HB   LYS  25           HB2      LYS  25   7.130   0.888 -10.800
  195   2HB   LYS  25           HB1      LYS  25   7.567  -0.803 -11.044
  196   1HG   LYS  25           HG2      LYS  25   6.492  -1.353  -8.859
  197   2HG   LYS  25           HG1      LYS  25   5.960   0.324  -8.735
  198   1HD   LYS  25           HD2      LYS  25   4.199  -0.103 -10.066
  199   2HD   LYS  25           HD1      LYS  25   5.272  -0.696 -11.335
  200   1HE   LYS  25           HE2      LYS  25   5.166  -2.915 -10.561
  201   2HE   LYS  25           HE1      LYS  25   4.601  -2.427  -8.964
  202   1HZ   LYS  25           HZ1      LYS  25   2.735  -1.452 -10.723
  203   2HZ   LYS  25           HZ3      LYS  25   3.094  -3.004 -11.304
  204   3HZ   LYS  25           HZ2      LYS  25   2.561  -2.800  -9.703
  205    H    THR  26           HN       THR  26  10.911  -0.518  -8.474
  206    HA   THR  26           HA       THR  26  11.753  -2.324 -10.536
  207    HB   THR  26           HB       THR  26  13.720  -0.426 -11.029
  208    HG1  THR  26           HG1      THR  26  12.609   1.442 -11.512
  209   1HG2  THR  26          HG21      THR  26  12.205  -2.058 -12.509
  210   2HG2  THR  26          HG23      THR  26  11.363  -0.547 -12.856
  211   3HG2  THR  26          HG22      THR  26  13.081  -0.705 -13.224
  212    H    LEU  27           HN       LEU  27  13.318   0.210  -8.538
  213    HA   LEU  27           HA       LEU  27  15.290  -1.783  -7.613
  214   1HB   LEU  27           HB2      LEU  27  15.298   1.012  -8.039
  215   2HB   LEU  27           HB1      LEU  27  15.501   0.779  -6.304
  216    HG   LEU  27           HG       LEU  27  17.097  -0.889  -8.230
  217   1HD1  LEU  27          HD11      LEU  27  17.214   1.979  -8.014
  218   2HD1  LEU  27          HD13      LEU  27  18.688   1.285  -7.341
  219   3HD1  LEU  27          HD12      LEU  27  18.212   0.908  -8.996
  220   1HD2  LEU  27          HD21      LEU  27  17.011  -0.295  -5.358
  221   2HD2  LEU  27          HD23      LEU  27  17.740  -1.665  -6.197
  222   3HD2  LEU  27          HD22      LEU  27  18.631  -0.151  -6.040
  223    H    CYS  28           HN       CYS  28  12.670   0.192  -6.261
  224    HA   CYS  28           HA       CYS  28  13.180  -0.843  -3.565
  225   1HB   CYS  28           HB2      CYS  28  11.522   1.246  -4.772
  226   2HB   CYS  28           HB1      CYS  28  10.692   0.362  -3.490
  227    H    THR  29           HN       THR  29  11.446  -1.974  -6.300
  228    HA   THR  29           HA       THR  29   9.471  -3.445  -4.677
  229    HB   THR  29           HB       THR  29   8.686  -4.312  -6.853
  230    HG1  THR  29           HG1      THR  29  11.148  -3.515  -7.571
  231   1HG2  THR  29          HG22      THR  29   7.956  -2.083  -5.970
  232   2HG2  THR  29          HG21      THR  29   9.216  -1.335  -6.951
  233   3HG2  THR  29          HG23      THR  29   7.892  -2.201  -7.728
  234    H    GLU  30           HN       GLU  30  12.644  -3.921  -4.968
  235    HA   GLU  30           HA       GLU  30  12.551  -6.784  -5.690
  236   1HB   GLU  30           HB2      GLU  30  14.574  -4.693  -5.599
  237   2HB   GLU  30           HB1      GLU  30  15.123  -6.133  -4.744
  238   1HG   GLU  30           HG2      GLU  30  13.769  -6.784  -7.253
  239   2HG   GLU  30           HG1      GLU  30  15.183  -5.758  -7.496
  240    H    LEU  31           HN       LEU  31  10.978  -6.419  -3.537
  241    HA   LEU  31           HA       LEU  31  12.497  -7.747  -1.376
  242   1HB   LEU  31           HB2      LEU  31  10.750  -5.296  -0.954
  243   2HB   LEU  31           HB1      LEU  31  11.415  -6.293   0.338
  244    HG   LEU  31           HG       LEU  31  13.145  -4.928  -1.739
  245   1HD1  LEU  31          HD12      LEU  31  11.808  -3.291  -0.385
  246   2HD1  LEU  31          HD11      LEU  31  12.521  -3.985   1.071
  247   3HD1  LEU  31          HD13      LEU  31  13.546  -3.175  -0.115
  248   1HD2  LEU  31          HD22      LEU  31  13.991  -6.932  -0.382
  249   2HD2  LEU  31          HD21      LEU  31  14.948  -5.456  -0.258
  250   3HD2  LEU  31          HD23      LEU  31  13.841  -5.901   1.041
  251    H    THR  32           HN       THR  32  11.333  -9.633  -1.861
  252    HA   THR  32           HA       THR  32   8.636  -9.961  -2.464
  253    HB   THR  32           HB       THR  32   8.925 -12.152  -1.010
  254    HG1  THR  32           HG1      THR  32  10.711 -11.569   0.139
  255   1HG2  THR  32          HG21      THR  32  10.128 -11.306  -3.596
  256   2HG2  THR  32          HG23      THR  32  10.680 -12.842  -2.928
  257   3HG2  THR  32          HG22      THR  32   8.967 -12.590  -3.261
  258    H    VAL  33           HN       VAL  33   6.732 -10.335  -1.186
  259    HA   VAL  33           HA       VAL  33   6.905  -9.657   1.696
  260    HB   VAL  33           HB       VAL  33   5.072  -8.002   1.465
  261   1HG1  VAL  33          HG12      VAL  33   7.642  -7.515   1.183
  262   2HG1  VAL  33          HG11      VAL  33   7.193  -7.162  -0.486
  263   3HG1  VAL  33          HG13      VAL  33   6.469  -6.245   0.836
  264   1HG2  VAL  33          HG21      VAL  33   4.249  -9.070  -0.729
  265   2HG2  VAL  33          HG23      VAL  33   4.254  -7.308  -0.666
  266   3HG2  VAL  33          HG22      VAL  33   5.538  -8.164  -1.520
  267    H    THR  34           HN       THR  34   4.214  -9.584   2.282
  268    HA   THR  34           HA       THR  34   3.491 -12.388   1.958
  269    HB   THR  34           HB       THR  34   2.838 -10.267   3.744
  270    HG1  THR  34           HG1      THR  34   1.819 -12.089   4.821
  271   1HG2  THR  34          HG23      THR  34   0.854  -9.847   2.322
  272   2HG2  THR  34          HG22      THR  34   0.388 -11.540   2.485
  273   3HG2  THR  34          HG21      THR  34   0.399 -10.488   3.897
  274    H    ASP  35           HN       ASP  35   1.938 -13.236   0.611
  275    HA   ASP  35           HA       ASP  35   0.852 -11.417  -1.464
  276   1HB   ASP  35           HB2      ASP  35   1.996 -13.715  -1.912
  277   2HB   ASP  35           HB1      ASP  35   0.462 -14.407  -1.383
  278    H    ILE  36           HN       ILE  36  -1.020 -10.450  -0.765
  279    HA   ILE  36           HA       ILE  36  -2.928 -12.047   0.851
  280    HB   ILE  36           HB       ILE  36  -3.996  -9.952   1.377
  281   1HG1  ILE  36          HG12      ILE  36  -2.168  -8.703  -0.705
  282   2HG1  ILE  36          HG11      ILE  36  -3.896  -8.983  -0.920
  283   1HG2  ILE  36          HG23      ILE  36  -1.805 -10.473   2.486
  284   2HG2  ILE  36          HG22      ILE  36  -1.004  -9.468   1.277
  285   3HG2  ILE  36          HG21      ILE  36  -2.153  -8.746   2.403
  286   1HD1  ILE  36          HD13      ILE  36  -3.332  -7.579   1.570
  287   2HD1  ILE  36          HD12      ILE  36  -2.734  -6.698   0.164
  288   3HD1  ILE  36          HD11      ILE  36  -4.437  -7.147   0.264
  289    H    PHE  37           HN       PHE  37  -2.505 -12.485  -2.080
  290    HA   PHE  37           HA       PHE  37  -5.352 -12.110  -2.885
  291   1HB   PHE  37           HB2      PHE  37  -2.926 -11.617  -4.641
  292   2HB   PHE  37           HB1      PHE  37  -4.600 -11.606  -5.197
  293    HD1  PHE  37           HD2      PHE  37  -6.206  -9.903  -4.269
  294    HD2  PHE  37           HD1      PHE  37  -1.982  -9.746  -3.503
  295    HE1  PHE  37           HE2      PHE  37  -6.420  -7.531  -3.573
  296    HE2  PHE  37           HE1      PHE  37  -2.196  -7.376  -2.807
  297    HZ   PHE  37           HZ       PHE  37  -4.416  -6.269  -2.843
  298    H    ALA  38           HN       ALA  38  -3.831 -14.412  -1.809
  299    HA   ALA  38           HA       ALA  38  -3.389 -16.215  -4.068
  300   1HB   ALA  38           HB2      ALA  38  -2.203 -16.287  -1.780
  301   2HB   ALA  38           HB1      ALA  38  -3.683 -17.032  -1.176
  302   3HB   ALA  38           HB3      ALA  38  -2.750 -17.825  -2.447
  303    H    ALA  39           HN       ALA  39  -5.655 -16.298  -1.303
  304    HA   ALA  39           HA       ALA  39  -7.827 -17.122  -3.118
  305   1HB   ALA  39           HB3      ALA  39  -6.459 -19.191  -2.295
  306   2HB   ALA  39           HB2      ALA  39  -7.261 -18.896  -0.753
  307   3HB   ALA  39           HB1      ALA  39  -8.219 -19.243  -2.193
  308    H    SER  40           HN       SER  40  -8.650 -15.051  -2.323
  309    HA   SER  40           HA       SER  40  -9.476 -15.080   0.543
  310   1HB   SER  40           HB2      SER  40  -8.250 -13.081  -0.746
  311   2HB   SER  40           HB1      SER  40  -9.908 -12.691  -1.199
  312    HG   SER  40           HG       SER  40 -10.188 -11.982   0.750
  313    H    LYS  41           HN       LYS  41 -11.410 -16.171   0.643
  314    HA   LYS  41           HA       LYS  41 -13.602 -15.147  -1.108
  315   1HB   LYS  41           HB2      LYS  41 -12.851 -18.010  -0.506
  316   2HB   LYS  41           HB1      LYS  41 -14.487 -17.572  -0.997
  317   1HG   LYS  41           HG2      LYS  41 -13.203 -16.271  -2.920
  318   2HG   LYS  41           HG1      LYS  41 -11.941 -17.452  -2.568
  319   1HD   LYS  41           HD2      LYS  41 -13.730 -19.250  -2.779
  320   2HD   LYS  41           HD1      LYS  41 -14.791 -17.998  -3.426
  321   1HE   LYS  41           HE2      LYS  41 -12.052 -18.568  -4.577
  322   2HE   LYS  41           HE1      LYS  41 -13.515 -19.359  -5.163
  323   1HZ   LYS  41           HZ1      LYS  41 -14.307 -16.836  -5.188
  324   2HZ   LYS  41           HZ3      LYS  41 -12.650 -16.599  -5.460
  325   3HZ   LYS  41           HZ2      LYS  41 -13.551 -17.578  -6.517
  326    H    ASP  42           HN       ASP  42 -12.847 -14.494   1.673
  327    HA   ASP  42           HA       ASP  42 -15.471 -14.738   2.865
  328   1HB   ASP  42           HB2      ASP  42 -14.992 -16.202   4.694
  329   2HB   ASP  42           HB1      ASP  42 -14.421 -17.039   3.250
  330    H    THR  43           HN       THR  43 -13.565 -12.638   2.257
  331    HA   THR  43           HA       THR  43 -13.107 -11.625   5.034
  332    HB   THR  43           HB       THR  43 -11.362 -10.544   2.905
  333    HG1  THR  43           HG1      THR  43 -10.073 -12.632   3.563
  334   1HG2  THR  43          HG22      THR  43 -11.453 -10.460   5.639
  335   2HG2  THR  43          HG21      THR  43 -10.255 -11.727   5.369
  336   3HG2  THR  43          HG23      THR  43 -10.011 -10.122   4.681
  337    H    THR  44           HN       THR  44 -12.719  -9.077   4.804
  338    HA   THR  44           HA       THR  44 -14.896  -8.062   3.025
  339    HB   THR  44           HB       THR  44 -14.846  -6.146   4.850
  340    HG1  THR  44           HG1      THR  44 -13.349  -6.720   6.241
  341   1HG2  THR  44          HG23      THR  44 -16.197  -8.778   4.741
  342   2HG2  THR  44          HG22      THR  44 -16.309  -7.925   6.282
  343   3HG2  THR  44          HG21      THR  44 -16.889  -7.157   4.804
  344    H    GLU  45           HN       GLU  45 -14.545  -5.488   2.834
  345    HA   GLU  45           HA       GLU  45 -11.983  -5.213   1.459
  346   1HB   GLU  45           HB2      GLU  45 -12.776  -3.018   0.802
  347   2HB   GLU  45           HB1      GLU  45 -14.113  -4.155   0.633
  348   1HG   GLU  45           HG2      GLU  45 -14.820  -3.465   2.992
  349   2HG   GLU  45           HG1      GLU  45 -13.658  -2.144   2.849
  350    H    LYS  46           HN       LYS  46 -13.475  -3.881   4.405
  351    HA   LYS  46           HA       LYS  46 -11.310  -2.117   5.029
  352   1HB   LYS  46           HB2      LYS  46 -12.232  -2.237   7.365
  353   2HB   LYS  46           HB1      LYS  46 -13.429  -1.825   6.139
  354   1HG   LYS  46           HG2      LYS  46 -13.204  -4.709   6.491
  355   2HG   LYS  46           HG1      LYS  46 -13.615  -3.903   8.004
  356   1HD   LYS  46           HD2      LYS  46 -15.081  -2.899   5.647
  357   2HD   LYS  46           HD1      LYS  46 -15.438  -4.572   6.075
  358   1HE   LYS  46           HE2      LYS  46 -16.114  -3.969   8.282
  359   2HE   LYS  46           HE1      LYS  46 -15.432  -2.350   8.125
  360   1HZ   LYS  46           HZ1      LYS  46 -17.095  -2.263   6.117
  361   2HZ   LYS  46           HZ3      LYS  46 -17.914  -3.440   7.021
  362   3HZ   LYS  46           HZ2      LYS  46 -17.608  -1.913   7.699
  363    H    GLU  47           HN       GLU  47 -11.742  -5.565   5.468
  364    HA   GLU  47           HA       GLU  47  -9.544  -5.810   7.379
  365   1HB   GLU  47           HB2      GLU  47 -11.532  -7.572   6.149
  366   2HB   GLU  47           HB1      GLU  47  -9.940  -8.322   6.263
  367   1HG   GLU  47           HG2      GLU  47  -9.853  -8.057   8.612
  368   2HG   GLU  47           HG1      GLU  47 -11.151  -6.865   8.611
  369    H    THR  48           HN       THR  48  -9.977  -6.886   3.973
  370    HA   THR  48           HA       THR  48  -7.285  -7.641   3.532
  371    HB   THR  48           HB       THR  48  -9.091  -6.333   1.478
  372    HG1  THR  48           HG1      THR  48  -9.173  -8.792   2.760
  373   1HG2  THR  48          HG21      THR  48  -6.484  -7.551   1.404
  374   2HG2  THR  48          HG23      THR  48  -7.614  -8.522   0.461
  375   3HG2  THR  48          HG22      THR  48  -7.395  -6.813   0.087
  376    H    PHE  49           HN       PHE  49  -8.711  -4.470   3.763
  377    HA   PHE  49           HA       PHE  49  -6.596  -3.031   2.411
  378   1HB   PHE  49           HB2      PHE  49  -8.882  -2.309   4.223
  379   2HB   PHE  49           HB1      PHE  49  -7.632  -1.112   3.893
  380    HD1  PHE  49           HD1      PHE  49  -8.794  -3.740   1.513
  381    HD2  PHE  49           HD2      PHE  49  -8.896   0.425   2.566
  382    HE1  PHE  49           HE1      PHE  49  -9.920  -3.230  -0.627
  383    HE2  PHE  49           HE2      PHE  49 -10.021   0.933   0.414
  384    HZ   PHE  49           HZ       PHE  49 -10.542  -0.900  -1.172
  385    H    CYS  50           HN       CYS  50  -7.451  -3.268   5.894
  386    HA   CYS  50           HA       CYS  50  -5.090  -2.066   6.887
  387   1HB   CYS  50           HB2      CYS  50  -5.816  -2.746   8.963
  388   2HB   CYS  50           HB1      CYS  50  -7.306  -3.032   8.066
  389    NH1  ARG  51           NH2      ARG  51  -6.507 -10.798   8.244
  390    NH2  ARG  51           NH1      ARG  51  -5.412 -12.682   7.651
  391    H    ARG  51           HN       ARG  51  -5.596  -5.255   5.541
  392    HA   ARG  51           HA       ARG  51  -3.278  -6.534   6.658
  393   1HB   ARG  51           HB2      ARG  51  -5.377  -7.301   4.993
  394   2HB   ARG  51           HB1      ARG  51  -3.960  -7.400   3.949
  395   1HG   ARG  51           HG2      ARG  51  -3.571  -9.411   4.909
  396   2HG   ARG  51           HG1      ARG  51  -3.069  -8.503   6.336
  397   1HD   ARG  51           HD2      ARG  51  -5.136  -8.779   7.400
  398   2HD   ARG  51           HD1      ARG  51  -5.983  -9.093   5.886
  399    HE   ARG  51           HE       ARG  51  -4.210 -11.209   6.102
  400   1HH1  ARG  51          HH21      ARG  51  -6.667  -9.817   8.153
  401   2HH1  ARG  51          HH22      ARG  51  -7.041 -11.329   8.902
  402   1HH2  ARG  51          HH11      ARG  51  -4.724 -13.150   7.097
  403   2HH2  ARG  51          HH12      ARG  51  -5.955 -13.196   8.314
  404    H    ALA  52           HN       ALA  52  -3.819  -5.085   3.421
  405    HA   ALA  52           HA       ALA  52  -1.058  -5.206   2.658
  406   1HB   ALA  52           HB3      ALA  52  -3.278  -3.363   1.725
  407   2HB   ALA  52           HB2      ALA  52  -1.702  -3.498   0.948
  408   3HB   ALA  52           HB1      ALA  52  -2.791  -4.884   0.977
  409    H    ALA  53           HN       ALA  53  -2.747  -3.125   4.847
  410    HA   ALA  53           HA       ALA  53  -0.928  -0.866   4.601
  411   1HB   ALA  53           HB1      ALA  53  -3.315  -1.553   6.139
  412   2HB   ALA  53           HB3      ALA  53  -2.102  -0.743   7.131
  413   3HB   ALA  53           HB2      ALA  53  -2.709   0.036   5.668
  414    H    THR  54           HN       THR  54  -1.138  -3.799   6.532
  415    HA   THR  54           HA       THR  54   0.949  -3.039   8.404
  416    HB   THR  54           HB       THR  54  -0.646  -5.464   7.800
  417    HG1  THR  54           HG1      THR  54  -0.639  -3.796   9.632
  418   1HG2  THR  54          HG22      THR  54   2.184  -5.591   8.851
  419   2HG2  THR  54          HG21      THR  54   0.994  -6.851   9.178
  420   3HG2  THR  54          HG23      THR  54   1.481  -6.507   7.519
  421    H    VAL  55           HN       VAL  55   0.818  -5.012   5.437
  422    HA   VAL  55           HA       VAL  55   3.581  -5.741   5.388
  423    HB   VAL  55           HB       VAL  55   1.751  -5.202   3.020
  424   1HG1  VAL  55          HG13      VAL  55   4.208  -5.448   2.547
  425   2HG1  VAL  55          HG12      VAL  55   4.146  -7.044   3.292
  426   3HG1  VAL  55          HG11      VAL  55   3.223  -6.720   1.824
  427   1HG2  VAL  55          HG23      VAL  55   1.400  -7.046   5.096
  428   2HG2  VAL  55          HG22      VAL  55   0.643  -7.111   3.504
  429   3HG2  VAL  55          HG21      VAL  55   2.147  -7.983   3.803
  430    H    LEU  56           HN       LEU  56   1.817  -2.912   4.220
  431    HA   LEU  56           HA       LEU  56   4.027  -1.623   2.921
  432   1HB   LEU  56           HB2      LEU  56   1.287  -1.004   3.570
  433   2HB   LEU  56           HB1      LEU  56   2.312   0.356   4.028
  434    HG   LEU  56           HG       LEU  56   3.403   0.045   1.694
  435   1HD1  LEU  56          HD13      LEU  56   0.781  -1.442   1.344
  436   2HD1  LEU  56          HD12      LEU  56   1.822  -0.916   0.021
  437   3HD1  LEU  56          HD11      LEU  56   2.400  -2.123   1.170
  438   1HD2  LEU  56          HD23      LEU  56   1.424   1.683   2.638
  439   2HD2  LEU  56          HD22      LEU  56   2.119   1.808   1.021
  440   3HD2  LEU  56          HD21      LEU  56   0.611   0.928   1.267
  441    NH1  ARG  57           NH2      ARG  57   2.586  -2.107  13.244
  442    NH2  ARG  57           NH1      ARG  57   4.069  -0.583  14.006
  443    H    ARG  57           HN       ARG  57   2.902  -1.786   6.249
  444    HA   ARG  57           HA       ARG  57   4.444   0.335   7.341
  445   1HB   ARG  57           HB2      ARG  57   3.274  -0.373   9.132
  446   2HB   ARG  57           HB1      ARG  57   2.885  -1.890   8.327
  447   1HG   ARG  57           HG2      ARG  57   5.009  -2.864   9.057
  448   2HG   ARG  57           HG1      ARG  57   5.486  -1.329   9.789
  449   1HD   ARG  57           HD2      ARG  57   2.852  -2.259  10.682
  450   2HD   ARG  57           HD1      ARG  57   4.155  -3.377  11.088
  451    HE   ARG  57           HE       ARG  57   5.152  -0.903  11.829
  452   1HH1  ARG  57          HH21      ARG  57   2.260  -2.727  12.533
  453   2HH1  ARG  57          HH22      ARG  57   2.084  -2.034  14.106
  454   1HH2  ARG  57          HH11      ARG  57   4.892  -0.029  13.876
  455   2HH2  ARG  57          HH12      ARG  57   3.557  -0.523  14.863
  456    H    GLN  58           HN       GLN  58   5.254  -3.092   6.767
  457    HA   GLN  58           HA       GLN  58   7.881  -2.965   7.908
  458   1HB   GLN  58           HB2      GLN  58   6.732  -5.100   7.362
  459   2HB   GLN  58           HB1      GLN  58   6.886  -4.727   5.645
  460   1HG   GLN  58           HG2      GLN  58   9.100  -5.259   5.596
  461   2HG   GLN  58           HG1      GLN  58   9.403  -4.545   7.180
  462   1HE2  GLN  58          HE22      GLN  58   8.586  -7.576   8.960
  463   2HE2  GLN  58          HE21      GLN  58   8.523  -5.885   9.100
  464    H    PHE  59           HN       PHE  59   6.592  -2.161   4.735
  465    HA   PHE  59           HA       PHE  59   9.039  -1.901   3.304
  466   1HB   PHE  59           HB2      PHE  59   6.467  -1.644   2.607
  467   2HB   PHE  59           HB1      PHE  59   6.844   0.061   2.819
  468    HD1  PHE  59           HD2      PHE  59   9.745   0.049   1.954
  469    HD2  PHE  59           HD1      PHE  59   6.267  -1.820   0.260
  470    HE1  PHE  59           HE2      PHE  59  10.816   0.081  -0.276
  471    HE2  PHE  59           HE1      PHE  59   7.342  -1.784  -1.973
  472    HZ   PHE  59           HZ       PHE  59   9.615  -0.833  -2.243
  473    OH   TYR  60           OH       TYR  60   5.770   4.230  10.624
  474    H    TYR  60           HN       TYR  60   7.124   0.734   4.812
  475    HA   TYR  60           HA       TYR  60   9.418   2.537   4.653
  476   1HB   TYR  60           HB2      TYR  60   7.864   4.167   4.857
  477   2HB   TYR  60           HB1      TYR  60   6.669   2.880   4.705
  478    HD1  TYR  60           HD2      TYR  60   6.001   1.629   6.888
  479    HD2  TYR  60           HD1      TYR  60   7.973   5.444   6.821
  480    HE1  TYR  60           HE2      TYR  60   5.250   2.056   9.213
  481    HE2  TYR  60           HE1      TYR  60   7.223   5.873   9.146
  482    HH   TYR  60           HH       TYR  60   5.475   3.397  10.998
  483    H    SER  61           HN       SER  61   8.760   0.097   6.793
  484    HA   SER  61           HA       SER  61   9.571   1.619   9.192
  485   1HB   SER  61           HB2      SER  61   7.859  -0.084   9.515
  486   2HB   SER  61           HB1      SER  61   8.896  -1.309   8.789
  487    HG   SER  61           HG       SER  61   8.974  -1.334  11.083
  488    H    HIS  62           HN       HIS  62  10.691  -1.410   7.663
  489    HA   HIS  62           HA       HIS  62  13.405  -0.890   8.722
  490   1HB   HIS  62           HB2      HIS  62  12.088  -3.270   7.414
  491   2HB   HIS  62           HB1      HIS  62  13.829  -3.206   7.693
  492    HD1  HIS  62           HD1      HIS  62  11.826  -5.174   9.200
  493    HD2  HIS  62           HD2      HIS  62  13.328  -1.598  10.729
  494    HE1  HIS  62           HE1      HIS  62  11.681  -5.357  11.722
  495    H    HIS  63           HN       HIS  63  11.791  -1.336   5.574
  496    HA   HIS  63           HA       HIS  63  14.331  -0.794   4.170
  497   1HB   HIS  63           HB2      HIS  63  11.643  -1.090   2.847
  498   2HB   HIS  63           HB1      HIS  63  13.238  -1.495   2.211
  499    HD1  HIS  63           HD1      HIS  63  14.177  -3.025   4.853
  500    HD2  HIS  63           HD2      HIS  63  10.657  -3.746   2.738
  501    HE1  HIS  63           HE1      HIS  63  13.474  -5.392   5.417
  502    H    GLU  64           HN       GLU  64  13.075   1.394   5.768
  503    HA   GLU  64           HA       GLU  64  12.109   3.246   3.677
  504   1HB   GLU  64           HB2      GLU  64  11.044   4.257   5.382
  505   2HB   GLU  64           HB1      GLU  64  11.634   2.966   6.427
  506   1HG   GLU  64           HG2      GLU  64  13.724   4.279   6.813
  507   2HG   GLU  64           HG1      GLU  64  13.031   5.596   5.862
  508    H    LYS  65           HN       LYS  65  14.935   2.671   5.698
  509    HA   LYS  65           HA       LYS  65  16.371   4.759   4.117
  510   1HB   LYS  65           HB2      LYS  65  16.284   4.340   7.089
  511   2HB   LYS  65           HB1      LYS  65  17.758   4.967   6.351
  512   1HG   LYS  65           HG2      LYS  65  15.820   6.481   5.120
  513   2HG   LYS  65           HG1      LYS  65  15.152   6.280   6.740
  514   1HD   LYS  65           HD2      LYS  65  16.844   7.470   7.739
  515   2HD   LYS  65           HD1      LYS  65  18.049   6.943   6.562
  516   1HE   LYS  65           HE2      LYS  65  16.797   8.402   4.861
  517   2HE   LYS  65           HE1      LYS  65  15.958   9.102   6.245
  518   1HZ   LYS  65           HZ3      LYS  65  18.214   9.543   7.200
  519   2HZ   LYS  65           HZ2      LYS  65  18.869   9.120   5.690
  520   3HZ   LYS  65           HZ1      LYS  65  17.826  10.455   5.823
  521    H    ASP  66           HN       ASP  66  16.224   1.889   3.670
  522    HA   ASP  66           HA       ASP  66  18.802   0.836   4.646
  523   1HB   ASP  66           HB2      ASP  66  16.355  -0.272   3.471
  524   2HB   ASP  66           HB1      ASP  66  17.823  -0.977   2.792
  525    H    THR  67           HN       THR  67  20.526   0.254   3.218
  526    HA   THR  67           HA       THR  67  20.904   2.091   1.013
  527    HB   THR  67           HB       THR  67  22.708   1.100   2.545
  528    HG1  THR  67           HG1      THR  67  24.194   1.114   0.819
  529   1HG2  THR  67          HG21      THR  67  21.711  -1.287   1.836
  530   2HG2  THR  67          HG23      THR  67  22.941  -1.126   0.583
  531   3HG2  THR  67          HG22      THR  67  23.404  -1.073   2.283
  532    NH1  ARG  68           NH2      ARG  68  20.932  -5.904   2.386
  533    NH2  ARG  68           NH1      ARG  68  19.184  -5.581   3.781
  534    H    ARG  68           HN       ARG  68  19.380  -0.978   1.222
  535    HA   ARG  68           HA       ARG  68  20.039  -2.183  -1.236
  536   1HB   ARG  68           HB2      ARG  68  18.084  -2.542   0.780
  537   2HB   ARG  68           HB1      ARG  68  17.210  -2.439  -0.748
  538   1HG   ARG  68           HG2      ARG  68  17.753  -4.729  -0.573
  539   2HG   ARG  68           HG1      ARG  68  18.995  -4.086  -1.647
  540   1HD   ARG  68           HD2      ARG  68  20.123  -5.448  -0.020
  541   2HD   ARG  68           HD1      ARG  68  20.457  -3.768   0.401
  542    HE   ARG  68           HE       ARG  68  18.197  -4.385   1.879
  543   1HH1  ARG  68          HH21      ARG  68  21.374  -5.784   1.499
  544   2HH1  ARG  68          HH22      ARG  68  21.403  -6.408   3.110
  545   1HH2  ARG  68          HH11      ARG  68  18.275  -5.208   3.963
  546   2HH2  ARG  68          HH12      ARG  68  19.671  -6.084   4.494
  547    H    CYS  69           HN       CYS  69  17.353   0.116  -0.599
  548    HA   CYS  69           HA       CYS  69  16.836   0.365  -3.472
  549   1HB   CYS  69           HB2      CYS  69  15.180   0.593  -1.407
  550   2HB   CYS  69           HB1      CYS  69  15.688   2.280  -1.481
  551    H    LEU  70           HN       LEU  70  18.687   2.101  -1.059
  552    HA   LEU  70           HA       LEU  70  18.847   4.629  -2.372
  553   1HB   LEU  70           HB2      LEU  70  20.860   3.206  -0.609
  554   2HB   LEU  70           HB1      LEU  70  20.996   4.892  -1.106
  555    HG   LEU  70           HG       LEU  70  18.549   3.805   0.303
  556   1HD1  LEU  70          HD11      LEU  70  21.204   4.567   1.360
  557   2HD1  LEU  70          HD13      LEU  70  19.836   5.337   2.163
  558   3HD1  LEU  70          HD12      LEU  70  19.942   3.578   2.094
  559   1HD2  LEU  70          HD23      LEU  70  19.664   6.571  -0.253
  560   2HD2  LEU  70          HD22      LEU  70  18.160   5.882  -0.867
  561   3HD2  LEU  70          HD21      LEU  70  18.318   6.269   0.846
  562    H    GLY  71           HN       GLY  71  21.603   2.359  -2.246
  563   1HA   GLY  71           HA2      GLY  71  22.461   1.408  -4.404
  564   2HA   GLY  71           HA1      GLY  71  22.052   2.955  -5.144
  565    H    ALA  72           HN       ALA  72  23.662   4.457  -5.248
  566    HA   ALA  72           HA       ALA  72  25.731   4.601  -3.178
  567   1HB   ALA  72           HB2      ALA  72  26.320   3.592  -5.963
  568   2HB   ALA  72           HB1      ALA  72  27.560   4.371  -4.980
  569   3HB   ALA  72           HB3      ALA  72  26.798   2.882  -4.421
  570    H    THR  73           HN       THR  73  23.994   6.570  -3.707
  571    HA   THR  73           HA       THR  73  25.685   8.733  -4.609
  572    HB   THR  73           HB       THR  73  25.130   7.964  -6.830
  573    HG1  THR  73           HG1      THR  73  24.930  10.053  -7.044
  574   1HG2  THR  73          HG23      THR  73  22.397   7.688  -5.628
  575   2HG2  THR  73          HG22      THR  73  22.547   7.982  -7.361
  576   3HG2  THR  73          HG21      THR  73  23.291   6.553  -6.640
  577    H    ALA  74           HN       ALA  74  24.352  10.841  -4.635
  578    HA   ALA  74           HA       ALA  74  22.530  10.757  -2.323
  579   1HB   ALA  74           HB1      ALA  74  24.031  12.859  -3.808
  580   2HB   ALA  74           HB3      ALA  74  22.547  13.357  -2.996
  581   3HB   ALA  74           HB2      ALA  74  23.855  12.620  -2.070
  582    H    GLN  75           HN       GLN  75  22.337  11.101  -5.798
  583    HA   GLN  75           HA       GLN  75  19.800  12.384  -5.991
  584   1HB   GLN  75           HB2      GLN  75  21.660  11.256  -7.769
  585   2HB   GLN  75           HB1      GLN  75  20.166  10.359  -8.037
  586   1HG   GLN  75           HG2      GLN  75  18.933  12.373  -8.473
  587   2HG   GLN  75           HG1      GLN  75  20.272  13.381  -7.926
  588   1HE2  GLN  75          HE22      GLN  75  22.116  13.049 -10.968
  589   2HE2  GLN  75          HE21      GLN  75  22.233  13.445  -9.322
  590    H    GLN  76           HN       GLN  76  20.631   8.910  -5.811
  591    HA   GLN  76           HA       GLN  76  17.953   7.948  -6.004
  592   1HB   GLN  76           HB2      GLN  76  20.553   6.850  -5.470
  593   2HB   GLN  76           HB1      GLN  76  19.421   6.231  -4.268
  594   1HG   GLN  76           HG2      GLN  76  18.631   4.792  -5.807
  595   2HG   GLN  76           HG1      GLN  76  18.066   6.161  -6.763
  596   1HE2  GLN  76          HE22      GLN  76  21.317   6.214  -8.587
  597   2HE2  GLN  76          HE21      GLN  76  20.448   7.320  -7.636
  598    H    PHE  77           HN       PHE  77  19.801   9.218  -3.296
  599    HA   PHE  77           HA       PHE  77  17.891   8.355  -1.278
  600   1HB   PHE  77           HB2      PHE  77  19.995   8.761  -0.354
  601   2HB   PHE  77           HB1      PHE  77  20.257  10.205  -1.332
  602    HD1  PHE  77           HD1      PHE  77  18.311   8.827   1.523
  603    HD2  PHE  77           HD2      PHE  77  19.572  12.361  -0.569
  604    HE1  PHE  77           HE1      PHE  77  17.435  10.233   3.370
  605    HE2  PHE  77           HE2      PHE  77  18.695  13.766   1.277
  606    HZ   PHE  77           HZ       PHE  77  17.627  12.702   3.247
  607    H    HIS  78           HN       HIS  78  18.197  11.111  -3.412
  608    HA   HIS  78           HA       HIS  78  16.442  12.871  -1.942
  609   1HB   HIS  78           HB2      HIS  78  18.072  13.585  -3.736
  610   2HB   HIS  78           HB1      HIS  78  16.983  12.865  -4.923
  611    HD1  HIS  78           HD1      HIS  78  15.821  14.788  -6.014
  612    HD2  HIS  78           HD2      HIS  78  16.004  15.247  -1.875
  613    HE1  HIS  78           HE1      HIS  78  14.492  16.873  -5.464
  614    NH1  ARG  79           NH2      ARG  79  11.317  13.134  -7.609
  615    NH2  ARG  79           NH1      ARG  79  10.366  11.411  -8.718
  616    H    ARG  79           HN       ARG  79  15.962  10.511  -4.546
  617    HA   ARG  79           HA       ARG  79  13.095  11.108  -4.717
  618   1HB   ARG  79           HB2      ARG  79  14.606   8.756  -5.888
  619   2HB   ARG  79           HB1      ARG  79  13.025   9.358  -6.386
  620   1HG   ARG  79           HG2      ARG  79  15.556  11.017  -6.504
  621   2HG   ARG  79           HG1      ARG  79  14.927  10.097  -7.872
  622   1HD   ARG  79           HD2      ARG  79  13.396  12.242  -6.372
  623   2HD   ARG  79           HD1      ARG  79  14.186  12.468  -7.932
  624    HE   ARG  79           HE       ARG  79  12.521  10.297  -8.349
  625   1HH1  ARG  79          HH21      ARG  79  12.092  13.543  -7.131
  626   2HH1  ARG  79          HH22      ARG  79  10.471  13.655  -7.716
  627   1HH2  ARG  79          HH11      ARG  79  10.416  10.486  -9.096
  628   2HH2  ARG  79          HH12      ARG  79   9.528  11.947  -8.816
  629    H    HIS  80           HN       HIS  80  15.144   8.902  -2.946
  630    HA   HIS  80           HA       HIS  80  13.074   6.970  -2.341
  631   1HB   HIS  80           HB2      HIS  80  15.520   6.479  -2.193
  632   2HB   HIS  80           HB1      HIS  80  15.622   7.568  -0.809
  633    HD1  HIS  80           HD1      HIS  80  12.597   5.402  -1.217
  634    HD2  HIS  80           HD2      HIS  80  16.154   5.373   0.957
  635    HE1  HIS  80           HE1      HIS  80  12.345   3.601   0.545
  636    H    LYS  81           HN       LYS  81  14.347   9.851  -0.696
  637    HA   LYS  81           HA       LYS  81  12.967   9.557   1.760
  638   1HB   LYS  81           HB2      LYS  81  14.700  11.374   0.892
  639   2HB   LYS  81           HB1      LYS  81  13.225  12.276   0.539
  640   1HG   LYS  81           HG2      LYS  81  12.917  11.126   3.127
  641   2HG   LYS  81           HG1      LYS  81  14.506  11.891   3.075
  642   1HD   LYS  81           HD2      LYS  81  13.593  14.006   2.502
  643   2HD   LYS  81           HD1      LYS  81  12.033  13.305   2.073
  644   1HE   LYS  81           HE2      LYS  81  11.732  12.628   4.463
  645   2HE   LYS  81           HE1      LYS  81  13.230  13.475   4.854
  646   1HZ   LYS  81           HZ2      LYS  81  11.847  15.317   3.443
  647   2HZ   LYS  81           HZ1      LYS  81  10.612  14.536   4.309
  648   3HZ   LYS  81           HZ3      LYS  81  11.914  15.236   5.139
  649    H    GLN  82           HN       GLN  82  11.884  10.936  -1.324
  650    HA   GLN  82           HA       GLN  82   9.369  11.916  -0.369
  651   1HB   GLN  82           HB2      GLN  82  10.092  10.915  -3.141
  652   2HB   GLN  82           HB1      GLN  82   8.699  11.920  -2.740
  653   1HG   GLN  82           HG2      GLN  82  11.545  12.748  -2.129
  654   2HG   GLN  82           HG1      GLN  82  10.728  13.174  -3.633
  655   1HE2  GLN  82          HE22      GLN  82   8.641  15.622  -2.123
  656   2HE2  GLN  82          HE21      GLN  82   8.930  14.697  -3.516
  657    H    LEU  83           HN       LEU  83  10.441   8.732  -1.425
  658    HA   LEU  83           HA       LEU  83   7.816   7.563  -1.648
  659   1HB   LEU  83           HB2      LEU  83   9.863   6.539  -2.624
  660   2HB   LEU  83           HB1      LEU  83  10.460   6.221  -0.996
  661    HG   LEU  83           HG       LEU  83   8.028   5.079  -0.782
  662   1HD1  LEU  83          HD11      LEU  83   7.897   5.764  -3.377
  663   2HD1  LEU  83          HD13      LEU  83   8.712   4.210  -3.547
  664   3HD1  LEU  83          HD12      LEU  83   7.141   4.299  -2.752
  665   1HD2  LEU  83          HD22      LEU  83  10.667   4.034  -1.769
  666   2HD2  LEU  83          HD21      LEU  83   9.872   3.760  -0.219
  667   3HD2  LEU  83          HD23      LEU  83   9.287   2.941  -1.668
  668    H    ILE  84           HN       ILE  84  10.077   8.017   1.028
  669    HA   ILE  84           HA       ILE  84   8.761   6.304   2.904
  670    HB   ILE  84           HB       ILE  84  10.239   8.854   3.590
  671   1HG1  ILE  84          HG12      ILE  84  11.749   7.794   2.122
  672   2HG1  ILE  84          HG11      ILE  84  12.225   7.170   3.701
  673   1HG2  ILE  84          HG22      ILE  84   8.993   7.404   5.333
  674   2HG2  ILE  84          HG21      ILE  84  10.250   6.204   5.037
  675   3HG2  ILE  84          HG23      ILE  84  10.681   7.797   5.662
  676   1HD1  ILE  84          HD11      ILE  84  10.457   5.287   3.152
  677   2HD1  ILE  84          HD13      ILE  84  10.752   5.786   1.486
  678   3HD1  ILE  84          HD12      ILE  84  12.084   5.196   2.479
  679    NH1  ARG  85           NH2      ARG  85   5.434  16.442   1.638
  680    NH2  ARG  85           NH1      ARG  85   3.194  16.290   1.382
  681    H    ARG  85           HN       ARG  85   8.245   9.704   2.033
  682    HA   ARG  85           HA       ARG  85   6.285  10.144   4.134
  683   1HB   ARG  85           HB2      ARG  85   6.821  12.251   3.547
  684   2HB   ARG  85           HB1      ARG  85   7.576  11.699   2.053
  685   1HG   ARG  85           HG2      ARG  85   5.412  11.670   0.922
  686   2HG   ARG  85           HG1      ARG  85   4.590  12.096   2.425
  687   1HD   ARG  85           HD2      ARG  85   6.309  14.127   2.373
  688   2HD   ARG  85           HD1      ARG  85   6.286  13.794   0.642
  689    HE   ARG  85           HE       ARG  85   3.606  13.872   1.339
  690   1HH1  ARG  85          HH21      ARG  85   6.333  16.017   1.723
  691   2HH1  ARG  85          HH22      ARG  85   5.352  17.438   1.666
  692   1HH2  ARG  85          HH11      ARG  85   2.367  15.739   1.268
  693   2HH2  ARG  85          HH12      ARG  85   3.130  17.287   1.411
  694    H    PHE  86           HN       PHE  86   6.171   9.109   0.768
  695    HA   PHE  86           HA       PHE  86   3.355   9.429   0.382
  696   1HB   PHE  86           HB2      PHE  86   5.581   8.166  -1.007
  697   2HB   PHE  86           HB1      PHE  86   4.118   7.186  -1.116
  698    HD1  PHE  86           HD2      PHE  86   1.931   9.009  -1.220
  699    HD2  PHE  86           HD1      PHE  86   5.841   9.451  -2.938
  700    HE1  PHE  86           HE2      PHE  86   1.008  10.568  -2.913
  701    HE2  PHE  86           HE1      PHE  86   4.919  11.011  -4.632
  702    HZ   PHE  86           HZ       PHE  86   2.503  11.571  -4.620
  703    H    LEU  87           HN       LEU  87   5.285   6.722   1.640
  704    HA   LEU  87           HA       LEU  87   3.021   4.949   1.945
  705   1HB   LEU  87           HB2      LEU  87   5.589   4.419   1.911
  706   2HB   LEU  87           HB1      LEU  87   5.496   4.757   3.639
  707    HG   LEU  87           HG       LEU  87   3.417   2.957   2.486
  708   1HD1  LEU  87          HD11      LEU  87   6.337   2.263   2.822
  709   2HD1  LEU  87          HD13      LEU  87   5.074   1.037   2.925
  710   3HD1  LEU  87          HD12      LEU  87   5.294   1.954   1.435
  711   1HD2  LEU  87          HD21      LEU  87   4.684   3.592   5.069
  712   2HD2  LEU  87          HD23      LEU  87   3.067   2.976   4.734
  713   3HD2  LEU  87          HD22      LEU  87   4.435   1.866   4.803
  714    H    LYS  88           HN       LYS  88   4.685   7.226   4.105
  715    HA   LYS  88           HA       LYS  88   3.432   6.548   6.533
  716   1HB   LYS  88           HB2      LYS  88   4.743   8.940   5.415
  717   2HB   LYS  88           HB1      LYS  88   3.570   9.286   6.687
  718   1HG   LYS  88           HG2      LYS  88   4.819   7.199   7.833
  719   2HG   LYS  88           HG1      LYS  88   6.146   7.800   6.838
  720   1HD   LYS  88           HD2      LYS  88   4.699   9.946   8.208
  721   2HD   LYS  88           HD1      LYS  88   5.427   8.791   9.326
  722   1HE   LYS  88           HE2      LYS  88   7.594   9.039   8.131
  723   2HE   LYS  88           HE1      LYS  88   6.856  10.253   7.086
  724   1HZ   LYS  88           HZ1      LYS  88   6.661  10.586   9.992
  725   2HZ   LYS  88           HZ3      LYS  88   8.134  10.946   9.234
  726   3HZ   LYS  88           HZ2      LYS  88   6.720  11.765   8.770
  727    NH1  ARG  89           NH2      ARG  89   0.754  12.803   1.084
  728    NH2  ARG  89           NH1      ARG  89  -0.906  11.928  -0.170
  729    H    ARG  89           HN       ARG  89   2.258   8.683   3.930
  730    HA   ARG  89           HA       ARG  89  -0.154   9.446   5.304
  731   1HB   ARG  89           HB2      ARG  89   0.743   9.505   2.432
  732   2HB   ARG  89           HB1      ARG  89  -0.922   9.906   2.853
  733   1HG   ARG  89           HG2      ARG  89   0.830  11.257   4.675
  734   2HG   ARG  89           HG1      ARG  89   1.369  11.581   3.029
  735   1HD   ARG  89           HD2      ARG  89  -1.414  12.000   4.141
  736   2HD   ARG  89           HD1      ARG  89  -0.287  13.259   3.647
  737    HE   ARG  89           HE       ARG  89  -2.114  11.815   1.952
  738   1HH1  ARG  89          HH21      ARG  89   1.103  13.126   1.961
  739   2HH1  ARG  89          HH22      ARG  89   1.315  12.898   0.262
  740   1HH2  ARG  89          HH11      ARG  89  -1.834  11.565  -0.251
  741   2HH2  ARG  89          HH12      ARG  89  -0.339  12.038  -0.987
  742    H    LEU  90           HN       LEU  90   0.537   6.927   2.879
  743    HA   LEU  90           HA       LEU  90  -2.186   5.954   2.826
  744   1HB   LEU  90           HB2      LEU  90  -0.034   5.585   1.219
  745   2HB   LEU  90           HB1      LEU  90  -0.011   4.072   2.126
  746    HG   LEU  90           HG       LEU  90  -2.515   3.903   1.611
  747   1HD1  LEU  90          HD13      LEU  90  -1.721   6.327   0.078
  748   2HD1  LEU  90          HD12      LEU  90  -2.796   5.194  -0.742
  749   3HD1  LEU  90          HD11      LEU  90  -3.276   5.911   0.797
  750   1HD2  LEU  90          HD21      LEU  90  -0.452   3.790  -0.611
  751   2HD2  LEU  90          HD23      LEU  90  -0.902   2.480   0.479
  752   3HD2  LEU  90          HD22      LEU  90  -2.057   3.069  -0.715
  753    H    ASP  91           HN       ASP  91   0.191   5.668   5.234
  754    HA   ASP  91           HA       ASP  91  -0.388   2.945   6.048
  755   1HB   ASP  91           HB2      ASP  91   1.698   4.285   6.647
  756   2HB   ASP  91           HB1      ASP  91   0.692   5.161   7.803
  757    NH1  ARG  92           NH2      ARG  92  -2.919   5.975  14.030
  758    NH2  ARG  92           NH1      ARG  92  -0.700   6.015  14.456
  759    H    ARG  92           HN       ARG  92  -1.526   6.159   7.076
  760    HA   ARG  92           HA       ARG  92  -3.409   4.913   8.977
  761   1HB   ARG  92           HB2      ARG  92  -2.841   7.806   8.275
  762   2HB   ARG  92           HB1      ARG  92  -4.000   7.289   9.501
  763   1HG   ARG  92           HG2      ARG  92  -1.201   6.225   9.620
  764   2HG   ARG  92           HG1      ARG  92  -1.515   7.866  10.187
  765   1HD   ARG  92           HD2      ARG  92  -3.291   6.992  11.682
  766   2HD   ARG  92           HD1      ARG  92  -2.919   5.354  11.144
  767    HE   ARG  92           HE       ARG  92  -0.484   6.334  12.035
  768   1HH1  ARG  92          HH21      ARG  92  -3.686   6.023  13.392
  769   2HH1  ARG  92          HH22      ARG  92  -3.094   5.844  15.005
  770   1HH2  ARG  92          HH11      ARG  92   0.245   6.094  14.138
  771   2HH2  ARG  92          HH12      ARG  92  -0.892   5.884  15.428
  772    H    ASN  93           HN       ASN  93  -3.440   6.314   5.766
  773    HA   ASN  93           HA       ASN  93  -6.342   6.706   5.748
  774   1HB   ASN  93           HB2      ASN  93  -4.080   7.205   3.929
  775   2HB   ASN  93           HB1      ASN  93  -5.581   6.760   3.118
  776   1HD2  ASN  93          HD22      ASN  93  -6.083  10.325   3.417
  777   2HD2  ASN  93          HD21      ASN  93  -5.404   9.155   2.391
  778    H    LEU  94           HN       LEU  94  -4.096   4.250   4.480
  779    HA   LEU  94           HA       LEU  94  -6.037   2.833   2.933
  780   1HB   LEU  94           HB2      LEU  94  -3.441   2.584   3.017
  781   2HB   LEU  94           HB1      LEU  94  -3.760   1.434   4.315
  782    HG   LEU  94           HG       LEU  94  -5.515   0.456   2.600
  783   1HD1  LEU  94          HD12      LEU  94  -5.173   2.274   0.946
  784   2HD1  LEU  94          HD11      LEU  94  -3.483   1.796   0.788
  785   3HD1  LEU  94          HD13      LEU  94  -4.761   0.696   0.273
  786   1HD2  LEU  94          HD22      LEU  94  -3.368  -0.589   3.519
  787   2HD2  LEU  94          HD21      LEU  94  -3.876  -1.157   1.929
  788   3HD2  LEU  94          HD23      LEU  94  -2.566   0.015   2.069
  789    CH2  TRP  95           CH2      TRP  95  -4.611   0.225  13.291
  790    H    TRP  95           HN       TRP  95  -4.813   2.065   6.220
  791    HA   TRP  95           HA       TRP  95  -7.055   0.181   6.565
  792   1HB   TRP  95           HB2      TRP  95  -5.810  -0.775   8.228
  793   2HB   TRP  95           HB1      TRP  95  -4.513  -0.008   7.322
  794    HD1  TRP  95           HD1      TRP  95  -4.632   2.896   8.257
  795    HE1  TRP  95           HE1      TRP  95  -4.132   3.558  10.706
  796    HE3  TRP  95           HE3      TRP  95  -5.453  -1.574  10.528
  797    HZ2  TRP  95           HZ2      TRP  95  -4.091   2.306  13.304
  798    HZ3  TRP  95           HZ3      TRP  95  -5.166  -1.819  12.960
  799    HH2  TRP  95           HH2      TRP  95  -4.489   0.107  14.358
  800    H    GLY  96           HN       GLY  96  -6.350   3.439   7.359
  801   1HA   GLY  96           HA2      GLY  96  -7.663   3.850   9.798
  802   2HA   GLY  96           HA1      GLY  96  -7.643   5.043   8.502
  803    H    LEU  97           HN       LEU  97  -9.123   3.676   6.542
  804    HA   LEU  97           HA       LEU  97 -11.788   4.275   7.250
  805   1HB   LEU  97           HB2      LEU  97 -10.741   2.298   5.200
  806   2HB   LEU  97           HB1      LEU  97 -12.419   2.836   5.296
  807    HG   LEU  97           HG       LEU  97 -10.503   5.054   5.310
  808   1HD1  LEU  97          HD13      LEU  97 -10.457   2.986   3.141
  809   2HD1  LEU  97          HD12      LEU  97 -10.297   4.685   2.697
  810   3HD1  LEU  97          HD11      LEU  97  -9.135   3.949   3.795
  811   1HD2  LEU  97          HD22      LEU  97 -13.105   4.272   4.083
  812   2HD2  LEU  97          HD21      LEU  97 -12.646   5.776   4.882
  813   3HD2  LEU  97          HD23      LEU  97 -12.150   5.476   3.216
  814    H    ALA  98           HN       ALA  98 -10.029   1.205   7.410
  815    HA   ALA  98           HA       ALA  98 -12.148  -0.485   8.196
  816   1HB   ALA  98           HB1      ALA  98  -9.767  -1.163   7.625
  817   2HB   ALA  98           HB3      ALA  98  -9.304  -0.621   9.237
  818   3HB   ALA  98           HB2      ALA  98 -10.436  -1.961   9.049
  819    H    GLY  99           HN       GLY  99  -9.760   1.080  10.342
  820   1HA   GLY  99           HA2      GLY  99 -10.134   2.130  12.435
  821   2HA   GLY  99           HA1      GLY  99 -11.853   1.776  12.271
  822    H    LEU 100           HN       LEU 100  -9.552  -0.809  11.833
  823    HA   LEU 100           HA       LEU 100 -10.459  -1.945  14.445
  824   1HB   LEU 100           HB2      LEU 100 -10.418  -3.036  11.817
  825   2HB   LEU 100           HB1      LEU 100  -9.194  -3.896  12.753
  826    HG   LEU 100           HG       LEU 100 -11.383  -4.998  12.976
  827   1HD1  LEU 100          HD13      LEU 100  -9.705  -4.779  14.916
  828   2HD1  LEU 100          HD12      LEU 100 -10.797  -3.557  15.568
  829   3HD1  LEU 100          HD11      LEU 100 -11.360  -5.214  15.343
  830   1HD2  LEU 100          HD23      LEU 100 -12.297  -2.305  13.083
  831   2HD2  LEU 100          HD22      LEU 100 -13.270  -3.776  13.116
  832   3HD2  LEU 100          HD21      LEU 100 -12.710  -3.054  14.625
  833    H    ASN 101           HN       ASN 101  -8.821  -3.032  15.742
  834    HA   ASN 101           HA       ASN 101  -6.343  -1.652  15.908
  835   1HB   ASN 101           HB2      ASN 101  -5.843  -3.078  17.670
  836   2HB   ASN 101           HB1      ASN 101  -7.589  -3.305  17.588
  837   1HD2  ASN 101          HD22      ASN 101  -5.229  -6.476  17.019
  838   2HD2  ASN 101          HD21      ASN 101  -4.697  -5.015  17.700
  839    H    SER 102           HN       SER 102  -4.196  -3.124  15.873
  840    HA   SER 102           HA       SER 102  -3.416  -3.426  13.217
  841   1HB   SER 102           HB2      SER 102  -1.664  -5.069  14.219
  842   2HB   SER 102           HB1      SER 102  -1.669  -3.399  14.778
  843    HG   SER 102           HG       SER 102  -2.722  -5.708  16.034
  844    H    CYS 103           HN       CYS 103  -2.941  -5.364  11.939
  845    HA   CYS 103           HA       CYS 103  -4.676  -7.700  12.609
  846   1HB   CYS 103           HB2      CYS 103  -4.588  -7.508   9.799
  847   2HB   CYS 103           HB1      CYS 103  -5.984  -7.243  10.840
  848    HA   PRO 104           HA       PRO 104  -0.322  -9.044  11.946
  849   1HB   PRO 104           HB2      PRO 104  -1.179 -11.526  13.176
  850   2HB   PRO 104           HB1      PRO 104  -0.027 -10.334  13.791
  851   1HG   PRO 104           HG2      PRO 104  -2.701 -10.809  14.723
  852   2HG   PRO 104           HG1      PRO 104  -1.567  -9.575  15.288
  853   1HD   PRO 104           HD2      PRO 104  -3.950  -9.184  13.723
  854   2HD   PRO 104           HD1      PRO 104  -2.791  -7.952  14.262
  855    H    VAL 105           HN       VAL 105  -0.596  -9.252   9.684
  856    HA   VAL 105           HA       VAL 105  -2.339 -10.930   8.282
  857    HB   VAL 105           HB       VAL 105  -0.852  -9.283   7.199
  858   1HG1  VAL 105          HG11      VAL 105   1.132 -10.590   8.699
  859   2HG1  VAL 105          HG13      VAL 105   1.497 -10.974   7.017
  860   3HG1  VAL 105          HG12      VAL 105   1.375  -9.292   7.531
  861   1HG2  VAL 105          HG23      VAL 105  -1.553 -11.822   6.255
  862   2HG2  VAL 105          HG22      VAL 105  -1.034 -10.450   5.275
  863   3HG2  VAL 105          HG21      VAL 105   0.146 -11.645   5.815
  864    H    LYS 106           HN       LYS 106  -2.476 -13.107   7.965
  865    HA   LYS 106           HA       LYS 106  -0.190 -14.793   8.907
  866   1HB   LYS 106           HB2      LYS 106  -3.159 -15.110   9.347
  867   2HB   LYS 106           HB1      LYS 106  -2.067 -16.492   9.443
  868   1HG   LYS 106           HG2      LYS 106  -0.938 -15.635  11.306
  869   2HG   LYS 106           HG1      LYS 106  -1.450 -13.980  10.975
  870   1HD   LYS 106           HD2      LYS 106  -3.058 -14.331  12.529
  871   2HD   LYS 106           HD1      LYS 106  -3.852 -15.319  11.303
  872   1HE   LYS 106           HE2      LYS 106  -3.658 -17.027  12.774
  873   2HE   LYS 106           HE1      LYS 106  -1.948 -17.040  12.343
  874   1HZ   LYS 106           HZ1      LYS 106  -1.979 -15.081  14.128
  875   2HZ   LYS 106           HZ3      LYS 106  -3.254 -16.023  14.732
  876   3HZ   LYS 106           HZ2      LYS 106  -1.710 -16.707  14.542
  877    H    GLU 107           HN       GLU 107  -3.278 -15.570   7.320
  878    HA   GLU 107           HA       GLU 107  -2.208 -17.493   5.552
  879   1HB   GLU 107           HB2      GLU 107  -4.577 -17.427   5.842
  880   2HB   GLU 107           HB1      GLU 107  -4.659 -15.731   5.360
  881   1HG   GLU 107           HG2      GLU 107  -4.291 -16.221   3.096
  882   2HG   GLU 107           HG1      GLU 107  -3.574 -17.792   3.456
  883    H    ALA 108           HN       ALA 108  -0.329 -16.771   4.502
  884    HA   ALA 108           HA       ALA 108  -0.682 -15.339   2.046
  885   1HB   ALA 108           HB1      ALA 108   0.301 -13.804   4.433
  886   2HB   ALA 108           HB3      ALA 108   0.944 -13.425   2.836
  887   3HB   ALA 108           HB2      ALA 108  -0.787 -13.284   3.146
  888    H    ASP 109           HN       ASP 109   0.965 -15.997   0.728
  889    HA   ASP 109           HA       ASP 109   3.250 -17.402   1.987
  890   1HB   ASP 109           HB2      ASP 109   2.687 -17.163  -0.971
  891   2HB   ASP 109           HB1      ASP 109   3.619 -18.406  -0.136
  892    H    GLN 110           HN       GLN 110   5.188 -17.035   0.003
  893    HA   GLN 110           HA       GLN 110   5.876 -14.174   0.465
  894   1HB   GLN 110           HB2      GLN 110   7.378 -16.528   0.717
  895   2HB   GLN 110           HB1      GLN 110   7.971 -15.779  -0.765
  896   1HG   GLN 110           HG2      GLN 110   9.291 -14.760   0.884
  897   2HG   GLN 110           HG1      GLN 110   8.002 -13.583   0.637
  898   1HE2  GLN 110          HE22      GLN 110   8.245 -14.078   4.306
  899   2HE2  GLN 110          HE21      GLN 110   9.226 -13.422   3.085
  900    H    SER 111           HN       SER 111   4.647 -13.256  -1.253
  901    HA   SER 111           HA       SER 111   5.221 -14.223  -3.995
  902   1HB   SER 111           HB2      SER 111   3.579 -12.333  -4.588
  903   2HB   SER 111           HB1      SER 111   2.915 -13.694  -3.686
  904    HG   SER 111           HG       SER 111   2.347 -11.609  -2.829
  905    H    THR 112           HN       THR 112   5.439 -12.086  -5.547
  906    HA   THR 112           HA       THR 112   7.826 -10.708  -4.442
  907    HB   THR 112           HB       THR 112   8.205 -10.030  -6.830
  908    HG1  THR 112           HG1      THR 112   6.436 -10.159  -7.961
  909   1HG2  THR 112          HG23      THR 112   7.974 -12.892  -5.946
  910   2HG2  THR 112          HG22      THR 112   8.501 -12.525  -7.589
  911   3HG2  THR 112          HG21      THR 112   9.424 -11.925  -6.211
  912    H    LEU 113           HN       LEU 113   7.748  -8.583  -3.919
  913    HA   LEU 113           HA       LEU 113   5.366  -7.186  -3.537
  914   1HB   LEU 113           HB2      LEU 113   7.641  -6.587  -2.620
  915   2HB   LEU 113           HB1      LEU 113   8.004  -5.857  -4.184
  916    HG   LEU 113           HG       LEU 113   5.414  -5.054  -3.007
  917   1HD1  LEU 113          HD13      LEU 113   6.824  -5.153  -0.982
  918   2HD1  LEU 113          HD12      LEU 113   8.041  -4.157  -1.781
  919   3HD1  LEU 113          HD11      LEU 113   6.452  -3.484  -1.414
  920   1HD2  LEU 113          HD23      LEU 113   7.560  -4.006  -4.729
  921   2HD2  LEU 113          HD22      LEU 113   5.834  -3.648  -4.742
  922   3HD2  LEU 113          HD21      LEU 113   6.898  -2.809  -3.616
  923    H    GLU 114           HN       GLU 114   7.167  -7.533  -6.515
  924    HA   GLU 114           HA       GLU 114   6.161  -5.273  -7.915
  925   1HB   GLU 114           HB2      GLU 114   7.729  -7.513  -8.531
  926   2HB   GLU 114           HB1      GLU 114   6.333  -7.632  -9.603
  927   1HG   GLU 114           HG2      GLU 114   6.876  -5.723 -10.747
  928   2HG   GLU 114           HG1      GLU 114   7.542  -4.932  -9.318
  929    H    ASN 115           HN       ASN 115   4.902  -8.619  -7.883
  930    HA   ASN 115           HA       ASN 115   2.493  -7.922  -9.315
  931   1HB   ASN 115           HB2      ASN 115   3.756 -10.278  -8.637
  932   2HB   ASN 115           HB1      ASN 115   2.334 -10.297  -7.594
  933   1HD2  ASN 115          HD22      ASN 115   0.051 -10.198 -10.451
  934   2HD2  ASN 115          HD21      ASN 115   0.238  -9.463  -8.932
  935    H    PHE 116           HN       PHE 116   3.362  -7.947  -5.915
  936    HA   PHE 116           HA       PHE 116   0.719  -8.010  -4.825
  937   1HB   PHE 116           HB2      PHE 116   2.493  -8.336  -3.289
  938   2HB   PHE 116           HB1      PHE 116   3.351  -6.902  -3.844
  939    HD1  PHE 116           HD1      PHE 116   0.331  -8.070  -2.002
  940    HD2  PHE 116           HD2      PHE 116   2.900  -4.753  -2.925
  941    HE1  PHE 116           HE1      PHE 116  -0.779  -6.719  -0.243
  942    HE2  PHE 116           HE2      PHE 116   1.789  -3.402  -1.168
  943    HZ   PHE 116           HZ       PHE 116  -0.050  -4.387   0.174
  944    H    LEU 117           HN       LEU 117   2.823  -5.119  -5.138
  945    HA   LEU 117           HA       LEU 117   0.779  -3.220  -4.727
  946   1HB   LEU 117           HB2      LEU 117   3.511  -3.208  -5.783
  947   2HB   LEU 117           HB1      LEU 117   2.483  -1.991  -6.543
  948    HG   LEU 117           HG       LEU 117   2.523  -2.347  -3.547
  949   1HD1  LEU 117          HD13      LEU 117   4.756  -1.606  -5.077
  950   2HD1  LEU 117          HD12      LEU 117   4.071  -0.083  -4.507
  951   3HD1  LEU 117          HD11      LEU 117   4.527  -1.334  -3.348
  952   1HD2  LEU 117          HD23      LEU 117   0.774  -0.990  -4.940
  953   2HD2  LEU 117          HD22      LEU 117   1.488  -0.239  -3.514
  954   3HD2  LEU 117          HD21      LEU 117   2.078   0.182  -5.121
  955    H    GLU 118           HN       GLU 118   1.669  -5.039  -7.600
  956    HA   GLU 118           HA       GLU 118   0.320  -3.540  -9.577
  957   1HB   GLU 118           HB2      GLU 118   1.754  -5.549 -10.003
  958   2HB   GLU 118           HB1      GLU 118   0.449  -6.563  -9.389
  959   1HG   GLU 118           HG2      GLU 118   0.246  -6.514 -11.790
  960   2HG   GLU 118           HG1      GLU 118  -1.057  -5.524 -11.135
  961    NH1  ARG 119           NH2      ARG 119  -3.946 -12.313  -7.794
  962    NH2  ARG 119           NH1      ARG 119  -5.360 -11.697  -9.446
  963    H    ARG 119           HN       ARG 119  -0.979  -6.278  -7.670
  964    HA   ARG 119           HA       ARG 119  -3.686  -5.869  -8.606
  965   1HB   ARG 119           HB2      ARG 119  -2.906  -7.271  -6.043
  966   2HB   ARG 119           HB1      ARG 119  -4.311  -7.574  -7.065
  967   1HG   ARG 119           HG2      ARG 119  -2.591  -8.151  -8.911
  968   2HG   ARG 119           HG1      ARG 119  -1.424  -8.260  -7.593
  969   1HD   ARG 119           HD2      ARG 119  -2.160 -10.439  -7.562
  970   2HD   ARG 119           HD1      ARG 119  -3.389  -9.734  -6.513
  971    HE   ARG 119           HE       ARG 119  -4.426  -9.458  -9.079
  972   1HH1  ARG 119          HH21      ARG 119  -3.246 -12.093  -7.118
  973   2HH1  ARG 119          HH22      ARG 119  -4.277 -13.254  -7.877
  974   1HH2  ARG 119          HH11      ARG 119  -5.747 -10.994 -10.043
  975   2HH2  ARG 119          HH12      ARG 119  -5.676 -12.644  -9.518
  976    H    LEU 120           HN       LEU 120  -1.794  -4.243  -6.201
  977    HA   LEU 120           HA       LEU 120  -4.022  -3.528  -4.484
  978   1HB   LEU 120           HB2      LEU 120  -1.187  -3.018  -4.578
  979   2HB   LEU 120           HB1      LEU 120  -2.051  -1.497  -4.347
  980    HG   LEU 120           HG       LEU 120  -3.441  -2.964  -2.612
  981   1HD1  LEU 120          HD13      LEU 120  -0.720  -4.300  -2.717
  982   2HD1  LEU 120          HD12      LEU 120  -1.923  -4.552  -1.452
  983   3HD1  LEU 120          HD11      LEU 120  -2.265  -5.057  -3.107
  984   1HD2  LEU 120          HD23      LEU 120  -1.859  -0.911  -2.304
  985   2HD2  LEU 120          HD22      LEU 120  -2.192  -1.931  -0.904
  986   3HD2  LEU 120          HD21      LEU 120  -0.673  -2.106  -1.781
  987    H    LYS 121           HN       LYS 121  -2.431  -2.049  -7.282
  988    HA   LYS 121           HA       LYS 121  -4.080   0.349  -7.221
  989   1HB   LYS 121           HB2      LYS 121  -1.733  -0.348  -8.467
  990   2HB   LYS 121           HB1      LYS 121  -2.886  -0.430  -9.799
  991   1HG   LYS 121           HG2      LYS 121  -3.681   1.853  -9.223
  992   2HG   LYS 121           HG1      LYS 121  -2.463   1.935  -7.949
  993   1HD   LYS 121           HD2      LYS 121  -1.642   3.045  -9.982
  994   2HD   LYS 121           HD1      LYS 121  -0.686   1.601  -9.643
  995   1HE   LYS 121           HE2      LYS 121  -1.796   0.345 -11.339
  996   2HE   LYS 121           HE1      LYS 121  -3.069   1.556 -11.504
  997   1HZ   LYS 121           HZ3      LYS 121  -1.295   3.130 -12.226
  998   2HZ   LYS 121           HZ2      LYS 121  -0.218   1.818 -12.276
  999   3HZ   LYS 121           HZ1      LYS 121  -1.574   1.846 -13.299
 1000    H    THR 122           HN       THR 122  -3.958  -2.501  -9.348
 1001    HA   THR 122           HA       THR 122  -6.174  -1.931 -10.976
 1002    HB   THR 122           HB       THR 122  -6.335  -4.704 -10.487
 1003    HG1  THR 122           HG1      THR 122  -3.766  -4.671 -10.944
 1004   1HG2  THR 122          HG22      THR 122  -6.373  -3.451 -12.663
 1005   2HG2  THR 122          HG21      THR 122  -4.625  -3.263 -12.527
 1006   3HG2  THR 122          HG23      THR 122  -5.329  -4.872 -12.681
 1007    H    ILE 123           HN       ILE 123  -6.189  -3.823  -7.965
 1008    HA   ILE 123           HA       ILE 123  -9.002  -4.167  -7.799
 1009    HB   ILE 123           HB       ILE 123  -6.977  -3.946  -5.552
 1010   1HG1  ILE 123          HG12      ILE 123  -6.618  -5.729  -7.348
 1011   2HG1  ILE 123          HG11      ILE 123  -6.780  -6.329  -5.698
 1012   1HG2  ILE 123          HG23      ILE 123  -9.853  -4.852  -5.671
 1013   2HG2  ILE 123          HG22      ILE 123  -8.759  -5.438  -4.419
 1014   3HG2  ILE 123          HG21      ILE 123  -9.108  -3.714  -4.550
 1015   1HD1  ILE 123          HD13      ILE 123  -9.080  -6.152  -7.663
 1016   2HD1  ILE 123          HD12      ILE 123  -8.136  -7.615  -7.382
 1017   3HD1  ILE 123          HD11      ILE 123  -9.098  -6.922  -6.077
 1018    H    MET 124           HN       MET 124  -6.913  -1.511  -6.771
 1019    HA   MET 124           HA       MET 124  -8.784  -0.100  -5.175
 1020   1HB   MET 124           HB2      MET 124  -6.201   0.356  -6.073
 1021   2HB   MET 124           HB1      MET 124  -7.127   1.644  -6.840
 1022   1HG   MET 124           HG2      MET 124  -6.595   2.597  -4.781
 1023   2HG   MET 124           HG1      MET 124  -8.192   1.924  -4.468
 1024   1HE   MET 124           HE2      MET 124  -5.467   2.823  -3.158
 1025   2HE   MET 124           HE1      MET 124  -6.238   2.300  -1.663
 1026   3HE   MET 124           HE3      MET 124  -4.674   1.627  -2.136
 1027    NH1  ARG 125           NH2      ARG 125  -6.861   4.264 -14.335
 1028    NH2  ARG 125           NH1      ARG 125  -7.232   2.171 -15.095
 1029    H    ARG 125           HN       ARG 125  -7.927   0.882  -8.497
 1030    HA   ARG 125           HA       ARG 125 -10.208   2.497  -8.891
 1031   1HB   ARG 125           HB2      ARG 125  -7.976   1.789 -10.380
 1032   2HB   ARG 125           HB1      ARG 125  -9.325   1.179 -11.339
 1033   1HG   ARG 125           HG2      ARG 125 -10.302   3.312 -11.551
 1034   2HG   ARG 125           HG1      ARG 125  -9.393   3.962 -10.185
 1035   1HD   ARG 125           HD2      ARG 125  -8.535   4.729 -12.422
 1036   2HD   ARG 125           HD1      ARG 125  -7.327   3.896 -11.445
 1037    HE   ARG 125           HE       ARG 125  -8.452   1.882 -12.988
 1038   1HH1  ARG 125          HH21      ARG 125  -6.969   4.971 -13.639
 1039   2HH1  ARG 125          HH22      ARG 125  -6.348   4.464 -15.170
 1040   1HH2  ARG 125          HH11      ARG 125  -7.630   1.260 -14.977
 1041   2HH2  ARG 125          HH12      ARG 125  -6.716   2.387 -15.923
 1042    H    GLU 126           HN       GLU 126 -10.020  -0.967  -8.910
 1043    HA   GLU 126           HA       GLU 126 -12.277  -1.412 -10.660
 1044   1HB   GLU 126           HB2      GLU 126 -10.365  -3.004  -9.345
 1045   2HB   GLU 126           HB1      GLU 126 -11.926  -3.516  -8.706
 1046   1HG   GLU 126           HG2      GLU 126 -12.743  -3.617 -11.116
 1047   2HG   GLU 126           HG1      GLU 126 -11.058  -3.420 -11.602
 1048    H    LYS 127           HN       LYS 127 -12.054  -1.894  -7.106
 1049    HA   LYS 127           HA       LYS 127 -14.993  -1.734  -6.955
 1050   1HB   LYS 127           HB2      LYS 127 -12.925  -2.281  -4.812
 1051   2HB   LYS 127           HB1      LYS 127 -14.671  -2.410  -4.604
 1052   1HG   LYS 127           HG2      LYS 127 -14.317  -3.937  -6.834
 1053   2HG   LYS 127           HG1      LYS 127 -12.796  -4.233  -5.988
 1054   1HD   LYS 127           HD2      LYS 127 -15.576  -4.573  -4.820
 1055   2HD   LYS 127           HD1      LYS 127 -14.485  -5.876  -5.293
 1056   1HE   LYS 127           HE2      LYS 127 -12.865  -5.193  -3.607
 1057   2HE   LYS 127           HE1      LYS 127 -13.843  -3.788  -3.188
 1058   1HZ   LYS 127           HZ3      LYS 127 -15.380  -6.171  -3.081
 1059   2HZ   LYS 127           HZ2      LYS 127 -14.009  -6.300  -2.085
 1060   3HZ   LYS 127           HZ1      LYS 127 -15.104  -5.018  -1.869
 1061    OH   TYR 128           OH       TYR 128  -8.865   1.574  -1.398
 1062    H    TYR 128           HN       TYR 128 -12.745   0.660  -7.040
 1063    HA   TYR 128           HA       TYR 128 -13.767   2.158  -4.712
 1064   1HB   TYR 128           HB2      TYR 128 -11.636   2.627  -6.768
 1065   2HB   TYR 128           HB1      TYR 128 -12.286   4.002  -5.877
 1066    HD1  TYR 128           HD1      TYR 128 -11.620   0.456  -4.847
 1067    HD2  TYR 128           HD2      TYR 128 -10.737   4.612  -4.233
 1068    HE1  TYR 128           HE1      TYR 128 -10.194  -0.133  -2.917
 1069    HE2  TYR 128           HE2      TYR 128  -9.313   4.021  -2.292
 1070    HH   TYR 128           HH       TYR 128  -8.956   2.267  -0.740
 1071    H    SER 129           HN       SER 129 -14.209   2.023  -8.189
 1072    HA   SER 129           HA       SER 129 -15.550   4.543  -8.490
 1073   1HB   SER 129           HB2      SER 129 -16.276   3.708 -10.624
 1074   2HB   SER 129           HB1      SER 129 -14.655   3.071 -10.355
 1075    HG   SER 129           HG       SER 129 -16.691   1.667 -10.956
 1076    H    LYS 130           HN       LYS 130 -16.595   1.412  -7.311
 1077    HA   LYS 130           HA       LYS 130 -19.428   2.309  -7.326
 1078   1HB   LYS 130           HB2      LYS 130 -18.128  -0.221  -7.583
 1079   2HB   LYS 130           HB1      LYS 130 -19.097  -0.260  -6.110
 1080   1HG   LYS 130           HG2      LYS 130 -21.060  -0.183  -7.252
 1081   2HG   LYS 130           HG1      LYS 130 -20.449   0.999  -8.407
 1082   1HD   LYS 130           HD2      LYS 130 -20.917  -1.120  -9.549
 1083   2HD   LYS 130           HD1      LYS 130 -19.183  -0.801  -9.556
 1084   1HE   LYS 130           HE2      LYS 130 -18.962  -2.884  -8.696
 1085   2HE   LYS 130           HE1      LYS 130 -19.539  -2.186  -7.185
 1086   1HZ   LYS 130           HZ3      LYS 130 -21.845  -2.605  -8.388
 1087   2HZ   LYS 130           HZ2      LYS 130 -20.945  -3.841  -9.127
 1088   3HZ   LYS 130           HZ1      LYS 130 -21.091  -3.788  -7.435
 1089    H    CYS 131           HN       CYS 131 -17.319   3.437  -5.512
 1090    HA   CYS 131           HA       CYS 131 -17.516   2.434  -2.877
 1091   1HB   CYS 131           HB2      CYS 131 -16.649   4.894  -4.154
 1092   2HB   CYS 131           HB1      CYS 131 -17.481   5.236  -2.636
 1093    H    SER 132           HN       SER 132 -19.708   4.504  -4.716
 1094    HA   SER 132           HA       SER 132 -21.472   4.915  -2.404
 1095   1HB   SER 132           HB2      SER 132 -22.037   6.697  -3.662
 1096   2HB   SER 132           HB1      SER 132 -21.141   6.058  -5.038
 1097    HG   SER 132           HG       SER 132 -22.962   5.442  -5.875
 1098    H    SER 133           HN       SER 133 -23.910   4.389  -2.847
 1099    HA   SER 133           HA       SER 133 -24.042   1.507  -3.429
 1100   1HB   SER 133           HB2      SER 133 -25.424   3.249  -1.713
 1101   2HB   SER 133           HB1      SER 133 -26.607   2.775  -2.928
 1102    HG   SER 133           HG       SER 133 -26.591   1.240  -1.298
   
  Start of MODEL           8
 Raw file had 1102 H/Q atoms
  Start of MODEL    8
    1   1H    GLU   1           HT2      GLU   1 -20.215  13.181   8.453
    2   2H    GLU   1           HT1      GLU   1 -18.656  13.798   8.184
    3   3H    GLU   1           HT3      GLU   1 -19.356  12.744   7.054
    4    HA   GLU   1           HA       GLU   1 -18.682  10.944   8.139
    5   1HB   GLU   1           HB2      GLU   1 -16.860  12.910   8.568
    6   2HB   GLU   1           HB1      GLU   1 -17.251  12.484  10.234
    7   1HG   GLU   1           HG2      GLU   1 -17.006  10.036   8.852
    8   2HG   GLU   1           HG1      GLU   1 -15.647  11.026   8.322
    9    H    ALA   2           HN       ALA   2 -20.723  10.282   9.021
   10    HA   ALA   2           HA       ALA   2 -20.761  10.085  11.909
   11   1HB   ALA   2           HB2      ALA   2 -22.146  12.314  10.670
   12   2HB   ALA   2           HB1      ALA   2 -23.285  11.251  11.500
   13   3HB   ALA   2           HB3      ALA   2 -21.930  11.954  12.383
   14    H    GLU   3           HN       GLU   3 -23.442  10.288   9.556
   15    HA   GLU   3           HA       GLU   3 -24.113   7.471  10.249
   16   1HB   GLU   3           HB2      GLU   3 -25.833   9.305   8.587
   17   2HB   GLU   3           HB1      GLU   3 -26.325   7.942   9.594
   18   1HG   GLU   3           HG2      GLU   3 -25.568   9.238  11.608
   19   2HG   GLU   3           HG1      GLU   3 -25.283  10.622  10.551
   20    H    ALA   4           HN       ALA   4 -21.899   8.137   8.447
   21    HA   ALA   4           HA       ALA   4 -22.509   6.304   6.313
   22   1HB   ALA   4           HB3      ALA   4 -23.605   8.649   5.700
   23   2HB   ALA   4           HB2      ALA   4 -21.953   9.037   5.225
   24   3HB   ALA   4           HB1      ALA   4 -22.792   7.682   4.469
   25    H    HIS   5           HN       HIS   5 -20.606   6.138   4.787
   26    HA   HIS   5           HA       HIS   5 -18.120   6.555   6.318
   27   1HB   HIS   5           HB2      HIS   5 -18.890   4.994   3.868
   28   2HB   HIS   5           HB1      HIS   5 -17.190   5.331   4.189
   29    HD1  HIS   5           HD1      HIS   5 -16.849   4.948   7.101
   30    HD2  HIS   5           HD2      HIS   5 -19.388   2.486   4.895
   31    HE1  HIS   5           HE1      HIS   5 -17.127   2.818   8.444
   32    H    LYS   6           HN       LYS   6 -16.189   7.019   4.522
   33    HA   LYS   6           HA       LYS   6 -17.033   9.482   3.053
   34   1HB   LYS   6           HB2      LYS   6 -14.847   9.089   5.054
   35   2HB   LYS   6           HB1      LYS   6 -14.535  10.168   3.695
   36   1HG   LYS   6           HG2      LYS   6 -16.665  11.375   4.238
   37   2HG   LYS   6           HG1      LYS   6 -16.814  10.373   5.682
   38   1HD   LYS   6           HD2      LYS   6 -15.757  12.508   6.258
   39   2HD   LYS   6           HD1      LYS   6 -14.598  11.193   6.452
   40   1HE   LYS   6           HE2      LYS   6 -13.492  11.730   4.409
   41   2HE   LYS   6           HE1      LYS   6 -14.799  12.799   3.899
   42   1HZ   LYS   6           HZ2      LYS   6 -14.078  13.845   6.275
   43   2HZ   LYS   6           HZ1      LYS   6 -12.583  13.315   5.666
   44   3HZ   LYS   6           HZ3      LYS   6 -13.528  14.399   4.766
   45    H    CYS   7           HN       CYS   7 -16.865   7.036   1.780
   46    HA   CYS   7           HA       CYS   7 -14.288   6.420   0.687
   47   1HB   CYS   7           HB2      CYS   7 -15.866   4.724   0.370
   48   2HB   CYS   7           HB1      CYS   7 -17.130   5.854  -0.109
   49    H    ASP   8           HN       ASP   8 -16.665   8.859  -0.096
   50    HA   ASP   8           HA       ASP   8 -16.025   9.478  -2.747
   51   1HB   ASP   8           HB2      ASP   8 -17.219  10.885  -0.475
   52   2HB   ASP   8           HB1      ASP   8 -16.396  11.965  -1.602
   53    H    ILE   9           HN       ILE   9 -14.737  11.474  -0.074
   54    HA   ILE   9           HA       ILE   9 -12.450  12.164  -1.798
   55    HB   ILE   9           HB       ILE   9 -13.443  13.184   0.860
   56   1HG1  ILE   9          HG12      ILE   9 -12.865  14.987  -1.403
   57   2HG1  ILE   9          HG11      ILE   9 -14.129  13.800  -1.729
   58   1HG2  ILE   9          HG23      ILE   9 -10.768  13.445  -0.422
   59   2HG2  ILE   9          HG22      ILE   9 -11.478  14.921   0.233
   60   3HG2  ILE   9          HG21      ILE   9 -11.210  13.530   1.283
   61   1HD1  ILE   9          HD12      ILE   9 -14.370  15.004   0.929
   62   2HD1  ILE   9          HD11      ILE   9 -14.480  16.192  -0.370
   63   3HD1  ILE   9          HD13      ILE   9 -15.588  14.820  -0.334
   64    H    THR  10           HN       THR  10 -12.977  10.343   1.215
   65    HA   THR  10           HA       THR  10 -10.231  10.201   1.977
   66    HB   THR  10           HB       THR  10 -12.282   8.022   2.427
   67    HG1  THR  10           HG1      THR  10 -11.731  10.347   3.958
   68   1HG2  THR  10          HG22      THR  10  -9.554   8.570   3.333
   69   2HG2  THR  10          HG21      THR  10 -10.680   8.331   4.669
   70   3HG2  THR  10          HG23      THR  10 -10.493   7.082   3.438
   71    H    LEU  11           HN       LEU  11 -12.084   7.528   0.466
   72    HA   LEU  11           HA       LEU  11  -9.711   6.111  -0.282
   73   1HB   LEU  11           HB2      LEU  11 -12.611   5.838  -0.739
   74   2HB   LEU  11           HB1      LEU  11 -11.595   5.139  -2.002
   75    HG   LEU  11           HG       LEU  11 -10.256   4.047  -0.106
   76   1HD1  LEU  11          HD13      LEU  11 -12.159   5.574   1.411
   77   2HD1  LEU  11          HD12      LEU  11 -12.409   3.859   1.739
   78   3HD1  LEU  11          HD11      LEU  11 -10.824   4.585   2.003
   79   1HD2  LEU  11          HD21      LEU  11 -12.133   3.027  -1.613
   80   2HD2  LEU  11          HD23      LEU  11 -11.626   2.142  -0.175
   81   3HD2  LEU  11          HD22      LEU  11 -13.112   3.093  -0.148
   82    H    GLN  12           HN       GLN  12 -11.223   8.840  -1.772
   83    HA   GLN  12           HA       GLN  12 -10.351   8.262  -4.489
   84   1HB   GLN  12           HB2      GLN  12 -12.127   9.847  -4.273
   85   2HB   GLN  12           HB1      GLN  12 -11.236  10.791  -3.078
   86   1HG   GLN  12           HG2      GLN  12 -10.040  11.896  -4.663
   87   2HG   GLN  12           HG1      GLN  12  -9.829  10.448  -5.646
   88   1HE2  GLN  12          HE22      GLN  12 -13.068  12.876  -6.312
   89   2HE2  GLN  12          HE21      GLN  12 -12.171  13.045  -4.881
   90    H    GLU  13           HN       GLU  13  -9.185  10.620  -2.077
   91    HA   GLU  13           HA       GLU  13  -6.762  11.256  -3.432
   92   1HB   GLU  13           HB2      GLU  13  -8.018  12.157  -1.164
   93   2HB   GLU  13           HB1      GLU  13  -6.651  11.275  -0.480
   94   1HG   GLU  13           HG2      GLU  13  -5.860  13.495  -0.836
   95   2HG   GLU  13           HG1      GLU  13  -5.186  12.537  -2.157
   96    H    ILE  14           HN       ILE  14  -7.677   8.628  -1.298
   97    HA   ILE  14           HA       ILE  14  -5.021   7.663  -0.747
   98    HB   ILE  14           HB       ILE  14  -7.752   6.890  -0.189
   99   1HG1  ILE  14          HG12      ILE  14  -5.551   5.480   1.166
  100   2HG1  ILE  14          HG11      ILE  14  -5.389   7.237   1.165
  101   1HG2  ILE  14          HG22      ILE  14  -5.877   4.662  -1.057
  102   2HG2  ILE  14          HG21      ILE  14  -7.381   4.423  -0.172
  103   3HG2  ILE  14          HG23      ILE  14  -7.419   5.085  -1.805
  104   1HD1  ILE  14          HD13      ILE  14  -8.126   6.405   1.721
  105   2HD1  ILE  14          HD12      ILE  14  -6.988   5.739   2.890
  106   3HD1  ILE  14          HD11      ILE  14  -7.077   7.482   2.642
  107    H    ILE  15           HN       ILE  15  -7.345   7.148  -3.330
  108    HA   ILE  15           HA       ILE  15  -6.081   4.894  -4.556
  109    HB   ILE  15           HB       ILE  15  -8.077   6.959  -5.349
  110   1HG1  ILE  15          HG12      ILE  15  -8.298   4.105  -6.128
  111   2HG1  ILE  15          HG11      ILE  15  -8.229   4.418  -4.392
  112   1HG2  ILE  15          HG21      ILE  15  -6.406   5.365  -7.288
  113   2HG2  ILE  15          HG23      ILE  15  -8.044   5.882  -7.689
  114   3HG2  ILE  15          HG22      ILE  15  -6.803   7.083  -7.335
  115   1HD1  ILE  15          HD12      ILE  15  -9.976   6.360  -5.228
  116   2HD1  ILE  15          HD11      ILE  15 -10.361   5.041  -6.333
  117   3HD1  ILE  15          HD13      ILE  15 -10.464   4.791  -4.590
  118    H    LYS  16           HN       LYS  16  -5.886   8.383  -5.373
  119    HA   LYS  16           HA       LYS  16  -3.915   8.113  -7.404
  120   1HB   LYS  16           HB2      LYS  16  -4.234  10.449  -5.496
  121   2HB   LYS  16           HB1      LYS  16  -3.502  10.490  -7.101
  122   1HG   LYS  16           HG2      LYS  16  -5.844   9.494  -7.840
  123   2HG   LYS  16           HG1      LYS  16  -6.391  10.250  -6.342
  124   1HD   LYS  16           HD2      LYS  16  -4.643  11.897  -8.097
  125   2HD   LYS  16           HD1      LYS  16  -6.279  11.588  -8.679
  126   1HE   LYS  16           HE2      LYS  16  -6.606  12.201  -5.969
  127   2HE   LYS  16           HE1      LYS  16  -5.394  13.347  -6.538
  128   1HZ   LYS  16           HZ1      LYS  16  -7.766  12.869  -8.194
  129   2HZ   LYS  16           HZ3      LYS  16  -7.930  13.838  -6.811
  130   3HZ   LYS  16           HZ2      LYS  16  -6.828  14.276  -8.028
  131    H    THR  17           HN       THR  17  -3.586   8.491  -3.898
  132    HA   THR  17           HA       THR  17  -0.766   8.835  -3.786
  133    HB   THR  17           HB       THR  17  -2.385   7.276  -1.763
  134    HG1  THR  17           HG1      THR  17  -2.337  10.019  -2.384
  135   1HG2  THR  17          HG22      THR  17   0.157   8.862  -1.780
  136   2HG2  THR  17          HG21      THR  17  -0.783   8.757  -0.293
  137   3HG2  THR  17          HG23      THR  17  -0.167   7.289  -1.054
  138    H    LEU  18           HN       LEU  18  -2.749   5.893  -3.905
  139    HA   LEU  18           HA       LEU  18  -0.702   3.992  -3.489
  140   1HB   LEU  18           HB2      LEU  18  -3.282   3.697  -3.814
  141   2HB   LEU  18           HB1      LEU  18  -2.855   3.493  -5.512
  142    HG   LEU  18           HG       LEU  18  -0.978   1.946  -4.154
  143   1HD1  LEU  18          HD13      LEU  18  -3.074   2.335  -2.366
  144   2HD1  LEU  18          HD12      LEU  18  -3.418   0.766  -3.092
  145   3HD1  LEU  18          HD11      LEU  18  -1.872   1.050  -2.293
  146   1HD2  LEU  18          HD21      LEU  18  -3.214   1.606  -5.980
  147   2HD2  LEU  18          HD23      LEU  18  -1.667   0.763  -5.944
  148   3HD2  LEU  18          HD22      LEU  18  -3.004   0.197  -4.942
  149    H    ASN  19           HN       ASN  19  -1.913   5.380  -6.552
  150    HA   ASN  19           HA       ASN  19  -0.078   4.057  -8.275
  151   1HB   ASN  19           HB2      ASN  19  -1.188   6.859  -8.622
  152   2HB   ASN  19           HB1      ASN  19  -0.583   5.802  -9.897
  153   1HD2  ASN  19          HD22      ASN  19  -3.603   3.998 -10.188
  154   2HD2  ASN  19          HD21      ASN  19  -2.016   4.219 -10.747
  155    H    SER  20           HN       SER  20   0.324   6.843  -6.183
  156    HA   SER  20           HA       SER  20   2.713   7.899  -7.350
  157   1HB   SER  20           HB2      SER  20   2.083   7.949  -4.396
  158   2HB   SER  20           HB1      SER  20   2.957   9.149  -5.344
  159    HG   SER  20           HG       SER  20   1.034   9.656  -6.391
  160    H    LEU  21           HN       LEU  21   2.194   5.364  -4.902
  161    HA   LEU  21           HA       LEU  21   4.992   5.032  -4.291
  162   1HB   LEU  21           HB2      LEU  21   2.676   3.093  -4.030
  163   2HB   LEU  21           HB1      LEU  21   4.281   2.830  -3.349
  164    HG   LEU  21           HG       LEU  21   3.595   5.408  -2.520
  165   1HD1  LEU  21          HD12      LEU  21   1.234   4.588  -3.305
  166   2HD1  LEU  21          HD11      LEU  21   1.275   3.626  -1.827
  167   3HD1  LEU  21          HD13      LEU  21   1.389   5.384  -1.739
  168   1HD2  LEU  21          HD21      LEU  21   4.807   3.644  -1.246
  169   2HD2  LEU  21          HD23      LEU  21   3.513   4.373  -0.296
  170   3HD2  LEU  21          HD22      LEU  21   3.283   2.784  -1.025
  171    H    THR  22           HN       THR  22   2.998   3.911  -6.927
  172    HA   THR  22           HA       THR  22   4.612   1.672  -7.722
  173    HB   THR  22           HB       THR  22   2.217   2.645  -8.530
  174    HG1  THR  22           HG1      THR  22   3.162   1.291 -10.579
  175   1HG2  THR  22          HG22      THR  22   3.507   4.506  -9.723
  176   2HG2  THR  22          HG21      THR  22   4.064   3.259 -10.841
  177   3HG2  THR  22          HG23      THR  22   2.342   3.614 -10.701
  178    H    GLU  23           HN       GLU  23   5.244   5.050  -7.872
  179    HA   GLU  23           HA       GLU  23   6.680   5.353 -10.262
  180   1HB   GLU  23           HB2      GLU  23   6.183   7.138  -8.520
  181   2HB   GLU  23           HB1      GLU  23   7.560   6.514  -7.609
  182   1HG   GLU  23           HG2      GLU  23   9.098   7.093  -9.318
  183   2HG   GLU  23           HG1      GLU  23   7.817   7.302 -10.512
  184    H    GLN  24           HN       GLN  24   7.622   3.687  -7.313
  185    HA   GLN  24           HA       GLN  24  10.327   3.186  -8.467
  186   1HB   GLN  24           HB2      GLN  24   9.181   3.125  -5.698
  187   2HB   GLN  24           HB1      GLN  24  10.557   2.084  -6.064
  188   1HG   GLN  24           HG2      GLN  24  11.208   4.554  -7.218
  189   2HG   GLN  24           HG1      GLN  24  10.497   4.960  -5.655
  190   1HE2  GLN  24          HE22      GLN  24  13.393   4.004  -3.914
  191   2HE2  GLN  24          HE21      GLN  24  11.971   4.931  -3.958
  192    H    LYS  25           HN       LYS  25   8.900   1.776 -10.010
  193    HA   LYS  25           HA       LYS  25   8.441  -0.901  -8.769
  194   1HB   LYS  25           HB2      LYS  25   6.511   0.245  -9.940
  195   2HB   LYS  25           HB1      LYS  25   7.420   0.084 -11.442
  196   1HG   LYS  25           HG2      LYS  25   7.530  -2.375 -11.083
  197   2HG   LYS  25           HG1      LYS  25   6.541  -2.186  -9.636
  198   1HD   LYS  25           HD2      LYS  25   5.068  -0.812 -11.506
  199   2HD   LYS  25           HD1      LYS  25   5.746  -2.123 -12.471
  200   1HE   LYS  25           HE2      LYS  25   3.562  -2.734 -11.430
  201   2HE   LYS  25           HE1      LYS  25   4.881  -3.780 -10.902
  202   1HZ   LYS  25           HZ3      LYS  25   4.654  -1.478  -9.246
  203   2HZ   LYS  25           HZ2      LYS  25   3.187  -2.332  -9.298
  204   3HZ   LYS  25           HZ1      LYS  25   4.615  -3.119  -8.816
  205    H    THR  26           HN       THR  26  11.024  -0.712  -9.077
  206    HA   THR  26           HA       THR  26  11.632  -2.501 -11.302
  207    HB   THR  26           HB       THR  26  12.909   0.251 -11.263
  208    HG1  THR  26           HG1      THR  26  11.084   0.633 -12.267
  209   1HG2  THR  26          HG23      THR  26  13.242  -2.151 -13.081
  210   2HG2  THR  26          HG22      THR  26  13.901  -0.550 -13.420
  211   3HG2  THR  26          HG21      THR  26  14.464  -1.456 -12.016
  212    H    LEU  27           HN       LEU  27  13.456  -0.147  -9.307
  213    HA   LEU  27           HA       LEU  27  15.383  -2.276  -8.631
  214   1HB   LEU  27           HB2      LEU  27  15.573   0.484  -9.013
  215   2HB   LEU  27           HB1      LEU  27  15.770   0.275  -7.273
  216    HG   LEU  27           HG       LEU  27  17.957   0.109  -8.302
  217   1HD1  LEU  27          HD13      LEU  27  17.058  -1.643  -6.531
  218   2HD1  LEU  27          HD12      LEU  27  17.270  -2.776  -7.866
  219   3HD1  LEU  27          HD11      LEU  27  18.648  -1.852  -7.266
  220   1HD2  LEU  27          HD21      LEU  27  16.684  -0.768 -10.518
  221   2HD2  LEU  27          HD23      LEU  27  18.406  -1.032 -10.244
  222   3HD2  LEU  27          HD22      LEU  27  17.249  -2.314  -9.882
  223    H    CYS  28           HN       CYS  28  12.932  -0.287  -7.017
  224    HA   CYS  28           HA       CYS  28  13.609  -1.475  -4.407
  225   1HB   CYS  28           HB2      CYS  28  11.864   0.729  -5.370
  226   2HB   CYS  28           HB1      CYS  28  11.351  -0.098  -3.900
  227    H    THR  29           HN       THR  29  11.366  -2.071  -7.003
  228    HA   THR  29           HA       THR  29   9.599  -3.668  -5.257
  229    HB   THR  29           HB       THR  29   8.533  -4.184  -7.586
  230    HG1  THR  29           HG1      THR  29   9.425  -3.208  -9.199
  231   1HG2  THR  29          HG21      THR  29   8.563  -1.414  -6.357
  232   2HG2  THR  29          HG23      THR  29   7.353  -1.989  -7.505
  233   3HG2  THR  29          HG22      THR  29   7.491  -2.744  -5.919
  234    H    GLU  30           HN       GLU  30  12.579  -4.308  -6.287
  235    HA   GLU  30           HA       GLU  30  11.971  -7.029  -7.327
  236   1HB   GLU  30           HB2      GLU  30  14.354  -7.109  -7.931
  237   2HB   GLU  30           HB1      GLU  30  13.612  -5.650  -8.587
  238   1HG   GLU  30           HG2      GLU  30  15.063  -4.366  -7.450
  239   2HG   GLU  30           HG1      GLU  30  14.549  -5.098  -5.929
  240    H    LEU  31           HN       LEU  31  11.483  -6.407  -4.537
  241    HA   LEU  31           HA       LEU  31  13.590  -8.100  -3.287
  242   1HB   LEU  31           HB2      LEU  31  11.783  -5.992  -2.050
  243   2HB   LEU  31           HB1      LEU  31  12.856  -7.047  -1.128
  244    HG   LEU  31           HG       LEU  31  14.424  -5.949  -3.214
  245   1HD1  LEU  31          HD13      LEU  31  12.341  -4.110  -2.248
  246   2HD1  LEU  31          HD12      LEU  31  13.977  -3.484  -2.056
  247   3HD1  LEU  31          HD11      LEU  31  13.402  -3.972  -3.650
  248   1HD2  LEU  31          HD21      LEU  31  14.762  -6.562  -0.634
  249   2HD2  LEU  31          HD23      LEU  31  15.824  -5.418  -1.456
  250   3HD2  LEU  31          HD22      LEU  31  14.505  -4.827  -0.445
  251    H    THR  32           HN       THR  32  11.156  -8.024  -1.083
  252    HA   THR  32           HA       THR  32   9.227  -9.764  -2.386
  253    HB   THR  32           HB       THR  32   9.799 -11.655  -0.659
  254    HG1  THR  32           HG1      THR  32  11.418 -10.697   0.463
  255   1HG2  THR  32          HG23      THR  32  10.096 -11.514  -3.272
  256   2HG2  THR  32          HG22      THR  32  11.811 -11.411  -2.873
  257   3HG2  THR  32          HG21      THR  32  10.872 -12.817  -2.372
  258    H    VAL  33           HN       VAL  33   7.379 -10.077  -1.070
  259    HA   VAL  33           HA       VAL  33   7.466  -9.081   1.716
  260    HB   VAL  33           HB       VAL  33   5.598  -7.529   1.344
  261   1HG1  VAL  33          HG13      VAL  33   8.082  -6.917   0.922
  262   2HG1  VAL  33          HG12      VAL  33   7.635  -6.911  -0.784
  263   3HG1  VAL  33          HG11      VAL  33   6.842  -5.807   0.339
  264   1HG2  VAL  33          HG21      VAL  33   4.663  -8.858  -0.621
  265   2HG2  VAL  33          HG23      VAL  33   4.693  -7.110  -0.847
  266   3HG2  VAL  33          HG22      VAL  33   5.920  -8.119  -1.612
  267    H    THR  34           HN       THR  34   4.519  -9.036   1.885
  268    HA   THR  34           HA       THR  34   4.106 -11.973   1.850
  269    HB   THR  34           HB       THR  34   3.257  -9.772   3.555
  270    HG1  THR  34           HG1      THR  34   3.863 -11.333   4.793
  271   1HG2  THR  34          HG22      THR  34   1.126 -11.672   2.538
  272   2HG2  THR  34          HG21      THR  34   0.964 -10.677   3.982
  273   3HG2  THR  34          HG23      THR  34   1.126  -9.913   2.403
  274    H    ASP  35           HN       ASP  35   2.219 -12.886   0.881
  275    HA   ASP  35           HA       ASP  35   1.015 -11.162  -1.241
  276   1HB   ASP  35           HB2      ASP  35   2.205 -13.695  -1.394
  277   2HB   ASP  35           HB1      ASP  35   0.472 -14.014  -1.480
  278    H    ILE  36           HN       ILE  36  -0.980 -10.437  -0.649
  279    HA   ILE  36           HA       ILE  36  -2.618 -12.182   1.128
  280    HB   ILE  36           HB       ILE  36  -3.578 -10.283   2.026
  281   1HG1  ILE  36          HG12      ILE  36  -2.985  -8.994  -0.649
  282   2HG1  ILE  36          HG11      ILE  36  -4.563  -9.342   0.059
  283   1HG2  ILE  36          HG21      ILE  36  -0.989 -10.289   2.161
  284   2HG2  ILE  36          HG23      ILE  36  -1.065  -8.973   0.989
  285   3HG2  ILE  36          HG22      ILE  36  -1.827  -8.791   2.569
  286   1HD1  ILE  36          HD12      ILE  36  -3.914  -7.763   1.955
  287   2HD1  ILE  36          HD11      ILE  36  -2.553  -7.265   0.949
  288   3HD1  ILE  36          HD13      ILE  36  -4.206  -7.003   0.391
  289    H    PHE  37           HN       PHE  37  -2.353 -11.420  -2.139
  290    HA   PHE  37           HA       PHE  37  -5.278 -11.459  -2.610
  291   1HB   PHE  37           HB2      PHE  37  -2.967 -11.247  -4.564
  292   2HB   PHE  37           HB1      PHE  37  -4.676 -11.085  -4.972
  293    HD1  PHE  37           HD2      PHE  37  -6.029  -9.249  -3.788
  294    HD2  PHE  37           HD1      PHE  37  -1.736  -9.393  -3.781
  295    HE1  PHE  37           HE2      PHE  37  -5.951  -6.847  -3.172
  296    HE2  PHE  37           HE1      PHE  37  -1.657  -6.992  -3.166
  297    HZ   PHE  37           HZ       PHE  37  -3.763  -5.719  -2.861
  298    H    ALA  38           HN       ALA  38  -3.517 -13.838  -1.655
  299    HA   ALA  38           HA       ALA  38  -4.326 -15.711  -3.843
  300   1HB   ALA  38           HB1      ALA  38  -1.860 -15.459  -2.277
  301   2HB   ALA  38           HB3      ALA  38  -2.518 -17.096  -2.265
  302   3HB   ALA  38           HB2      ALA  38  -2.142 -16.307  -3.798
  303    H    ALA  39           HN       ALA  39  -5.757 -14.662  -1.293
  304    HA   ALA  39           HA       ALA  39  -6.975 -17.205  -0.608
  305   1HB   ALA  39           HB3      ALA  39  -4.793 -16.179   1.033
  306   2HB   ALA  39           HB2      ALA  39  -6.286 -16.345   1.959
  307   3HB   ALA  39           HB1      ALA  39  -5.613 -17.739   1.113
  308    H    SER  40           HN       SER  40  -8.777 -15.865  -1.375
  309    HA   SER  40           HA       SER  40  -9.746 -14.004   0.755
  310   1HB   SER  40           HB2      SER  40  -9.990 -13.691  -2.249
  311   2HB   SER  40           HB1      SER  40 -10.856 -12.697  -1.080
  312    HG   SER  40           HG       SER  40  -8.975 -11.828  -0.415
  313    H    LYS  41           HN       LYS  41 -11.684 -14.640   1.568
  314    HA   LYS  41           HA       LYS  41 -13.309 -16.540  -0.074
  315   1HB   LYS  41           HB2      LYS  41 -13.456 -16.220   2.931
  316   2HB   LYS  41           HB1      LYS  41 -14.071 -17.550   1.949
  317   1HG   LYS  41           HG2      LYS  41 -11.751 -18.142   1.313
  318   2HG   LYS  41           HG1      LYS  41 -11.149 -16.836   2.335
  319   1HD   LYS  41           HD2      LYS  41 -11.695 -17.934   4.302
  320   2HD   LYS  41           HD1      LYS  41 -13.002 -18.849   3.550
  321   1HE   LYS  41           HE2      LYS  41 -10.452 -19.496   2.324
  322   2HE   LYS  41           HE1      LYS  41 -10.401 -19.769   4.066
  323   1HZ   LYS  41           HZ2      LYS  41 -12.704 -20.702   2.483
  324   2HZ   LYS  41           HZ1      LYS  41 -11.277 -21.624   2.535
  325   3HZ   LYS  41           HZ3      LYS  41 -12.118 -21.283   3.968
  326    H    ASP  42           HN       ASP  42 -13.446 -13.744   2.109
  327    HA   ASP  42           HA       ASP  42 -15.634 -12.548   0.696
  328   1HB   ASP  42           HB2      ASP  42 -16.905 -14.398   1.750
  329   2HB   ASP  42           HB1      ASP  42 -16.355 -13.857   3.337
  330    H    THR  43           HN       THR  43 -13.442 -11.277   1.286
  331    HA   THR  43           HA       THR  43 -13.847  -9.865   3.884
  332    HB   THR  43           HB       THR  43 -11.482  -8.954   3.249
  333    HG1  THR  43           HG1      THR  43 -10.381 -10.254   1.830
  334   1HG2  THR  43          HG22      THR  43 -11.972 -10.562   5.078
  335   2HG2  THR  43          HG21      THR  43 -11.863 -11.886   3.919
  336   3HG2  THR  43          HG23      THR  43 -10.438 -10.912   4.283
  337    H    THR  44           HN       THR  44 -13.646  -7.498   3.861
  338    HA   THR  44           HA       THR  44 -14.680  -6.353   1.311
  339    HB   THR  44           HB       THR  44 -14.841  -4.391   3.300
  340    HG1  THR  44           HG1      THR  44 -15.194  -5.370   5.118
  341   1HG2  THR  44          HG22      THR  44 -16.668  -6.208   1.842
  342   2HG2  THR  44          HG21      THR  44 -17.327  -5.485   3.309
  343   3HG2  THR  44          HG23      THR  44 -16.723  -4.454   2.013
  344    H    GLU  45           HN       GLU  45 -14.002  -3.739   1.481
  345    HA   GLU  45           HA       GLU  45 -11.137  -3.808   0.936
  346   1HB   GLU  45           HB2      GLU  45 -11.367  -1.549   0.224
  347   2HB   GLU  45           HB1      GLU  45 -12.865  -2.342  -0.267
  348   1HG   GLU  45           HG2      GLU  45 -13.715  -1.567   2.104
  349   2HG   GLU  45           HG1      GLU  45 -12.399  -0.398   1.975
  350    H    LYS  46           HN       LYS  46 -13.154  -2.976   3.660
  351    HA   LYS  46           HA       LYS  46 -11.191  -1.329   5.000
  352   1HB   LYS  46           HB2      LYS  46 -13.460  -2.924   6.219
  353   2HB   LYS  46           HB1      LYS  46 -12.644  -1.536   6.930
  354   1HG   LYS  46           HG2      LYS  46 -14.080  -0.157   5.888
  355   2HG   LYS  46           HG1      LYS  46 -13.531  -0.775   4.330
  356   1HD   LYS  46           HD2      LYS  46 -15.843  -1.248   4.323
  357   2HD   LYS  46           HD1      LYS  46 -15.111  -2.778   4.807
  358   1HE   LYS  46           HE2      LYS  46 -15.623  -2.399   7.115
  359   2HE   LYS  46           HE1      LYS  46 -16.056  -0.717   6.810
  360   1HZ   LYS  46           HZ1      LYS  46 -17.628  -2.240   5.124
  361   2HZ   LYS  46           HZ3      LYS  46 -17.673  -3.030   6.624
  362   3HZ   LYS  46           HZ2      LYS  46 -18.126  -1.397   6.513
  363    H    GLU  47           HN       GLU  47 -12.115  -4.770   5.240
  364    HA   GLU  47           HA       GLU  47 -10.157  -5.379   7.277
  365   1HB   GLU  47           HB2      GLU  47 -12.299  -6.707   6.380
  366   2HB   GLU  47           HB1      GLU  47 -11.077  -7.492   5.381
  367   1HG   GLU  47           HG2      GLU  47  -9.817  -7.507   7.790
  368   2HG   GLU  47           HG1      GLU  47 -11.499  -7.637   8.309
  369    H    THR  48           HN       THR  48 -10.217  -6.005   3.746
  370    HA   THR  48           HA       THR  48  -7.607  -7.121   3.596
  371    HB   THR  48           HB       THR  48  -8.686  -5.410   1.376
  372    HG1  THR  48           HG1      THR  48 -10.110  -7.068   0.865
  373   1HG2  THR  48          HG21      THR  48  -6.538  -7.050   1.543
  374   2HG2  THR  48          HG23      THR  48  -7.759  -8.203   1.007
  375   3HG2  THR  48          HG22      THR  48  -7.419  -6.767   0.042
  376    H    PHE  49           HN       PHE  49  -8.678  -3.780   3.763
  377    HA   PHE  49           HA       PHE  49  -6.162  -2.609   2.944
  378   1HB   PHE  49           HB2      PHE  49  -8.654  -1.626   4.278
  379   2HB   PHE  49           HB1      PHE  49  -7.202  -0.633   4.392
  380    HD1  PHE  49           HD1      PHE  49  -8.106  -2.876   1.568
  381    HD2  PHE  49           HD2      PHE  49  -7.802   1.182   2.945
  382    HE1  PHE  49           HE1      PHE  49  -8.502  -2.065  -0.738
  383    HE2  PHE  49           HE2      PHE  49  -8.195   1.992   0.635
  384    HZ   PHE  49           HZ       PHE  49  -8.553   0.367  -1.204
  385    H    CYS  50           HN       CYS  50  -7.513  -3.703   6.014
  386    HA   CYS  50           HA       CYS  50  -5.468  -2.519   7.677
  387   1HB   CYS  50           HB2      CYS  50  -7.583  -3.281   8.651
  388   2HB   CYS  50           HB1      CYS  50  -7.257  -4.933   8.133
  389    NH1  ARG  51           NH2      ARG  51  -6.634 -12.169   4.519
  390    NH2  ARG  51           NH1      ARG  51  -4.738 -12.549   3.350
  391    H    ARG  51           HN       ARG  51  -5.826  -5.726   6.145
  392    HA   ARG  51           HA       ARG  51  -3.498  -6.922   7.267
  393   1HB   ARG  51           HB2      ARG  51  -5.304  -7.442   5.010
  394   2HB   ARG  51           HB1      ARG  51  -3.649  -7.975   4.711
  395   1HG   ARG  51           HG2      ARG  51  -3.656  -9.447   6.538
  396   2HG   ARG  51           HG1      ARG  51  -5.002  -8.619   7.320
  397   1HD   ARG  51           HD2      ARG  51  -6.047 -10.523   6.444
  398   2HD   ARG  51           HD1      ARG  51  -6.341  -9.325   5.183
  399    HE   ARG  51           HE       ARG  51  -3.933 -10.516   4.462
  400   1HH1  ARG  51          HH21      ARG  51  -7.165 -11.625   5.165
  401   2HH1  ARG  51          HH22      ARG  51  -7.039 -12.987   4.110
  402   1HH2  ARG  51          HH11      ARG  51  -3.805 -12.291   3.099
  403   2HH2  ARG  51          HH12      ARG  51  -5.156 -13.363   2.949
  404    H    ALA  52           HN       ALA  52  -3.842  -5.427   4.026
  405    HA   ALA  52           HA       ALA  52  -1.037  -5.392   3.484
  406   1HB   ALA  52           HB2      ALA  52  -3.131  -4.947   1.932
  407   2HB   ALA  52           HB1      ALA  52  -2.838  -3.267   2.382
  408   3HB   ALA  52           HB3      ALA  52  -1.577  -4.194   1.570
  409    H    ALA  53           HN       ALA  53  -3.004  -3.386   5.520
  410    HA   ALA  53           HA       ALA  53  -1.304  -1.047   5.470
  411   1HB   ALA  53           HB1      ALA  53  -3.572  -2.035   7.138
  412   2HB   ALA  53           HB3      ALA  53  -2.512  -0.823   7.858
  413   3HB   ALA  53           HB2      ALA  53  -3.356  -0.472   6.350
  414    H    THR  54           HN       THR  54  -1.415  -4.023   7.355
  415    HA   THR  54           HA       THR  54   0.572  -3.187   9.291
  416    HB   THR  54           HB       THR  54  -0.543  -5.875   8.458
  417    HG1  THR  54           HG1      THR  54  -0.619  -4.492  10.926
  418   1HG2  THR  54          HG22      THR  54   1.647  -5.240  10.449
  419   2HG2  THR  54          HG21      THR  54   0.721  -6.741  10.484
  420   3HG2  THR  54          HG23      THR  54   1.722  -6.355   9.085
  421    H    VAL  55           HN       VAL  55   0.688  -5.333   6.424
  422    HA   VAL  55           HA       VAL  55   3.487  -5.785   6.452
  423    HB   VAL  55           HB       VAL  55   1.566  -5.580   4.111
  424   1HG1  VAL  55          HG12      VAL  55   4.482  -6.267   4.296
  425   2HG1  VAL  55          HG11      VAL  55   3.476  -7.123   3.127
  426   3HG1  VAL  55          HG13      VAL  55   3.624  -5.368   3.044
  427   1HG2  VAL  55          HG23      VAL  55   1.792  -7.464   6.166
  428   2HG2  VAL  55          HG22      VAL  55   0.972  -7.702   4.623
  429   3HG2  VAL  55          HG21      VAL  55   2.654  -8.194   4.812
  430    H    LEU  56           HN       LEU  56   1.601  -3.009   5.422
  431    HA   LEU  56           HA       LEU  56   3.730  -1.700   3.965
  432   1HB   LEU  56           HB2      LEU  56   0.988  -1.178   4.589
  433   2HB   LEU  56           HB1      LEU  56   1.935   0.217   5.108
  434    HG   LEU  56           HG       LEU  56   3.104  -0.126   2.748
  435   1HD1  LEU  56          HD12      LEU  56   0.511  -1.623   2.592
  436   2HD1  LEU  56          HD11      LEU  56   1.056  -0.716   1.181
  437   3HD1  LEU  56          HD13      LEU  56   2.064  -2.000   1.848
  438   1HD2  LEU  56          HD21      LEU  56   1.670   1.815   3.660
  439   2HD2  LEU  56          HD23      LEU  56   1.727   1.621   1.908
  440   3HD2  LEU  56          HD22      LEU  56   0.322   1.056   2.812
  441    NH1  ARG  57           NH2      ARG  57   0.853  -1.192  13.720
  442    NH2  ARG  57           NH1      ARG  57  -0.977  -1.819  12.552
  443    H    ARG  57           HN       ARG  57   2.563  -1.586   7.321
  444    HA   ARG  57           HA       ARG  57   4.177   0.538   8.259
  445   1HB   ARG  57           HB2      ARG  57   2.873  -1.839   9.488
  446   2HB   ARG  57           HB1      ARG  57   4.157  -1.072  10.422
  447   1HG   ARG  57           HG2      ARG  57   2.970   1.146   9.972
  448   2HG   ARG  57           HG1      ARG  57   1.607   0.187   9.396
  449   1HD   ARG  57           HD2      ARG  57   2.721  -0.645  12.010
  450   2HD   ARG  57           HD1      ARG  57   1.932   0.932  11.995
  451    HE   ARG  57           HE       ARG  57   0.150  -0.731  10.667
  452   1HH1  ARG  57          HH21      ARG  57   1.745  -0.745  13.771
  453   2HH1  ARG  57          HH22      ARG  57   0.464  -1.612  14.540
  454   1HH2  ARG  57          HH11      ARG  57  -1.493  -1.852  11.696
  455   2HH2  ARG  57          HH12      ARG  57  -1.354  -2.235  13.379
  456    H    GLN  58           HN       GLN  58   4.923  -2.883   7.740
  457    HA   GLN  58           HA       GLN  58   7.585  -2.719   8.885
  458   1HB   GLN  58           HB2      GLN  58   5.925  -4.779   8.075
  459   2HB   GLN  58           HB1      GLN  58   7.178  -4.780   6.832
  460   1HG   GLN  58           HG2      GLN  58   8.760  -4.519   8.976
  461   2HG   GLN  58           HG1      GLN  58   7.405  -5.338   9.755
  462   1HE2  GLN  58          HE22      GLN  58   7.804  -8.103   7.212
  463   2HE2  GLN  58          HE21      GLN  58   6.584  -6.957   7.497
  464    H    PHE  59           HN       PHE  59   6.194  -2.223   5.693
  465    HA   PHE  59           HA       PHE  59   8.578  -2.268   4.136
  466   1HB   PHE  59           HB2      PHE  59   6.085  -2.030   3.403
  467   2HB   PHE  59           HB1      PHE  59   6.346  -0.303   3.635
  468    HD1  PHE  59           HD1      PHE  59   7.278  -3.267   1.654
  469    HD2  PHE  59           HD2      PHE  59   7.865   0.955   2.194
  470    HE1  PHE  59           HE1      PHE  59   8.378  -3.135  -0.565
  471    HE2  PHE  59           HE2      PHE  59   8.966   1.085  -0.023
  472    HZ   PHE  59           HZ       PHE  59   9.222  -0.959  -1.403
  473    OH   TYR  60           OH       TYR  60   5.650   3.896  11.205
  474    H    TYR  60           HN       TYR  60   6.983   0.505   5.767
  475    HA   TYR  60           HA       TYR  60   9.360   2.154   5.199
  476   1HB   TYR  60           HB2      TYR  60   8.023   3.976   5.547
  477   2HB   TYR  60           HB1      TYR  60   6.734   2.805   5.267
  478    HD1  TYR  60           HD2      TYR  60   5.567   1.738   7.193
  479    HD2  TYR  60           HD1      TYR  60   8.428   4.895   7.735
  480    HE1  TYR  60           HE2      TYR  60   4.735   2.096   9.501
  481    HE2  TYR  60           HE1      TYR  60   7.596   5.252  10.045
  482    HH   TYR  60           HH       TYR  60   5.636   4.840  11.373
  483    H    SER  61           HN       SER  61   8.515   0.011   7.646
  484    HA   SER  61           HA       SER  61   9.725   1.634   9.794
  485   1HB   SER  61           HB2      SER  61   8.428  -1.086   9.684
  486   2HB   SER  61           HB1      SER  61   9.341  -0.570  11.098
  487    HG   SER  61           HG       SER  61   7.418   0.228  11.569
  488    H    HIS  62           HN       HIS  62  10.298  -1.674   8.580
  489    HA   HIS  62           HA       HIS  62  13.129  -1.462   9.414
  490   1HB   HIS  62           HB2      HIS  62  11.566  -3.789   8.259
  491   2HB   HIS  62           HB1      HIS  62  13.215  -3.872   8.881
  492    HD1  HIS  62           HD1      HIS  62  10.525  -5.284  10.074
  493    HD2  HIS  62           HD2      HIS  62  12.549  -1.988  11.630
  494    HE1  HIS  62           HE1      HIS  62   9.915  -5.162  12.528
  495    H    HIS  63           HN       HIS  63  11.208  -1.873   6.468
  496    HA   HIS  63           HA       HIS  63  13.639  -2.002   4.811
  497   1HB   HIS  63           HB2      HIS  63  11.686  -3.434   4.315
  498   2HB   HIS  63           HB1      HIS  63  10.708  -1.999   4.036
  499    HD1  HIS  63           HD1      HIS  63  14.272  -2.557   2.840
  500    HD2  HIS  63           HD2      HIS  63  10.429  -2.139   1.280
  501    HE1  HIS  63           HE1      HIS  63  14.533  -2.418   0.324
  502    H    GLU  64           HN       GLU  64  12.634   0.551   6.325
  503    HA   GLU  64           HA       GLU  64  12.225   2.366   4.024
  504   1HB   GLU  64           HB2      GLU  64  10.932   3.235   5.709
  505   2HB   GLU  64           HB1      GLU  64  11.955   2.571   6.978
  506   1HG   GLU  64           HG2      GLU  64  13.570   4.314   6.721
  507   2HG   GLU  64           HG1      GLU  64  12.841   4.858   5.209
  508    H    LYS  65           HN       LYS  65  14.686   1.471   6.376
  509    HA   LYS  65           HA       LYS  65  16.564   3.400   5.073
  510   1HB   LYS  65           HB2      LYS  65  16.041   3.209   7.716
  511   2HB   LYS  65           HB1      LYS  65  17.331   2.011   7.592
  512   1HG   LYS  65           HG2      LYS  65  18.922   3.578   7.068
  513   2HG   LYS  65           HG1      LYS  65  17.780   4.595   6.187
  514   1HD   LYS  65           HD2      LYS  65  17.318   5.837   8.018
  515   2HD   LYS  65           HD1      LYS  65  17.150   4.408   9.038
  516   1HE   LYS  65           HE2      LYS  65  19.035   5.432   9.964
  517   2HE   LYS  65           HE1      LYS  65  19.763   4.289   8.835
  518   1HZ   LYS  65           HZ3      LYS  65  19.825   6.093   7.180
  519   2HZ   LYS  65           HZ2      LYS  65  19.257   7.175   8.361
  520   3HZ   LYS  65           HZ1      LYS  65  20.770   6.426   8.548
  521    H    ASP  66           HN       ASP  66  16.091   1.169   3.595
  522    HA   ASP  66           HA       ASP  66  18.098  -0.883   4.294
  523   1HB   ASP  66           HB2      ASP  66  15.671  -1.063   3.069
  524   2HB   ASP  66           HB1      ASP  66  16.742  -1.009   1.668
  525    H    THR  67           HN       THR  67  20.029  -1.156   3.197
  526    HA   THR  67           HA       THR  67  21.142   1.101   1.809
  527    HB   THR  67           HB       THR  67  22.628  -0.369   3.009
  528    HG1  THR  67           HG1      THR  67  24.032  -0.070   1.504
  529   1HG2  THR  67          HG23      THR  67  21.204  -2.461   1.425
  530   2HG2  THR  67          HG22      THR  67  22.895  -2.751   1.833
  531   3HG2  THR  67          HG21      THR  67  21.712  -2.482   3.114
  532    NH1  ARG  68           NH2      ARG  68  18.770  -8.074  -0.789
  533    NH2  ARG  68           NH1      ARG  68  18.701  -8.471  -3.011
  534    H    ARG  68           HN       ARG  68  19.455  -1.777   0.732
  535    HA   ARG  68           HA       ARG  68  20.314  -1.652  -2.021
  536   1HB   ARG  68           HB2      ARG  68  18.229  -3.091  -0.468
  537   2HB   ARG  68           HB1      ARG  68  17.915  -2.890  -2.193
  538   1HG   ARG  68           HG2      ARG  68  19.784  -4.131  -2.818
  539   2HG   ARG  68           HG1      ARG  68  20.626  -3.816  -1.300
  540   1HD   ARG  68           HD2      ARG  68  19.834  -5.736  -0.440
  541   2HD   ARG  68           HD1      ARG  68  18.180  -5.188  -0.711
  542    HE   ARG  68           HE       ARG  68  19.026  -6.048  -3.210
  543   1HH1  ARG  68          HH21      ARG  68  18.860  -7.447  -0.018
  544   2HH1  ARG  68          HH22      ARG  68  18.640  -9.051  -0.620
  545   1HH2  ARG  68          HH11      ARG  68  18.737  -8.143  -3.955
  546   2HH2  ARG  68          HH12      ARG  68  18.571  -9.446  -2.825
  547    H    CYS  69           HN       CYS  69  17.127  -0.812  -0.595
  548    HA   CYS  69           HA       CYS  69  16.253   0.616  -2.924
  549   1HB   CYS  69           HB2      CYS  69  15.298   0.214  -0.157
  550   2HB   CYS  69           HB1      CYS  69  14.769   1.715  -0.919
  551    H    LEU  70           HN       LEU  70  18.489   1.502  -0.460
  552    HA   LEU  70           HA       LEU  70  18.080   4.266  -0.168
  553   1HB   LEU  70           HB2      LEU  70  20.103   2.440   0.479
  554   2HB   LEU  70           HB1      LEU  70  20.898   3.647  -0.533
  555    HG   LEU  70           HG       LEU  70  20.984   4.350   1.812
  556   1HD1  LEU  70          HD12      LEU  70  20.476   5.973  -0.163
  557   2HD1  LEU  70          HD11      LEU  70  18.858   6.059   0.531
  558   3HD1  LEU  70          HD13      LEU  70  20.253   6.562   1.485
  559   1HD2  LEU  70          HD22      LEU  70  18.217   3.415   1.732
  560   2HD2  LEU  70          HD21      LEU  70  19.268   3.680   3.124
  561   3HD2  LEU  70          HD23      LEU  70  18.349   5.023   2.444
  562    H    GLY  71           HN       GLY  71  19.739   2.525  -2.797
  563   1HA   GLY  71           HA2      GLY  71  19.687   3.301  -5.087
  564   2HA   GLY  71           HA1      GLY  71  19.346   4.928  -4.497
  565    H    ALA  72           HN       ALA  72  21.356   4.595  -6.359
  566    HA   ALA  72           HA       ALA  72  23.803   5.061  -4.701
  567   1HB   ALA  72           HB1      ALA  72  23.402   3.044  -6.647
  568   2HB   ALA  72           HB3      ALA  72  24.459   4.243  -7.390
  569   3HB   ALA  72           HB2      ALA  72  24.918   3.488  -5.865
  570    H    THR  73           HN       THR  73  21.862   7.025  -5.633
  571    HA   THR  73           HA       THR  73  23.727   8.835  -6.972
  572    HB   THR  73           HB       THR  73  22.914   7.814  -8.973
  573    HG1  THR  73           HG1      THR  73  22.805   9.935  -9.330
  574   1HG2  THR  73          HG22      THR  73  20.495   7.506  -7.369
  575   2HG2  THR  73          HG21      THR  73  20.146   8.080  -9.000
  576   3HG2  THR  73          HG23      THR  73  21.039   6.578  -8.767
  577    H    ALA  74           HN       ALA  74  22.844  11.054  -7.036
  578    HA   ALA  74           HA       ALA  74  21.347  11.690  -4.673
  579   1HB   ALA  74           HB3      ALA  74  22.643  13.140  -6.853
  580   2HB   ALA  74           HB2      ALA  74  21.149  13.918  -6.331
  581   3HB   ALA  74           HB1      ALA  74  22.435  13.609  -5.165
  582    H    GLN  75           HN       GLN  75  20.418  11.104  -8.005
  583    HA   GLN  75           HA       GLN  75  17.804  12.292  -7.872
  584   1HB   GLN  75           HB2      GLN  75  18.956  10.090  -9.603
  585   2HB   GLN  75           HB1      GLN  75  17.323  10.721  -9.812
  586   1HG   GLN  75           HG2      GLN  75  19.039  12.971  -9.622
  587   2HG   GLN  75           HG1      GLN  75  19.809  11.840 -10.736
  588   1HE2  GLN  75          HE22      GLN  75  17.079  14.032 -12.372
  589   2HE2  GLN  75          HE21      GLN  75  18.239  14.460 -11.209
  590    H    GLN  76           HN       GLN  76  18.778   8.847  -7.667
  591    HA   GLN  76           HA       GLN  76  16.220   7.869  -6.906
  592   1HB   GLN  76           HB2      GLN  76  18.937   6.754  -6.143
  593   2HB   GLN  76           HB1      GLN  76  17.410   5.870  -6.134
  594   1HG   GLN  76           HG2      GLN  76  18.141   7.239  -8.674
  595   2HG   GLN  76           HG1      GLN  76  19.094   5.819  -8.237
  596   1HE2  GLN  76          HE22      GLN  76  16.393   4.199 -10.001
  597   2HE2  GLN  76          HE21      GLN  76  17.922   4.894 -10.245
  598    H    PHE  77           HN       PHE  77  18.689   9.499  -5.042
  599    HA   PHE  77           HA       PHE  77  17.902   8.636  -2.435
  600   1HB   PHE  77           HB2      PHE  77  19.803  10.385  -3.496
  601   2HB   PHE  77           HB1      PHE  77  18.759  11.418  -2.519
  602    HD1  PHE  77           HD2      PHE  77  18.114  10.459  -0.145
  603    HD2  PHE  77           HD1      PHE  77  21.511   9.185  -2.445
  604    HE1  PHE  77           HE2      PHE  77  19.188   9.598   1.918
  605    HE2  PHE  77           HE1      PHE  77  22.585   8.323  -0.381
  606    HZ   PHE  77           HZ       PHE  77  21.422   8.530   1.800
  607    H    HIS  78           HN       HIS  78  16.815  11.391  -4.429
  608    HA   HIS  78           HA       HIS  78  14.930  12.294  -2.396
  609   1HB   HIS  78           HB2      HIS  78  15.787  13.947  -3.920
  610   2HB   HIS  78           HB1      HIS  78  15.291  12.995  -5.320
  611    HD1  HIS  78           HD1      HIS  78  12.795  13.028  -5.973
  612    HD2  HIS  78           HD2      HIS  78  13.644  15.302  -2.584
  613    HE1  HIS  78           HE1      HIS  78  10.724  14.407  -5.499
  614    NH1  ARG  79           NH2      ARG  79  14.500  10.634 -10.045
  615    NH2  ARG  79           NH1      ARG  79  15.036   8.777 -11.210
  616    H    ARG  79           HN       ARG  79  14.824  10.121  -5.149
  617    HA   ARG  79           HA       ARG  79  11.928  10.022  -5.301
  618   1HB   ARG  79           HB2      ARG  79  14.063   8.125  -6.319
  619   2HB   ARG  79           HB1      ARG  79  12.345   7.980  -6.691
  620   1HG   ARG  79           HG2      ARG  79  13.020  10.671  -7.209
  621   2HG   ARG  79           HG1      ARG  79  14.323   9.707  -7.900
  622   1HD   ARG  79           HD2      ARG  79  11.694   8.560  -8.442
  623   2HD   ARG  79           HD1      ARG  79  11.841  10.195  -9.077
  624    HE   ARG  79           HE       ARG  79  13.015   7.848 -10.199
  625   1HH1  ARG  79          HH21      ARG  79  13.890  11.135  -9.436
  626   2HH1  ARG  79          HH22      ARG  79  15.304  11.093 -10.427
  627   1HH2  ARG  79          HH11      ARG  79  14.836   7.839 -11.489
  628   2HH2  ARG  79          HH12      ARG  79  15.831   9.252 -11.587
  629    H    HIS  80           HN       HIS  80  14.301   8.501  -3.259
  630    HA   HIS  80           HA       HIS  80  12.464   6.330  -2.483
  631   1HB   HIS  80           HB2      HIS  80  14.859   5.835  -2.592
  632   2HB   HIS  80           HB1      HIS  80  15.198   7.124  -1.439
  633    HD1  HIS  80           HD1      HIS  80  12.834   4.116  -1.502
  634    HD2  HIS  80           HD2      HIS  80  15.454   6.067   1.088
  635    HE1  HIS  80           HE1      HIS  80  12.781   2.825   0.677
  636    H    LYS  81           HN       LYS  81  13.957   9.199  -0.962
  637    HA   LYS  81           HA       LYS  81  12.715   8.940   1.574
  638   1HB   LYS  81           HB2      LYS  81  14.510  10.656   0.639
  639   2HB   LYS  81           HB1      LYS  81  13.084  11.661   0.377
  640   1HG   LYS  81           HG2      LYS  81  12.581  11.781   2.650
  641   2HG   LYS  81           HG1      LYS  81  13.445  10.288   3.022
  642   1HD   LYS  81           HD2      LYS  81  14.969  12.653   1.968
  643   2HD   LYS  81           HD1      LYS  81  14.518  12.597   3.673
  644   1HE   LYS  81           HE2      LYS  81  15.995  10.373   2.239
  645   2HE   LYS  81           HE1      LYS  81  16.785  11.620   3.205
  646   1HZ   LYS  81           HZ1      LYS  81  14.904  10.785   4.894
  647   2HZ   LYS  81           HZ3      LYS  81  15.202   9.342   4.053
  648   3HZ   LYS  81           HZ2      LYS  81  16.475  10.140   4.846
  649    H    GLN  82           HN       GLN  82  11.412   9.995  -1.496
  650    HA   GLN  82           HA       GLN  82   9.057  11.260  -0.308
  651   1HB   GLN  82           HB2      GLN  82  10.109  11.829  -2.580
  652   2HB   GLN  82           HB1      GLN  82   9.353  10.351  -3.175
  653   1HG   GLN  82           HG2      GLN  82   7.148  11.206  -2.368
  654   2HG   GLN  82           HG1      GLN  82   7.937  12.718  -1.916
  655   1HE2  GLN  82          HE22      GLN  82   7.584  13.992  -5.168
  656   2HE2  GLN  82          HE21      GLN  82   7.639  14.284  -3.496
  657    H    LEU  83           HN       LEU  83   9.781   8.164  -1.927
  658    HA   LEU  83           HA       LEU  83   7.126   7.161  -1.972
  659   1HB   LEU  83           HB2      LEU  83   8.182   5.453  -2.986
  660   2HB   LEU  83           HB1      LEU  83   9.721   6.199  -2.584
  661    HG   LEU  83           HG       LEU  83   9.509   5.010  -0.296
  662   1HD1  LEU  83          HD12      LEU  83   6.982   4.402  -1.227
  663   2HD1  LEU  83          HD11      LEU  83   7.875   2.927  -1.596
  664   3HD1  LEU  83          HD13      LEU  83   7.810   3.527   0.061
  665   1HD2  LEU  83          HD21      LEU  83  10.963   4.357  -2.290
  666   2HD2  LEU  83          HD23      LEU  83  10.571   3.062  -1.159
  667   3HD2  LEU  83          HD22      LEU  83   9.710   3.185  -2.694
  668    H    ILE  84           HN       ILE  84   9.531   7.216   0.608
  669    HA   ILE  84           HA       ILE  84   8.129   5.466   2.399
  670    HB   ILE  84           HB       ILE  84  10.005   7.749   3.080
  671   1HG1  ILE  84          HG12      ILE  84  10.864   5.998   1.429
  672   2HG1  ILE  84          HG11      ILE  84  11.796   6.154   2.919
  673   1HG2  ILE  84          HG23      ILE  84   8.631   5.650   4.623
  674   2HG2  ILE  84          HG22      ILE  84  10.369   5.725   4.907
  675   3HG2  ILE  84          HG21      ILE  84   9.369   7.151   5.181
  676   1HD1  ILE  84          HD11      ILE  84   9.552   4.238   3.062
  677   2HD1  ILE  84          HD13      ILE  84  10.844   3.780   1.953
  678   3HD1  ILE  84          HD12      ILE  84  11.205   4.080   3.652
  679    NH1  ARG  85           NH2      ARG  85   8.608  15.679   2.877
  680    NH2  ARG  85           NH1      ARG  85   9.296  15.480   5.019
  681    H    ARG  85           HN       ARG  85   7.923   8.938   1.767
  682    HA   ARG  85           HA       ARG  85   6.250   9.580   4.014
  683   1HB   ARG  85           HB2      ARG  85   6.554  10.895   1.300
  684   2HB   ARG  85           HB1      ARG  85   5.616  11.584   2.626
  685   1HG   ARG  85           HG2      ARG  85   7.775  11.294   4.031
  686   2HG   ARG  85           HG1      ARG  85   8.590  11.119   2.476
  687   1HD   ARG  85           HD2      ARG  85   8.288  13.313   1.915
  688   2HD   ARG  85           HD1      ARG  85   6.711  13.404   2.702
  689    HE   ARG  85           HE       ARG  85   8.476  13.177   4.815
  690   1HH1  ARG  85          HH21      ARG  85   8.193  15.295   2.055
  691   2HH1  ARG  85          HH22      ARG  85   8.917  16.630   2.877
  692   1HH2  ARG  85          HH11      ARG  85   9.410  14.932   5.848
  693   2HH2  ARG  85          HH12      ARG  85   9.599  16.432   5.001
  694    H    PHE  86           HN       PHE  86   5.507   8.744   0.635
  695    HA   PHE  86           HA       PHE  86   2.698   8.966   0.761
  696   1HB   PHE  86           HB2      PHE  86   4.566   7.229  -0.837
  697   2HB   PHE  86           HB1      PHE  86   2.823   6.996  -0.966
  698    HD1  PHE  86           HD2      PHE  86   1.700   9.658  -0.809
  699    HD2  PHE  86           HD1      PHE  86   5.311   8.358  -2.740
  700    HE1  PHE  86           HE2      PHE  86   1.553  11.574  -2.373
  701    HE2  PHE  86           HE1      PHE  86   5.162  10.276  -4.305
  702    HZ   PHE  86           HZ       PHE  86   3.284  11.885  -4.122
  703    H    LEU  87           HN       LEU  87   4.819   6.296   1.745
  704    HA   LEU  87           HA       LEU  87   2.728   4.423   2.324
  705   1HB   LEU  87           HB2      LEU  87   5.605   4.644   2.771
  706   2HB   LEU  87           HB1      LEU  87   4.786   3.881   4.133
  707    HG   LEU  87           HG       LEU  87   3.609   2.745   1.846
  708   1HD1  LEU  87          HD13      LEU  87   5.597   3.723   0.618
  709   2HD1  LEU  87          HD12      LEU  87   6.627   2.686   1.604
  710   3HD1  LEU  87          HD11      LEU  87   5.450   1.969   0.504
  711   1HD2  LEU  87          HD22      LEU  87   5.725   1.784   3.790
  712   2HD2  LEU  87          HD21      LEU  87   3.983   1.525   3.888
  713   3HD2  LEU  87          HD23      LEU  87   4.926   0.721   2.632
  714    H    LYS  88           HN       LYS  88   4.444   6.756   4.416
  715    HA   LYS  88           HA       LYS  88   3.173   6.126   6.852
  716   1HB   LYS  88           HB2      LYS  88   4.080   8.822   5.798
  717   2HB   LYS  88           HB1      LYS  88   3.641   8.505   7.477
  718   1HG   LYS  88           HG2      LYS  88   5.388   6.522   7.202
  719   2HG   LYS  88           HG1      LYS  88   6.025   7.566   5.930
  720   1HD   LYS  88           HD2      LYS  88   6.487   9.323   7.434
  721   2HD   LYS  88           HD1      LYS  88   5.418   8.663   8.672
  722   1HE   LYS  88           HE2      LYS  88   6.939   6.970   9.261
  723   2HE   LYS  88           HE1      LYS  88   7.826   7.110   7.743
  724   1HZ   LYS  88           HZ1      LYS  88   7.712   9.241   9.806
  725   2HZ   LYS  88           HZ3      LYS  88   8.974   8.115   9.675
  726   3HZ   LYS  88           HZ2      LYS  88   8.683   9.216   8.413
  727    NH1  ARG  89           NH2      ARG  89   0.759  12.557  -0.189
  728    NH2  ARG  89           NH1      ARG  89   2.992  12.698   0.134
  729    H    ARG  89           HN       ARG  89   1.992   7.985   4.102
  730    HA   ARG  89           HA       ARG  89  -0.311   9.066   5.484
  731   1HB   ARG  89           HB2      ARG  89   0.406   8.731   2.569
  732   2HB   ARG  89           HB1      ARG  89  -1.148   9.396   3.075
  733   1HG   ARG  89           HG2      ARG  89   0.079  11.108   4.428
  734   2HG   ARG  89           HG1      ARG  89   1.594  10.491   3.767
  735   1HD   ARG  89           HD2      ARG  89  -0.193  10.935   1.583
  736   2HD   ARG  89           HD1      ARG  89  -0.201  12.381   2.591
  737    HE   ARG  89           HE       ARG  89   2.488  11.754   2.341
  738   1HH1  ARG  89          HH21      ARG  89  -0.155  12.316   0.133
  739   2HH1  ARG  89          HH22      ARG  89   0.876  12.942  -1.104
  740   1HH2  ARG  89          HH11      ARG  89   3.796  12.564   0.712
  741   2HH2  ARG  89          HH12      ARG  89   3.094  13.077  -0.787
  742    H    LEU  90           HN       LEU  90   0.102   6.341   3.214
  743    HA   LEU  90           HA       LEU  90  -2.624   5.454   3.409
  744   1HB   LEU  90           HB2      LEU  90  -0.228   3.737   2.737
  745   2HB   LEU  90           HB1      LEU  90  -1.900   3.491   2.234
  746    HG   LEU  90           HG       LEU  90   0.083   5.535   1.273
  747   1HD1  LEU  90          HD12      LEU  90  -0.698   3.197   0.218
  748   2HD1  LEU  90          HD11      LEU  90  -1.993   4.215  -0.415
  749   3HD1  LEU  90          HD13      LEU  90  -0.312   4.592  -0.790
  750   1HD2  LEU  90          HD22      LEU  90  -2.907   5.807   1.474
  751   2HD2  LEU  90          HD21      LEU  90  -1.662   7.028   1.736
  752   3HD2  LEU  90          HD23      LEU  90  -2.060   6.512   0.098
  753    H    ASP  91           HN       ASP  91  -0.063   5.241   5.678
  754    HA   ASP  91           HA       ASP  91  -0.574   2.690   6.825
  755   1HB   ASP  91           HB2      ASP  91   1.361   3.818   7.600
  756   2HB   ASP  91           HB1      ASP  91   0.457   5.287   7.970
  757    NH1  ARG  92           NH2      ARG  92  -5.105   3.919  14.047
  758    NH2  ARG  92           NH1      ARG  92  -3.760   4.781  15.642
  759    H    ARG  92           HN       ARG  92  -1.676   5.834   8.125
  760    HA   ARG  92           HA       ARG  92  -3.923   4.434   9.443
  761   1HB   ARG  92           HB2      ARG  92  -2.844   7.249   9.615
  762   2HB   ARG  92           HB1      ARG  92  -4.348   6.764  10.400
  763   1HG   ARG  92           HG2      ARG  92  -1.750   5.272  10.816
  764   2HG   ARG  92           HG1      ARG  92  -2.242   6.620  11.842
  765   1HD   ARG  92           HD2      ARG  92  -4.527   5.104  11.810
  766   2HD   ARG  92           HD1      ARG  92  -3.281   3.858  11.738
  767    HE   ARG  92           HE       ARG  92  -2.421   5.571  13.747
  768   1HH1  ARG  92          HH21      ARG  92  -5.331   3.761  13.088
  769   2HH1  ARG  92          HH22      ARG  92  -5.706   3.559  14.762
  770   1HH2  ARG  92          HH11      ARG  92  -2.941   5.291  15.907
  771   2HH2  ARG  92          HH12      ARG  92  -4.371   4.417  16.345
  772    H    ASN  93           HN       ASN  93  -3.456   6.001   6.453
  773    HA   ASN  93           HA       ASN  93  -6.166   7.152   6.359
  774   1HB   ASN  93           HB2      ASN  93  -3.991   6.871   4.268
  775   2HB   ASN  93           HB1      ASN  93  -5.558   7.615   3.955
  776   1HD2  ASN  93          HD22      ASN  93  -3.663  10.551   4.878
  777   2HD2  ASN  93          HD21      ASN  93  -4.057   9.588   3.536
  778    H    LEU  94           HN       LEU  94  -4.441   4.394   4.907
  779    HA   LEU  94           HA       LEU  94  -6.771   3.494   3.435
  780   1HB   LEU  94           HB2      LEU  94  -4.010   2.795   3.609
  781   2HB   LEU  94           HB1      LEU  94  -4.953   1.337   3.908
  782    HG   LEU  94           HG       LEU  94  -6.327   2.431   1.811
  783   1HD1  LEU  94          HD12      LEU  94  -4.096   4.008   1.883
  784   2HD1  LEU  94          HD11      LEU  94  -3.568   2.728   0.790
  785   3HD1  LEU  94          HD13      LEU  94  -5.013   3.666   0.417
  786   1HD2  LEU  94          HD23      LEU  94  -4.915   0.131   2.330
  787   2HD2  LEU  94          HD22      LEU  94  -5.723   0.480   0.802
  788   3HD2  LEU  94          HD21      LEU  94  -4.001   0.813   0.984
  789    CH2  TRP  95           CH2      TRP  95  -5.016   0.827  13.429
  790    H    TRP  95           HN       TRP  95  -5.179   2.342   6.436
  791    HA   TRP  95           HA       TRP  95  -7.440   0.504   6.889
  792   1HB   TRP  95           HB2      TRP  95  -5.458  -0.535   7.491
  793   2HB   TRP  95           HB1      TRP  95  -4.765   0.942   8.159
  794    HD1  TRP  95           HD1      TRP  95  -7.808  -1.341   8.955
  795    HE1  TRP  95           HE1      TRP  95  -7.995  -1.515  11.523
  796    HE3  TRP  95           HE3      TRP  95  -3.962   1.673  10.298
  797    HZ2  TRP  95           HZ2      TRP  95  -6.673  -0.481  13.852
  798    HZ3  TRP  95           HZ3      TRP  95  -3.428   2.083  12.690
  799    HH2  TRP  95           HH2      TRP  95  -4.783   1.005  14.467
  800    H    GLY  96           HN       GLY  96  -6.495   3.700   7.901
  801   1HA   GLY  96           HA2      GLY  96  -7.742   3.798  10.460
  802   2HA   GLY  96           HA1      GLY  96  -7.601   5.183   9.379
  803    H    LEU  97           HN       LEU  97  -9.071   4.325   7.203
  804    HA   LEU  97           HA       LEU  97 -11.745   4.927   7.892
  805   1HB   LEU  97           HB2      LEU  97 -10.561   4.788   5.557
  806   2HB   LEU  97           HB1      LEU  97 -11.065   3.099   5.591
  807    HG   LEU  97           HG       LEU  97 -13.303   4.657   6.394
  808   1HD1  LEU  97          HD12      LEU  97 -11.793   6.398   5.074
  809   2HD1  LEU  97          HD11      LEU  97 -12.436   5.549   3.668
  810   3HD1  LEU  97          HD13      LEU  97 -13.535   6.333   4.803
  811   1HD2  LEU  97          HD22      LEU  97 -12.499   2.888   4.113
  812   2HD2  LEU  97          HD21      LEU  97 -13.791   2.671   5.295
  813   3HD2  LEU  97          HD23      LEU  97 -13.995   3.811   3.965
  814    H    ALA  98           HN       ALA  98 -10.019   1.876   7.697
  815    HA   ALA  98           HA       ALA  98 -12.164   0.059   7.947
  816   1HB   ALA  98           HB3      ALA  98  -9.464  -0.178   7.753
  817   2HB   ALA  98           HB2      ALA  98  -9.686  -0.555   9.461
  818   3HB   ALA  98           HB1      ALA  98 -10.515  -1.512   8.232
  819    H    GLY  99           HN       GLY  99 -10.045   1.226  10.575
  820   1HA   GLY  99           HA2      GLY  99 -10.670   1.876  12.774
  821   2HA   GLY  99           HA1      GLY  99 -12.350   1.520  12.370
  822    H    LEU 100           HN       LEU 100  -9.818  -0.820  11.769
  823    HA   LEU 100           HA       LEU 100 -11.161  -2.716  13.574
  824   1HB   LEU 100           HB2      LEU 100  -9.418  -2.874  11.265
  825   2HB   LEU 100           HB1      LEU 100  -8.789  -3.870  12.578
  826    HG   LEU 100           HG       LEU 100 -10.401  -5.085  11.091
  827   1HD1  LEU 100          HD11      LEU 100 -10.040  -5.672  13.509
  828   2HD1  LEU 100          HD13      LEU 100 -11.434  -4.668  13.910
  829   3HD1  LEU 100          HD12      LEU 100 -11.642  -6.104  12.909
  830   1HD2  LEU 100          HD21      LEU 100 -11.811  -2.805  11.013
  831   2HD2  LEU 100          HD23      LEU 100 -12.576  -4.378  10.784
  832   3HD2  LEU 100          HD22      LEU 100 -12.649  -3.582  12.356
  833    H    ASN 101           HN       ASN 101  -9.067  -4.235  14.551
  834    HA   ASN 101           HA       ASN 101  -7.592  -2.276  16.267
  835   1HB   ASN 101           HB2      ASN 101  -8.879  -4.919  16.965
  836   2HB   ASN 101           HB1      ASN 101  -7.637  -4.193  17.984
  837   1HD2  ASN 101          HD22      ASN 101 -11.410  -2.751  18.111
  838   2HD2  ASN 101          HD21      ASN 101 -11.001  -4.110  17.180
  839    H    SER 102           HN       SER 102  -7.226  -5.810  16.100
  840    HA   SER 102           HA       SER 102  -4.352  -5.406  15.541
  841   1HB   SER 102           HB2      SER 102  -5.346  -8.168  15.699
  842   2HB   SER 102           HB1      SER 102  -4.042  -7.393  16.591
  843    HG   SER 102           HG       SER 102  -5.650  -7.823  18.047
  844    H    CYS 103           HN       CYS 103  -3.530  -7.387  13.999
  845    HA   CYS 103           HA       CYS 103  -5.301  -7.951  11.762
  846   1HB   CYS 103           HB2      CYS 103  -3.968  -5.480  11.710
  847   2HB   CYS 103           HB1      CYS 103  -3.020  -6.520  10.652
  848    HA   PRO 104           HA       PRO 104  -1.732 -10.788  12.784
  849   1HB   PRO 104           HB2      PRO 104  -3.630 -12.936  12.541
  850   2HB   PRO 104           HB1      PRO 104  -2.794 -12.381  13.998
  851   1HG   PRO 104           HG2      PRO 104  -5.576 -12.017  13.310
  852   2HG   PRO 104           HG1      PRO 104  -4.739 -11.487  14.775
  853   1HD   PRO 104           HD2      PRO 104  -5.673  -9.850  12.602
  854   2HD   PRO 104           HD1      PRO 104  -4.792  -9.332  14.054
  855    H    VAL 105           HN       VAL 105  -0.983 -10.240  10.605
  856    HA   VAL 105           HA       VAL 105  -2.291 -11.450   8.286
  857    HB   VAL 105           HB       VAL 105   0.476 -10.217   8.503
  858   1HG1  VAL 105          HG12      VAL 105  -0.906 -11.565   6.391
  859   2HG1  VAL 105          HG11      VAL 105  -0.794  -9.857   5.972
  860   3HG1  VAL 105          HG13      VAL 105   0.669 -10.771   6.333
  861   1HG2  VAL 105          HG23      VAL 105  -2.240  -9.068   8.440
  862   2HG2  VAL 105          HG22      VAL 105  -0.719  -8.331   8.948
  863   3HG2  VAL 105          HG21      VAL 105  -1.142  -8.394   7.237
  864    H    LYS 106           HN       LYS 106  -2.280 -13.713   8.847
  865    HA   LYS 106           HA       LYS 106   0.403 -14.979   9.103
  866   1HB   LYS 106           HB2      LYS 106  -1.943 -15.454  10.462
  867   2HB   LYS 106           HB1      LYS 106  -1.971 -16.717   9.231
  868   1HG   LYS 106           HG2      LYS 106   0.223 -17.503   9.903
  869   2HG   LYS 106           HG1      LYS 106   0.407 -16.153  11.024
  870   1HD   LYS 106           HD2      LYS 106  -1.771 -17.041  12.121
  871   2HD   LYS 106           HD1      LYS 106  -1.438 -18.527  11.231
  872   1HE   LYS 106           HE2      LYS 106   0.800 -17.304  12.790
  873   2HE   LYS 106           HE1      LYS 106  -0.466 -18.145  13.685
  874   1HZ   LYS 106           HZ3      LYS 106   0.725 -19.418  11.318
  875   2HZ   LYS 106           HZ2      LYS 106   1.568 -19.450  12.793
  876   3HZ   LYS 106           HZ1      LYS 106   0.018 -20.135  12.682
  877    H    GLU 107           HN       GLU 107  -2.662 -15.821   7.436
  878    HA   GLU 107           HA       GLU 107  -1.526 -17.549   5.519
  879   1HB   GLU 107           HB2      GLU 107  -3.979 -17.242   5.896
  880   2HB   GLU 107           HB1      GLU 107  -3.876 -15.678   5.088
  881   1HG   GLU 107           HG2      GLU 107  -3.555 -16.615   3.005
  882   2HG   GLU 107           HG1      GLU 107  -2.760 -18.049   3.657
  883    H    ALA 108           HN       ALA 108   0.386 -16.788   4.573
  884    HA   ALA 108           HA       ALA 108   0.143 -15.011   2.331
  885   1HB   ALA 108           HB3      ALA 108   1.060 -13.876   4.942
  886   2HB   ALA 108           HB2      ALA 108   1.861 -13.329   3.469
  887   3HB   ALA 108           HB1      ALA 108   0.121 -13.115   3.660
  888    H    ASP 109           HN       ASP 109   1.823 -15.460   0.962
  889    HA   ASP 109           HA       ASP 109   4.120 -16.997   2.094
  890   1HB   ASP 109           HB2      ASP 109   3.818 -16.907  -0.837
  891   2HB   ASP 109           HB1      ASP 109   4.076 -18.293   0.224
  892    H    GLN 110           HN       GLN 110   6.226 -16.606   0.757
  893    HA   GLN 110           HA       GLN 110   6.755 -13.731   0.837
  894   1HB   GLN 110           HB2      GLN 110   8.301 -16.054   1.115
  895   2HB   GLN 110           HB1      GLN 110   8.868 -15.316  -0.383
  896   1HG   GLN 110           HG2      GLN 110  10.160 -14.086   1.051
  897   2HG   GLN 110           HG1      GLN 110   8.696 -13.110   1.176
  898   1HE2  GLN 110          HE22      GLN 110   7.803 -14.949   4.313
  899   2HE2  GLN 110          HE21      GLN 110   7.077 -14.771   2.789
  900    H    SER 111           HN       SER 111   5.444 -12.908  -0.884
  901    HA   SER 111           HA       SER 111   6.018 -13.874  -3.625
  902   1HB   SER 111           HB2      SER 111   4.060 -12.836  -4.261
  903   2HB   SER 111           HB1      SER 111   3.696 -13.072  -2.554
  904    HG   SER 111           HG       SER 111   3.878 -10.991  -2.233
  905    H    THR 112           HN       THR 112   5.728 -11.420  -4.985
  906    HA   THR 112           HA       THR 112   8.198  -9.984  -4.097
  907    HB   THR 112           HB       THR 112   8.727  -9.591  -6.433
  908    HG1  THR 112           HG1      THR 112   6.435 -11.108  -7.090
  909   1HG2  THR 112          HG23      THR 112   8.683 -12.106  -5.203
  910   2HG2  THR 112          HG22      THR 112   8.067 -12.390  -6.830
  911   3HG2  THR 112          HG21      THR 112   9.646 -11.638  -6.605
  912    H    LEU 113           HN       LEU 113   8.215  -7.677  -4.448
  913    HA   LEU 113           HA       LEU 113   5.630  -6.440  -4.022
  914   1HB   LEU 113           HB2      LEU 113   8.031  -5.706  -3.222
  915   2HB   LEU 113           HB1      LEU 113   8.064  -4.854  -4.766
  916    HG   LEU 113           HG       LEU 113   5.661  -4.043  -4.010
  917   1HD1  LEU 113          HD11      LEU 113   6.990  -5.000  -1.486
  918   2HD1  LEU 113          HD13      LEU 113   5.886  -3.625  -1.441
  919   3HD1  LEU 113          HD12      LEU 113   5.315  -5.198  -1.998
  920   1HD2  LEU 113          HD22      LEU 113   8.191  -2.931  -4.056
  921   2HD2  LEU 113          HD21      LEU 113   6.699  -2.043  -3.747
  922   3HD2  LEU 113          HD23      LEU 113   7.671  -2.630  -2.399
  923    H    GLU 114           HN       GLU 114   7.128  -7.449  -6.886
  924    HA   GLU 114           HA       GLU 114   6.325  -5.213  -8.558
  925   1HB   GLU 114           HB2      GLU 114   7.517  -7.897  -8.959
  926   2HB   GLU 114           HB1      GLU 114   6.548  -7.286 -10.302
  927   1HG   GLU 114           HG2      GLU 114   7.863  -5.211 -10.332
  928   2HG   GLU 114           HG1      GLU 114   8.817  -5.783  -8.962
  929    H    ASN 115           HN       ASN 115   5.045  -8.506  -8.048
  930    HA   ASN 115           HA       ASN 115   2.604  -7.852  -9.541
  931   1HB   ASN 115           HB2      ASN 115   3.619 -10.131  -9.601
  932   2HB   ASN 115           HB1      ASN 115   3.254 -10.309  -7.884
  933   1HD2  ASN 115          HD22      ASN 115  -0.035  -9.947 -10.334
  934   2HD2  ASN 115          HD21      ASN 115   1.304  -8.936 -10.592
  935    H    PHE 116           HN       PHE 116   3.660  -7.749  -6.225
  936    HA   PHE 116           HA       PHE 116   0.989  -7.900  -5.071
  937   1HB   PHE 116           HB2      PHE 116   2.705  -8.498  -3.571
  938   2HB   PHE 116           HB1      PHE 116   3.713  -7.128  -4.034
  939    HD1  PHE 116           HD1      PHE 116   0.704  -8.166  -2.134
  940    HD2  PHE 116           HD2      PHE 116   3.371  -4.932  -3.081
  941    HE1  PHE 116           HE1      PHE 116  -0.265  -6.825  -0.290
  942    HE2  PHE 116           HE2      PHE 116   2.401  -3.591  -1.236
  943    HZ   PHE 116           HZ       PHE 116   0.582  -4.537   0.160
  944    H    LEU 117           HN       LEU 117   3.294  -5.243  -5.729
  945    HA   LEU 117           HA       LEU 117   1.424  -3.192  -4.891
  946   1HB   LEU 117           HB2      LEU 117   4.147  -3.287  -5.584
  947   2HB   LEU 117           HB1      LEU 117   3.400  -2.250  -6.799
  948    HG   LEU 117           HG       LEU 117   2.264  -1.021  -4.889
  949   1HD1  LEU 117          HD13      LEU 117   2.665  -2.939  -3.266
  950   2HD1  LEU 117          HD12      LEU 117   4.352  -2.427  -3.206
  951   3HD1  LEU 117          HD11      LEU 117   3.079  -1.338  -2.653
  952   1HD2  LEU 117          HD23      LEU 117   4.736  -0.672  -6.038
  953   2HD2  LEU 117          HD22      LEU 117   3.984   0.472  -4.926
  954   3HD2  LEU 117          HD21      LEU 117   5.144  -0.711  -4.322
  955    H    GLU 118           HN       GLU 118   2.291  -4.678  -7.995
  956    HA   GLU 118           HA       GLU 118   0.841  -2.894  -9.683
  957   1HB   GLU 118           HB2      GLU 118   2.253  -4.397 -10.821
  958   2HB   GLU 118           HB1      GLU 118   1.660  -5.786  -9.910
  959   1HG   GLU 118           HG2      GLU 118  -0.191  -6.042 -11.240
  960   2HG   GLU 118           HG1      GLU 118  -0.349  -4.310 -11.534
  961    NH1  ARG 119           NH2      ARG 119  -5.969  -8.749  -9.817
  962    NH2  ARG 119           NH1      ARG 119  -6.547  -9.284  -7.701
  963    H    ARG 119           HN       ARG 119  -0.156  -5.930  -8.105
  964    HA   ARG 119           HA       ARG 119  -2.872  -5.882  -9.018
  965   1HB   ARG 119           HB2      ARG 119  -1.522  -7.136  -6.618
  966   2HB   ARG 119           HB1      ARG 119  -3.252  -7.315  -6.916
  967   1HG   ARG 119           HG2      ARG 119  -1.241  -7.936  -9.074
  968   2HG   ARG 119           HG1      ARG 119  -1.670  -9.142  -7.859
  969   1HD   ARG 119           HD2      ARG 119  -3.586  -7.729  -9.737
  970   2HD   ARG 119           HD1      ARG 119  -3.103  -9.423  -9.817
  971    HE   ARG 119           HE       ARG 119  -4.140  -9.136  -7.261
  972   1HH1  ARG 119          HH21      ARG 119  -5.278  -8.526 -10.503
  973   2HH1  ARG 119          HH22      ARG 119  -6.933  -8.791 -10.080
  974   1HH2  ARG 119          HH11      ARG 119  -6.294  -9.473  -6.752
  975   2HH2  ARG 119          HH12      ARG 119  -7.507  -9.321  -7.980
  976    H    LEU 120           HN       LEU 120  -1.209  -4.258  -6.376
  977    HA   LEU 120           HA       LEU 120  -3.488  -3.480  -4.856
  978   1HB   LEU 120           HB2      LEU 120  -0.676  -2.696  -5.048
  979   2HB   LEU 120           HB1      LEU 120  -1.728  -1.329  -4.680
  980    HG   LEU 120           HG       LEU 120  -2.481  -3.695  -3.157
  981   1HD1  LEU 120          HD13      LEU 120   0.381  -2.849  -3.221
  982   2HD1  LEU 120          HD12      LEU 120  -0.325  -3.213  -1.647
  983   3HD1  LEU 120          HD11      LEU 120  -0.311  -4.441  -2.913
  984   1HD2  LEU 120          HD22      LEU 120  -2.968  -1.145  -2.859
  985   2HD2  LEU 120          HD21      LEU 120  -2.682  -2.124  -1.422
  986   3HD2  LEU 120          HD23      LEU 120  -1.394  -1.107  -2.067
  987    H    LYS 121           HN       LYS 121  -1.751  -1.653  -7.402
  988    HA   LYS 121           HA       LYS 121  -3.480   0.558  -7.599
  989   1HB   LYS 121           HB2      LYS 121  -1.280   0.047  -8.881
  990   2HB   LYS 121           HB1      LYS 121  -2.322  -0.779 -10.040
  991   1HG   LYS 121           HG2      LYS 121  -3.507   1.751  -9.416
  992   2HG   LYS 121           HG1      LYS 121  -1.814   2.020  -9.833
  993   1HD   LYS 121           HD2      LYS 121  -3.771   0.403 -11.493
  994   2HD   LYS 121           HD1      LYS 121  -3.289   2.064 -11.837
  995   1HE   LYS 121           HE2      LYS 121  -0.974   0.348 -11.415
  996   2HE   LYS 121           HE1      LYS 121  -1.992  -0.249 -12.725
  997   1HZ   LYS 121           HZ2      LYS 121  -2.006   2.195 -13.466
  998   2HZ   LYS 121           HZ1      LYS 121  -0.636   2.356 -12.474
  999   3HZ   LYS 121           HZ3      LYS 121  -0.617   1.265 -13.771
 1000    H    THR 122           HN       THR 122  -3.555  -2.368  -9.551
 1001    HA   THR 122           HA       THR 122  -5.803  -1.993 -11.097
 1002    HB   THR 122           HB       THR 122  -5.949  -4.678 -10.120
 1003    HG1  THR 122           HG1      THR 122  -3.433  -4.593 -10.939
 1004   1HG2  THR 122          HG21      THR 122  -4.742  -3.385 -12.573
 1005   2HG2  THR 122          HG23      THR 122  -4.968  -5.124 -12.391
 1006   3HG2  THR 122          HG22      THR 122  -6.368  -4.051 -12.415
 1007    H    ILE 123           HN       ILE 123  -5.800  -3.123  -7.738
 1008    HA   ILE 123           HA       ILE 123  -8.674  -3.478  -7.644
 1009    HB   ILE 123           HB       ILE 123  -6.632  -3.214  -5.425
 1010   1HG1  ILE 123          HG12      ILE 123  -6.262  -5.160  -6.880
 1011   2HG1  ILE 123          HG11      ILE 123  -6.888  -5.688  -5.319
 1012   1HG2  ILE 123          HG23      ILE 123  -9.541  -4.071  -5.391
 1013   2HG2  ILE 123          HG22      ILE 123  -8.424  -4.307  -4.047
 1014   3HG2  ILE 123          HG21      ILE 123  -8.841  -2.675  -4.571
 1015   1HD1  ILE 123          HD12      ILE 123  -9.200  -5.250  -6.766
 1016   2HD1  ILE 123          HD11      ILE 123  -8.102  -5.892  -7.987
 1017   3HD1  ILE 123          HD13      ILE 123  -8.437  -6.822  -6.526
 1018    H    MET 124           HN       MET 124  -6.522  -0.805  -6.729
 1019    HA   MET 124           HA       MET 124  -8.468   0.716  -5.304
 1020   1HB   MET 124           HB2      MET 124  -6.129   1.752  -6.932
 1021   2HB   MET 124           HB1      MET 124  -7.009   2.654  -5.701
 1022   1HG   MET 124           HG2      MET 124  -5.535   0.062  -5.167
 1023   2HG   MET 124           HG1      MET 124  -4.864   1.662  -4.872
 1024   1HE   MET 124           HE3      MET 124  -4.802   2.702  -3.218
 1025   2HE   MET 124           HE2      MET 124  -6.295   3.420  -2.644
 1026   3HE   MET 124           HE1      MET 124  -5.406   2.307  -1.608
 1027    NH1  ARG 125           NH2      ARG 125  -7.626   6.407 -12.754
 1028    NH2  ARG 125           NH1      ARG 125  -9.534   7.224 -11.860
 1029    H    ARG 125           HN       ARG 125  -7.637   0.677  -8.761
 1030    HA   ARG 125           HA       ARG 125  -9.620   2.760  -9.336
 1031   1HB   ARG 125           HB2      ARG 125  -7.567   2.696 -10.647
 1032   2HB   ARG 125           HB1      ARG 125  -7.917   1.046 -11.161
 1033   1HG   ARG 125           HG2      ARG 125  -9.243   1.781 -12.825
 1034   2HG   ARG 125           HG1      ARG 125 -10.187   2.757 -11.699
 1035   1HD   ARG 125           HD2      ARG 125  -7.530   3.878 -12.248
 1036   2HD   ARG 125           HD1      ARG 125  -8.545   3.759 -13.685
 1037    HE   ARG 125           HE       ARG 125 -10.219   4.870 -11.778
 1038   1HH1  ARG 125          HH21      ARG 125  -7.066   5.641 -13.064
 1039   2HH1  ARG 125          HH22      ARG 125  -7.271   7.339 -12.824
 1040   1HH2  ARG 125          HH11      ARG 125 -10.448   7.079 -11.481
 1041   2HH2  ARG 125          HH12      ARG 125  -9.164   8.150 -11.934
 1042    H    GLU 126           HN       GLU 126  -9.220  -0.579 -10.548
 1043    HA   GLU 126           HA       GLU 126 -11.716  -0.834 -11.775
 1044   1HB   GLU 126           HB2      GLU 126  -9.947  -2.521 -11.977
 1045   2HB   GLU 126           HB1      GLU 126 -10.179  -2.982 -10.290
 1046   1HG   GLU 126           HG2      GLU 126 -11.855  -4.361 -10.874
 1047   2HG   GLU 126           HG1      GLU 126 -12.726  -3.014 -11.607
 1048    H    LYS 127           HN       LYS 127 -10.993  -1.065  -8.316
 1049    HA   LYS 127           HA       LYS 127 -13.721  -2.048  -7.765
 1050   1HB   LYS 127           HB2      LYS 127 -11.731  -2.827  -6.440
 1051   2HB   LYS 127           HB1      LYS 127 -11.600  -1.196  -5.781
 1052   1HG   LYS 127           HG2      LYS 127 -12.879  -2.453  -4.194
 1053   2HG   LYS 127           HG1      LYS 127 -14.022  -1.419  -5.047
 1054   1HD   LYS 127           HD2      LYS 127 -15.198  -3.292  -5.498
 1055   2HD   LYS 127           HD1      LYS 127 -13.910  -3.710  -6.626
 1056   1HE   LYS 127           HE2      LYS 127 -13.355  -5.474  -5.348
 1057   2HE   LYS 127           HE1      LYS 127 -13.037  -4.399  -3.988
 1058   1HZ   LYS 127           HZ1      LYS 127 -15.815  -5.070  -4.649
 1059   2HZ   LYS 127           HZ3      LYS 127 -14.871  -6.221  -3.833
 1060   3HZ   LYS 127           HZ2      LYS 127 -15.124  -4.687  -3.145
 1061    OH   TYR 128           OH       TYR 128 -10.852   0.104  -1.326
 1062    H    TYR 128           HN       TYR 128 -11.826   0.932  -7.175
 1063    HA   TYR 128           HA       TYR 128 -14.253   2.207  -6.084
 1064   1HB   TYR 128           HB2      TYR 128 -11.485   3.361  -6.490
 1065   2HB   TYR 128           HB1      TYR 128 -12.796   4.093  -5.563
 1066    HD1  TYR 128           HD2      TYR 128 -13.956   1.688  -4.243
 1067    HD2  TYR 128           HD1      TYR 128  -9.859   2.849  -4.827
 1068    HE1  TYR 128           HE2      TYR 128 -13.300   0.356  -2.267
 1069    HE2  TYR 128           HE1      TYR 128  -9.209   1.513  -2.841
 1070    HH   TYR 128           HH       TYR 128 -11.531   0.217  -0.658
 1071    H    SER 129           HN       SER 129 -13.855   1.473  -9.054
 1072    HA   SER 129           HA       SER 129 -13.804   4.046 -10.409
 1073   1HB   SER 129           HB2      SER 129 -13.791   1.288 -11.163
 1074   2HB   SER 129           HB1      SER 129 -15.143   2.069 -11.979
 1075    HG   SER 129           HG       SER 129 -12.506   2.275 -12.462
 1076    H    LYS 130           HN       LYS 130 -16.131   2.449  -8.506
 1077    HA   LYS 130           HA       LYS 130 -18.391   3.773  -9.916
 1078   1HB   LYS 130           HB2      LYS 130 -18.715   1.392  -9.466
 1079   2HB   LYS 130           HB1      LYS 130 -18.340   1.641  -7.760
 1080   1HG   LYS 130           HG2      LYS 130 -20.311   3.012  -7.459
 1081   2HG   LYS 130           HG1      LYS 130 -20.641   2.999  -9.191
 1082   1HD   LYS 130           HD2      LYS 130 -22.085   1.328  -8.428
 1083   2HD   LYS 130           HD1      LYS 130 -20.664   0.389  -8.887
 1084   1HE   LYS 130           HE2      LYS 130 -19.872   0.591  -6.493
 1085   2HE   LYS 130           HE1      LYS 130 -21.442   1.290  -6.103
 1086   1HZ   LYS 130           HZ2      LYS 130 -22.396  -0.773  -7.202
 1087   2HZ   LYS 130           HZ1      LYS 130 -20.835  -1.433  -7.078
 1088   3HZ   LYS 130           HZ3      LYS 130 -21.675  -0.976  -5.677
 1089    H    CYS 131           HN       CYS 131 -17.384   3.159  -6.534
 1090    HA   CYS 131           HA       CYS 131 -18.945   5.244  -5.391
 1091   1HB   CYS 131           HB2      CYS 131 -17.920   3.490  -4.012
 1092   2HB   CYS 131           HB1      CYS 131 -16.310   4.079  -4.431
 1093    H    SER 132           HN       SER 132 -15.658   5.255  -6.724
 1094    HA   SER 132           HA       SER 132 -15.617   8.223  -6.358
 1095   1HB   SER 132           HB2      SER 132 -13.555   6.123  -6.132
 1096   2HB   SER 132           HB1      SER 132 -13.048   7.548  -7.035
 1097    HG   SER 132           HG       SER 132 -14.439   7.848  -4.614
 1098    H    SER 133           HN       SER 133 -14.144   9.243  -8.189
 1099    HA   SER 133           HA       SER 133 -14.890   7.971 -10.792
 1100   1HB   SER 133           HB2      SER 133 -14.658  10.911 -10.774
 1101   2HB   SER 133           HB1      SER 133 -15.863   9.883 -11.544
 1102    HG   SER 133           HG       SER 133 -17.091  10.067  -9.840
   
  Start of MODEL           9
 Raw file had 1102 H/Q atoms
  Start of MODEL    9
    1   1H    GLU   1           HT2      GLU   1 -25.433  23.569   0.220
    2   2H    GLU   1           HT1      GLU   1 -25.829  23.492  -1.430
    3   3H    GLU   1           HT3      GLU   1 -26.202  22.190  -0.409
    4    HA   GLU   1           HA       GLU   1 -24.319  21.429  -1.470
    5   1HB   GLU   1           HB2      GLU   1 -22.294  23.042  -1.633
    6   2HB   GLU   1           HB1      GLU   1 -23.647  23.309  -2.733
    7   1HG   GLU   1           HG2      GLU   1 -24.404  25.181  -1.566
    8   2HG   GLU   1           HG1      GLU   1 -23.631  24.680  -0.062
    9    H    ALA   2           HN       ALA   2 -25.054  21.004   1.095
   10    HA   ALA   2           HA       ALA   2 -22.451  21.135   2.549
   11   1HB   ALA   2           HB1      ALA   2 -24.830  22.498   3.274
   12   2HB   ALA   2           HB3      ALA   2 -24.654  21.156   4.404
   13   3HB   ALA   2           HB2      ALA   2 -23.354  22.335   4.225
   14    H    GLU   3           HN       GLU   3 -23.589  18.975   0.976
   15    HA   GLU   3           HA       GLU   3 -24.557  17.041   3.003
   16   1HB   GLU   3           HB2      GLU   3 -24.486  17.162   0.022
   17   2HB   GLU   3           HB1      GLU   3 -24.426  15.564   0.768
   18   1HG   GLU   3           HG2      GLU   3 -26.597  15.665   1.394
   19   2HG   GLU   3           HG1      GLU   3 -26.421  17.309   2.010
   20    H    ALA   4           HN       ALA   4 -23.479  14.680   2.291
   21    HA   ALA   4           HA       ALA   4 -20.576  14.905   1.911
   22   1HB   ALA   4           HB1      ALA   4 -21.427  15.227   4.481
   23   2HB   ALA   4           HB3      ALA   4 -21.251  13.473   4.417
   24   3HB   ALA   4           HB2      ALA   4 -19.874  14.512   4.050
   25    H    HIS   5           HN       HIS   5 -19.582  12.746   1.698
   26    HA   HIS   5           HA       HIS   5 -21.582  10.556   1.328
   27   1HB   HIS   5           HB2      HIS   5 -19.777  11.787  -0.638
   28   2HB   HIS   5           HB1      HIS   5 -19.618  10.034  -0.552
   29    HD1  HIS   5           HD1      HIS   5 -20.761  10.177  -3.023
   30    HD2  HIS   5           HD2      HIS   5 -23.219  11.151   0.200
   31    HE1  HIS   5           HE1      HIS   5 -23.142  10.063  -3.878
   32    H    LYS   6           HN       LYS   6 -19.983   8.464   0.764
   33    HA   LYS   6           HA       LYS   6 -17.763   8.488   2.742
   34   1HB   LYS   6           HB2      LYS   6 -18.573   6.304   3.645
   35   2HB   LYS   6           HB1      LYS   6 -19.670   7.643   3.986
   36   1HG   LYS   6           HG2      LYS   6 -20.234   6.353   1.421
   37   2HG   LYS   6           HG1      LYS   6 -20.382   5.244   2.785
   38   1HD   LYS   6           HD2      LYS   6 -22.207   6.316   3.621
   39   2HD   LYS   6           HD1      LYS   6 -21.563   7.913   3.238
   40   1HE   LYS   6           HE2      LYS   6 -23.492   7.584   1.838
   41   2HE   LYS   6           HE1      LYS   6 -22.071   7.425   0.804
   42   1HZ   LYS   6           HZ2      LYS   6 -23.569   5.175   2.036
   43   2HZ   LYS   6           HZ1      LYS   6 -23.669   5.652   0.409
   44   3HZ   LYS   6           HZ3      LYS   6 -22.215   5.031   1.020
   45    H    CYS   7           HN       CYS   7 -17.098   8.593   0.226
   46    HA   CYS   7           HA       CYS   7 -15.690   6.168  -0.316
   47   1HB   CYS   7           HB2      CYS   7 -17.648   5.086  -1.043
   48   2HB   CYS   7           HB1      CYS   7 -18.308   6.558  -1.756
   49    H    ASP   8           HN       ASP   8 -17.162   9.083  -1.692
   50    HA   ASP   8           HA       ASP   8 -15.106   9.302  -3.764
   51   1HB   ASP   8           HB2      ASP   8 -17.675  10.429  -3.269
   52   2HB   ASP   8           HB1      ASP   8 -16.524  11.762  -3.371
   53    H    ILE   9           HN       ILE   9 -15.388  10.290  -0.456
   54    HA   ILE   9           HA       ILE   9 -13.441  12.478  -0.835
   55    HB   ILE   9           HB       ILE   9 -14.664  11.465   1.743
   56   1HG1  ILE   9          HG12      ILE   9 -15.634  13.376  -0.366
   57   2HG1  ILE   9          HG11      ILE   9 -16.542  12.163   0.536
   58   1HG2  ILE   9          HG23      ILE   9 -12.549  12.912   1.768
   59   2HG2  ILE   9          HG22      ILE   9 -13.545  14.196   1.083
   60   3HG2  ILE   9          HG21      ILE   9 -13.928  13.536   2.673
   61   1HD1  ILE   9          HD12      ILE   9 -16.018  13.583   2.622
   62   2HD1  ILE   9          HD11      ILE   9 -15.568  14.855   1.487
   63   3HD1  ILE   9          HD13      ILE   9 -17.213  14.221   1.492
   64    H    THR  10           HN       THR  10 -13.569   9.829   1.567
   65    HA   THR  10           HA       THR  10 -10.692   9.883   1.885
   66    HB   THR  10           HB       THR  10 -12.532   7.684   2.818
   67    HG1  THR  10           HG1      THR  10 -13.253   8.978   4.355
   68   1HG2  THR  10          HG22      THR  10  -9.886   7.824   3.044
   69   2HG2  THR  10          HG21      THR  10 -10.295   8.878   4.396
   70   3HG2  THR  10          HG23      THR  10 -10.883   7.215   4.364
   71    H    LEU  11           HN       LEU  11 -12.917   7.716   0.130
   72    HA   LEU  11           HA       LEU  11 -10.799   5.810  -0.434
   73   1HB   LEU  11           HB2      LEU  11 -13.578   5.783  -0.636
   74   2HB   LEU  11           HB1      LEU  11 -13.024   5.709  -2.310
   75    HG   LEU  11           HG       LEU  11 -11.502   3.839  -1.708
   76   1HD1  LEU  11          HD12      LEU  11 -12.306   4.653   0.971
   77   2HD1  LEU  11          HD11      LEU  11 -12.551   2.925   0.717
   78   3HD1  LEU  11          HD13      LEU  11 -10.956   3.636   0.471
   79   1HD2  LEU  11          HD21      LEU  11 -14.448   3.551  -1.077
   80   2HD2  LEU  11          HD23      LEU  11 -13.616   3.159  -2.584
   81   3HD2  LEU  11          HD22      LEU  11 -13.358   2.165  -1.150
   82    H    GLN  12           HN       GLN  12 -12.102   8.626  -2.141
   83    HA   GLN  12           HA       GLN  12 -10.695   7.994  -4.605
   84   1HB   GLN  12           HB2      GLN  12 -11.847   9.742  -5.448
   85   2HB   GLN  12           HB1      GLN  12 -12.661   9.817  -3.891
   86   1HG   GLN  12           HG2      GLN  12 -10.943  11.404  -3.071
   87   2HG   GLN  12           HG1      GLN  12 -10.139  11.338  -4.642
   88   1HE2  GLN  12          HE22      GLN  12 -13.086  12.928  -6.244
   89   2HE2  GLN  12          HE21      GLN  12 -12.211  11.489  -6.453
   90    H    GLU  13           HN       GLU  13 -10.016  10.045  -1.780
   91    HA   GLU  13           HA       GLU  13  -7.542  11.098  -2.821
   92   1HB   GLU  13           HB2      GLU  13  -8.912  11.005  -0.189
   93   2HB   GLU  13           HB1      GLU  13  -7.156  11.170  -0.132
   94   1HG   GLU  13           HG2      GLU  13  -8.469  12.884  -2.140
   95   2HG   GLU  13           HG1      GLU  13  -8.894  13.266  -0.472
   96    H    ILE  14           HN       ILE  14  -8.426   8.177  -1.072
   97    HA   ILE  14           HA       ILE  14  -5.717   7.335  -0.497
   98    HB   ILE  14           HB       ILE  14  -8.427   6.289  -0.174
   99   1HG1  ILE  14          HG12      ILE  14  -6.059   5.237   1.307
  100   2HG1  ILE  14          HG11      ILE  14  -6.424   6.955   1.474
  101   1HG2  ILE  14          HG22      ILE  14  -6.206   4.381  -0.967
  102   2HG2  ILE  14          HG21      ILE  14  -7.682   3.881  -0.146
  103   3HG2  ILE  14          HG23      ILE  14  -7.770   4.584  -1.760
  104   1HD1  ILE  14          HD12      ILE  14  -8.674   4.996   1.724
  105   2HD1  ILE  14          HD11      ILE  14  -7.558   5.168   3.079
  106   3HD1  ILE  14          HD13      ILE  14  -8.463   6.565   2.499
  107    H    ILE  15           HN       ILE  15  -7.889   7.009  -3.239
  108    HA   ILE  15           HA       ILE  15  -6.430   4.911  -4.578
  109    HB   ILE  15           HB       ILE  15  -8.410   7.001  -5.499
  110   1HG1  ILE  15          HG12      ILE  15  -8.717   4.023  -5.707
  111   2HG1  ILE  15          HG11      ILE  15  -8.900   4.787  -4.127
  112   1HG2  ILE  15          HG23      ILE  15  -6.665   5.175  -7.092
  113   2HG2  ILE  15          HG22      ILE  15  -8.347   5.338  -7.595
  114   3HG2  ILE  15          HG21      ILE  15  -7.311   6.763  -7.512
  115   1HD1  ILE  15          HD11      ILE  15 -10.360   6.443  -5.813
  116   2HD1  ILE  15          HD13      ILE  15 -10.707   4.827  -6.425
  117   3HD1  ILE  15          HD12      ILE  15 -11.032   5.218  -4.737
  118    H    LYS  16           HN       LYS  16  -6.360   8.465  -4.797
  119    HA   LYS  16           HA       LYS  16  -4.453   8.629  -6.912
  120   1HB   LYS  16           HB2      LYS  16  -5.715  10.434  -5.033
  121   2HB   LYS  16           HB1      LYS  16  -4.005  10.829  -5.213
  122   1HG   LYS  16           HG2      LYS  16  -4.256  11.501  -7.372
  123   2HG   LYS  16           HG1      LYS  16  -5.389  10.200  -7.743
  124   1HD   LYS  16           HD2      LYS  16  -6.344  12.329  -5.891
  125   2HD   LYS  16           HD1      LYS  16  -6.167  12.766  -7.591
  126   1HE   LYS  16           HE2      LYS  16  -7.404  10.371  -7.857
  127   2HE   LYS  16           HE1      LYS  16  -8.074  10.888  -6.310
  128   1HZ   LYS  16           HZ2      LYS  16  -8.130  13.117  -7.917
  129   2HZ   LYS  16           HZ1      LYS  16  -8.646  11.848  -8.922
  130   3HZ   LYS  16           HZ3      LYS  16  -9.457  12.158  -7.465
  131    H    THR  17           HN       THR  17  -4.016   8.629  -3.376
  132    HA   THR  17           HA       THR  17  -1.190   8.920  -3.368
  133    HB   THR  17           HB       THR  17  -2.619   7.184  -1.364
  134    HG1  THR  17           HG1      THR  17  -3.692   8.850  -0.617
  135   1HG2  THR  17          HG22      THR  17  -0.190   7.573  -1.141
  136   2HG2  THR  17          HG21      THR  17  -0.472   9.314  -1.144
  137   3HG2  THR  17          HG23      THR  17  -1.082   8.324   0.182
  138    H    LEU  18           HN       LEU  18  -3.207   5.991  -3.569
  139    HA   LEU  18           HA       LEU  18  -1.107   4.092  -3.426
  140   1HB   LEU  18           HB2      LEU  18  -3.573   3.602  -3.362
  141   2HB   LEU  18           HB1      LEU  18  -3.600   3.816  -5.112
  142    HG   LEU  18           HG       LEU  18  -1.413   2.085  -4.390
  143   1HD1  LEU  18          HD11      LEU  18  -3.370   1.802  -2.517
  144   2HD1  LEU  18          HD13      LEU  18  -3.911   0.654  -3.741
  145   3HD1  LEU  18          HD12      LEU  18  -2.304   0.496  -3.033
  146   1HD2  LEU  18          HD23      LEU  18  -3.309   2.373  -6.421
  147   2HD2  LEU  18          HD22      LEU  18  -2.068   1.124  -6.320
  148   3HD2  LEU  18          HD21      LEU  18  -3.684   0.812  -5.690
  149    H    ASN  19           HN       ASN  19  -2.373   5.962  -6.153
  150    HA   ASN  19           HA       ASN  19  -0.791   4.591  -8.158
  151   1HB   ASN  19           HB2      ASN  19  -2.897   6.014  -8.535
  152   2HB   ASN  19           HB1      ASN  19  -1.842   7.418  -8.370
  153   1HD2  ASN  19          HD22      ASN  19  -1.478   7.031 -11.906
  154   2HD2  ASN  19          HD21      ASN  19  -2.280   7.908 -10.694
  155    H    SER  20           HN       SER  20  -0.209   7.259  -5.959
  156    HA   SER  20           HA       SER  20   2.047   8.383  -7.340
  157   1HB   SER  20           HB2      SER  20   1.117   8.444  -4.472
  158   2HB   SER  20           HB1      SER  20   2.638   9.191  -4.952
  159    HG   SER  20           HG       SER  20   0.383  10.341  -5.055
  160    H    LEU  21           HN       LEU  21   1.776   5.875  -4.816
  161    HA   LEU  21           HA       LEU  21   4.626   5.485  -4.574
  162   1HB   LEU  21           HB2      LEU  21   2.235   3.790  -3.839
  163   2HB   LEU  21           HB1      LEU  21   3.889   3.233  -3.577
  164    HG   LEU  21           HG       LEU  21   2.983   5.931  -2.575
  165   1HD1  LEU  21          HD11      LEU  21   2.419   3.208  -1.476
  166   2HD1  LEU  21          HD13      LEU  21   2.867   4.477  -0.337
  167   3HD1  LEU  21          HD12      LEU  21   1.454   4.681  -1.372
  168   1HD2  LEU  21          HD22      LEU  21   5.448   4.922  -2.738
  169   2HD2  LEU  21          HD21      LEU  21   4.947   5.885  -1.346
  170   3HD2  LEU  21          HD23      LEU  21   4.962   4.124  -1.241
  171    H    THR  22           HN       THR  22   2.472   4.658  -7.103
  172    HA   THR  22           HA       THR  22   3.948   2.242  -7.897
  173    HB   THR  22           HB       THR  22   1.374   2.998  -8.288
  174    HG1  THR  22           HG1      THR  22   3.108   1.292  -9.688
  175   1HG2  THR  22          HG22      THR  22   2.284   4.800  -9.881
  176   2HG2  THR  22          HG21      THR  22   2.672   3.471 -10.973
  177   3HG2  THR  22          HG23      THR  22   0.998   3.765 -10.502
  178    H    GLU  23           HN       GLU  23   4.384   5.601  -8.329
  179    HA   GLU  23           HA       GLU  23   5.271   5.812 -10.991
  180   1HB   GLU  23           HB2      GLU  23   6.119   7.854 -10.373
  181   2HB   GLU  23           HB1      GLU  23   5.153   7.544  -8.931
  182   1HG   GLU  23           HG2      GLU  23   7.205   6.444  -7.921
  183   2HG   GLU  23           HG1      GLU  23   8.121   7.074  -9.291
  184    H    GLN  24           HN       GLN  24   6.892   4.423  -8.188
  185    HA   GLN  24           HA       GLN  24   9.073   3.524 -10.026
  186   1HB   GLN  24           HB2      GLN  24   9.547   5.346  -8.125
  187   2HB   GLN  24           HB1      GLN  24   9.665   3.899  -7.127
  188   1HG   GLN  24           HG2      GLN  24  11.826   3.876  -7.861
  189   2HG   GLN  24           HG1      GLN  24  11.119   3.123  -9.291
  190   1HE2  GLN  24          HE22      GLN  24  12.038   7.135  -9.512
  191   2HE2  GLN  24          HE21      GLN  24  11.576   6.480  -8.017
  192    H    LYS  25           HN       LYS  25   7.523   1.652 -10.152
  193    HA   LYS  25           HA       LYS  25   7.726  -0.109  -7.747
  194   1HB   LYS  25           HB2      LYS  25   5.822  -1.366  -8.789
  195   2HB   LYS  25           HB1      LYS  25   5.417   0.303  -8.390
  196   1HG   LYS  25           HG2      LYS  25   5.383   0.973 -10.610
  197   2HG   LYS  25           HG1      LYS  25   6.507  -0.289 -11.116
  198   1HD   LYS  25           HD2      LYS  25   3.868  -1.158 -10.026
  199   2HD   LYS  25           HD1      LYS  25   3.889  -0.453 -11.643
  200   1HE   LYS  25           HE2      LYS  25   5.480  -2.090 -12.418
  201   2HE   LYS  25           HE1      LYS  25   5.730  -2.698 -10.781
  202   1HZ   LYS  25           HZ2      LYS  25   3.003  -2.801 -11.267
  203   2HZ   LYS  25           HZ1      LYS  25   3.753  -3.433 -12.655
  204   3HZ   LYS  25           HZ3      LYS  25   4.079  -4.108 -11.133
  205    H    THR  26           HN       THR  26  10.036  -0.084  -9.118
  206    HA   THR  26           HA       THR  26  10.018  -2.741 -10.434
  207    HB   THR  26           HB       THR  26  10.215  -1.752 -12.468
  208    HG1  THR  26           HG1      THR  26  12.257  -1.813 -12.912
  209   1HG2  THR  26          HG22      THR  26  10.881   0.742 -10.897
  210   2HG2  THR  26          HG21      THR  26  10.926   0.703 -12.660
  211   3HG2  THR  26          HG23      THR  26   9.413   0.389 -11.809
  212    H    LEU  27           HN       LEU  27  12.072  -0.027  -9.346
  213    HA   LEU  27           HA       LEU  27  14.297  -1.868  -8.799
  214   1HB   LEU  27           HB2      LEU  27  14.315   0.705  -9.510
  215   2HB   LEU  27           HB1      LEU  27  14.255   0.938  -7.762
  216    HG   LEU  27           HG       LEU  27  16.187  -0.810  -7.698
  217   1HD1  LEU  27          HD11      LEU  27  15.730  -1.090 -10.315
  218   2HD1  LEU  27          HD13      LEU  27  16.861   0.261 -10.407
  219   3HD1  LEU  27          HD12      LEU  27  17.354  -1.250  -9.646
  220   1HD2  LEU  27          HD21      LEU  27  16.093   1.952  -7.697
  221   2HD2  LEU  27          HD23      LEU  27  17.524   0.988  -7.327
  222   3HD2  LEU  27          HD22      LEU  27  17.278   1.613  -8.958
  223    H    CYS  28           HN       CYS  28  12.122   0.200  -6.866
  224    HA   CYS  28           HA       CYS  28  13.106  -0.932  -4.362
  225   1HB   CYS  28           HB2      CYS  28  11.634   1.336  -5.065
  226   2HB   CYS  28           HB1      CYS  28  10.488   0.328  -4.179
  227    H    THR  29           HN       THR  29  10.958  -2.062  -6.751
  228    HA   THR  29           HA       THR  29   9.294  -3.582  -4.850
  229    HB   THR  29           HB       THR  29   8.283  -4.513  -6.964
  230    HG1  THR  29           HG1      THR  29  10.184  -4.158  -8.229
  231   1HG2  THR  29          HG23      THR  29   8.429  -1.527  -6.533
  232   2HG2  THR  29          HG22      THR  29   7.315  -2.273  -7.678
  233   3HG2  THR  29          HG21      THR  29   7.191  -2.642  -5.958
  234    H    GLU  30           HN       GLU  30  12.392  -3.956  -5.652
  235    HA   GLU  30           HA       GLU  30  12.287  -6.798  -6.429
  236   1HB   GLU  30           HB2      GLU  30  14.278  -4.640  -6.474
  237   2HB   GLU  30           HB1      GLU  30  14.941  -6.177  -5.919
  238   1HG   GLU  30           HG2      GLU  30  13.149  -6.225  -8.304
  239   2HG   GLU  30           HG1      GLU  30  14.781  -5.589  -8.517
  240    H    LEU  31           HN       LEU  31  11.053  -6.555  -4.049
  241    HA   LEU  31           HA       LEU  31  12.836  -8.024  -2.247
  242   1HB   LEU  31           HB2      LEU  31  12.063  -6.554  -0.290
  243   2HB   LEU  31           HB1      LEU  31  13.294  -5.868  -1.345
  244    HG   LEU  31           HG       LEU  31  10.851  -5.119  -2.519
  245   1HD1  LEU  31          HD13      LEU  31  10.694  -5.294   0.450
  246   2HD1  LEU  31          HD12      LEU  31  10.081  -3.819  -0.294
  247   3HD1  LEU  31          HD11      LEU  31   9.404  -5.381  -0.750
  248   1HD2  LEU  31          HD21      LEU  31  12.927  -3.742  -0.818
  249   2HD2  LEU  31          HD23      LEU  31  12.697  -3.644  -2.564
  250   3HD2  LEU  31          HD22      LEU  31  11.554  -2.852  -1.479
  251    H    THR  32           HN       THR  32  11.527  -9.774  -2.417
  252    HA   THR  32           HA       THR  32   8.823 -10.072  -2.714
  253    HB   THR  32           HB       THR  32   9.030 -12.198  -1.408
  254    HG1  THR  32           HG1      THR  32  10.556 -12.330   0.000
  255   1HG2  THR  32          HG23      THR  32   9.818 -11.869  -3.812
  256   2HG2  THR  32          HG22      THR  32  11.448 -11.721  -3.156
  257   3HG2  THR  32          HG21      THR  32  10.545 -13.221  -2.945
  258    H    VAL  33           HN       VAL  33   7.097 -10.647  -1.173
  259    HA   VAL  33           HA       VAL  33   7.293  -9.658   1.589
  260    HB   VAL  33           HB       VAL  33   5.329  -8.095   1.232
  261   1HG1  VAL  33          HG11      VAL  33   7.778  -7.390   1.386
  262   2HG1  VAL  33          HG13      VAL  33   7.765  -7.288  -0.375
  263   3HG1  VAL  33          HG12      VAL  33   6.703  -6.248   0.577
  264   1HG2  VAL  33          HG22      VAL  33   4.959  -9.238  -1.116
  265   2HG2  VAL  33          HG21      VAL  33   4.607  -7.521  -0.910
  266   3HG2  VAL  33          HG23      VAL  33   6.120  -8.029  -1.664
  267    H    THR  34           HN       THR  34   4.683  -9.657   2.308
  268    HA   THR  34           HA       THR  34   3.939 -12.455   1.875
  269    HB   THR  34           HB       THR  34   3.335 -10.381   3.806
  270    HG1  THR  34           HG1      THR  34   4.092 -12.676   3.963
  271   1HG2  THR  34          HG21      THR  34   0.976 -11.929   2.687
  272   2HG2  THR  34          HG23      THR  34   0.958 -11.012   4.192
  273   3HG2  THR  34          HG22      THR  34   1.183 -10.176   2.660
  274    H    ASP  35           HN       ASP  35   1.946 -13.143   0.918
  275    HA   ASP  35           HA       ASP  35   0.901 -11.205  -1.088
  276   1HB   ASP  35           HB2      ASP  35   1.814 -13.656  -1.590
  277   2HB   ASP  35           HB1      ASP  35   0.175 -14.107  -1.129
  278    H    ILE  36           HN       ILE  36  -0.550 -10.102   0.324
  279    HA   ILE  36           HA       ILE  36  -2.452 -11.472   1.995
  280    HB   ILE  36           HB       ILE  36  -3.422  -9.331   2.367
  281   1HG1  ILE  36          HG12      ILE  36  -2.155  -8.567  -0.280
  282   2HG1  ILE  36          HG11      ILE  36  -3.879  -8.645   0.092
  283   1HG2  ILE  36          HG21      ILE  36  -0.793  -9.745   2.754
  284   2HG2  ILE  36          HG23      ILE  36  -0.697  -8.367   1.657
  285   3HG2  ILE  36          HG22      ILE  36  -1.580  -8.224   3.176
  286   1HD1  ILE  36          HD11      ILE  36  -3.499  -6.867   1.839
  287   2HD1  ILE  36          HD13      ILE  36  -1.851  -6.706   1.235
  288   3HD1  ILE  36          HD12      ILE  36  -3.216  -6.321   0.187
  289    H    PHE  37           HN       PHE  37  -2.318 -11.138  -1.412
  290    HA   PHE  37           HA       PHE  37  -5.263 -11.282  -1.713
  291   1HB   PHE  37           HB2      PHE  37  -3.077 -11.188  -3.813
  292   2HB   PHE  37           HB1      PHE  37  -4.810 -11.070  -4.119
  293    HD1  PHE  37           HD2      PHE  37  -6.074  -9.213  -2.724
  294    HD2  PHE  37           HD1      PHE  37  -1.855  -9.225  -3.524
  295    HE1  PHE  37           HE2      PHE  37  -5.985  -6.773  -2.291
  296    HE2  PHE  37           HE1      PHE  37  -1.765  -6.784  -3.091
  297    HZ   PHE  37           HZ       PHE  37  -3.831  -5.560  -2.474
  298    H    ALA  38           HN       ALA  38  -3.758 -13.515  -0.504
  299    HA   ALA  38           HA       ALA  38  -4.340 -15.592  -2.577
  300   1HB   ALA  38           HB3      ALA  38  -1.872 -15.171  -1.702
  301   2HB   ALA  38           HB2      ALA  38  -2.430 -16.134  -0.335
  302   3HB   ALA  38           HB1      ALA  38  -2.465 -16.812  -1.962
  303    H    ALA  39           HN       ALA  39  -5.914 -14.324  -0.187
  304    HA   ALA  39           HA       ALA  39  -7.174 -16.813   0.630
  305   1HB   ALA  39           HB3      ALA  39  -5.256 -15.413   2.440
  306   2HB   ALA  39           HB2      ALA  39  -6.742 -16.037   3.155
  307   3HB   ALA  39           HB1      ALA  39  -5.639 -17.131   2.322
  308    H    SER  40           HN       SER  40  -9.186 -16.403   1.749
  309    HA   SER  40           HA       SER  40 -10.017 -13.846   2.693
  310   1HB   SER  40           HB2      SER  40 -10.214 -14.284  -0.217
  311   2HB   SER  40           HB1      SER  40 -11.712 -13.745   0.540
  312    HG   SER  40           HG       SER  40  -9.680 -12.267  -0.118
  313    H    LYS  41           HN       LYS  41 -12.385 -13.841   3.184
  314    HA   LYS  41           HA       LYS  41 -13.703 -16.485   2.860
  315   1HB   LYS  41           HB2      LYS  41 -12.403 -16.262   5.103
  316   2HB   LYS  41           HB1      LYS  41 -13.697 -15.155   5.563
  317   1HG   LYS  41           HG2      LYS  41 -15.194 -16.838   5.823
  318   2HG   LYS  41           HG1      LYS  41 -14.685 -17.630   4.333
  319   1HD   LYS  41           HD2      LYS  41 -12.570 -17.854   6.265
  320   2HD   LYS  41           HD1      LYS  41 -14.077 -18.396   7.002
  321   1HE   LYS  41           HE2      LYS  41 -13.094 -19.330   4.293
  322   2HE   LYS  41           HE1      LYS  41 -12.835 -20.218   5.794
  323   1HZ   LYS  41           HZ1      LYS  41 -15.456 -19.744   5.917
  324   2HZ   LYS  41           HZ3      LYS  41 -15.256 -19.875   4.238
  325   3HZ   LYS  41           HZ2      LYS  41 -14.784 -21.156   5.251
  326    H    ASP  42           HN       ASP  42 -14.086 -13.194   4.241
  327    HA   ASP  42           HA       ASP  42 -16.674 -12.999   2.815
  328   1HB   ASP  42           HB2      ASP  42 -16.518 -13.611   5.586
  329   2HB   ASP  42           HB1      ASP  42 -17.057 -11.937   5.455
  330    H    THR  43           HN       THR  43 -13.910 -11.663   2.849
  331    HA   THR  43           HA       THR  43 -14.988  -8.899   2.848
  332    HB   THR  43           HB       THR  43 -13.953  -8.994   5.012
  333    HG1  THR  43           HG1      THR  43 -13.430  -7.138   3.973
  334   1HG2  THR  43          HG23      THR  43 -12.544 -11.079   4.303
  335   2HG2  THR  43          HG22      THR  43 -11.347  -9.888   3.796
  336   3HG2  THR  43          HG21      THR  43 -11.858  -9.963   5.481
  337    H    THR  44           HN       THR  44 -13.480  -7.398   1.697
  338    HA   THR  44           HA       THR  44 -11.333  -8.546   0.108
  339    HB   THR  44           HB       THR  44 -13.409  -7.506  -1.719
  340    HG1  THR  44           HG1      THR  44 -14.883  -8.817  -1.042
  341   1HG2  THR  44          HG23      THR  44 -11.168  -8.457  -2.353
  342   2HG2  THR  44          HG22      THR  44 -11.731 -10.025  -1.775
  343   3HG2  THR  44          HG21      THR  44 -12.533  -9.249  -3.142
  344    H    GLU  45           HN       GLU  45 -11.673  -6.225   1.849
  345    HA   GLU  45           HA       GLU  45 -10.311  -4.303   0.249
  346   1HB   GLU  45           HB2      GLU  45 -11.964  -3.176  -0.759
  347   2HB   GLU  45           HB1      GLU  45 -13.166  -4.208   0.004
  348   1HG   GLU  45           HG2      GLU  45 -13.295  -2.747   1.930
  349   2HG   GLU  45           HG1      GLU  45 -11.922  -1.797   1.359
  350    H    LYS  46           HN       LYS  46 -12.637  -4.303   3.007
  351    HA   LYS  46           HA       LYS  46 -11.041  -2.362   4.442
  352   1HB   LYS  46           HB2      LYS  46 -12.589  -2.607   6.206
  353   2HB   LYS  46           HB1      LYS  46 -13.547  -2.902   4.755
  354   1HG   LYS  46           HG2      LYS  46 -13.057  -5.380   5.084
  355   2HG   LYS  46           HG1      LYS  46 -12.416  -4.955   6.670
  356   1HD   LYS  46           HD2      LYS  46 -14.994  -3.696   6.218
  357   2HD   LYS  46           HD1      LYS  46 -15.101  -5.447   6.032
  358   1HE   LYS  46           HE2      LYS  46 -13.731  -5.548   8.235
  359   2HE   LYS  46           HE1      LYS  46 -14.218  -3.865   8.439
  360   1HZ   LYS  46           HZ2      LYS  46 -16.319  -5.734   7.703
  361   2HZ   LYS  46           HZ1      LYS  46 -15.683  -5.911   9.269
  362   3HZ   LYS  46           HZ3      LYS  46 -16.355  -4.429   8.790
  363    H    GLU  47           HN       GLU  47 -11.255  -5.900   4.440
  364    HA   GLU  47           HA       GLU  47  -9.365  -6.149   6.648
  365   1HB   GLU  47           HB2      GLU  47 -10.701  -8.047   4.752
  366   2HB   GLU  47           HB1      GLU  47  -9.267  -8.588   5.624
  367   1HG   GLU  47           HG2      GLU  47 -10.925  -7.216   7.489
  368   2HG   GLU  47           HG1      GLU  47 -11.949  -8.348   6.609
  369    H    THR  48           HN       THR  48  -9.229  -5.945   3.150
  370    HA   THR  48           HA       THR  48  -6.500  -6.874   2.907
  371    HB   THR  48           HB       THR  48  -7.991  -5.021   1.030
  372    HG1  THR  48           HG1      THR  48  -8.537  -7.057   0.011
  373   1HG2  THR  48          HG21      THR  48  -5.381  -6.130   1.018
  374   2HG2  THR  48          HG23      THR  48  -6.312  -7.005  -0.197
  375   3HG2  THR  48          HG22      THR  48  -6.182  -5.248  -0.282
  376    H    PHE  49           HN       PHE  49  -7.972  -3.822   3.793
  377    HA   PHE  49           HA       PHE  49  -5.524  -2.287   3.272
  378   1HB   PHE  49           HB2      PHE  49  -8.033  -1.531   4.783
  379   2HB   PHE  49           HB1      PHE  49  -6.726  -0.428   4.397
  380    HD1  PHE  49           HD2      PHE  49  -6.135  -1.516   1.587
  381    HD2  PHE  49           HD1      PHE  49  -9.796  -0.523   3.596
  382    HE1  PHE  49           HE2      PHE  49  -7.218  -1.101  -0.601
  383    HE2  PHE  49           HE1      PHE  49 -10.884  -0.110   1.405
  384    HZ   PHE  49           HZ       PHE  49  -9.596  -0.405  -0.691
  385    H    CYS  50           HN       CYS  50  -7.132  -3.753   6.085
  386    HA   CYS  50           HA       CYS  50  -5.301  -2.528   7.984
  387   1HB   CYS  50           HB2      CYS  50  -6.265  -4.076   9.609
  388   2HB   CYS  50           HB1      CYS  50  -7.551  -3.391   8.636
  389    NH1  ARG  51           NH2      ARG  51  -7.721 -10.737   4.611
  390    NH2  ARG  51           NH1      ARG  51  -6.514 -10.552   2.712
  391    H    ARG  51           HN       ARG  51  -5.428  -5.618   6.232
  392    HA   ARG  51           HA       ARG  51  -3.145  -6.831   7.507
  393   1HB   ARG  51           HB2      ARG  51  -4.768  -7.309   5.035
  394   2HB   ARG  51           HB1      ARG  51  -3.165  -8.038   5.107
  395   1HG   ARG  51           HG2      ARG  51  -3.824  -9.580   6.622
  396   2HG   ARG  51           HG1      ARG  51  -4.669  -8.379   7.599
  397   1HD   ARG  51           HD2      ARG  51  -6.160 -10.166   6.593
  398   2HD   ARG  51           HD1      ARG  51  -6.628  -8.517   6.200
  399    HE   ARG  51           HE       ARG  51  -4.963  -9.268   4.107
  400   1HH1  ARG  51          HH21      ARG  51  -7.853 -10.549   5.582
  401   2HH1  ARG  51          HH22      ARG  51  -8.403 -11.272   4.114
  402   1HH2  ARG  51          HH11      ARG  51  -5.711 -10.213   2.223
  403   2HH2  ARG  51          HH12      ARG  51  -7.205 -11.089   2.227
  404    H    ALA  52           HN       ALA  52  -3.547  -5.311   4.308
  405    HA   ALA  52           HA       ALA  52  -0.773  -5.173   3.675
  406   1HB   ALA  52           HB1      ALA  52  -2.885  -4.761   2.192
  407   2HB   ALA  52           HB3      ALA  52  -2.748  -3.097   2.759
  408   3HB   ALA  52           HB2      ALA  52  -1.422  -3.836   1.861
  409    H    ALA  53           HN       ALA  53  -2.704  -3.323   5.890
  410    HA   ALA  53           HA       ALA  53  -1.099  -0.921   5.861
  411   1HB   ALA  53           HB1      ALA  53  -3.225  -2.084   7.606
  412   2HB   ALA  53           HB3      ALA  53  -2.182  -0.851   8.315
  413   3HB   ALA  53           HB2      ALA  53  -3.127  -0.484   6.871
  414    H    THR  54           HN       THR  54  -1.046  -3.953   7.714
  415    HA   THR  54           HA       THR  54   1.071  -3.097   9.503
  416    HB   THR  54           HB       THR  54  -0.484  -5.516   9.018
  417    HG1  THR  54           HG1      THR  54   1.031  -5.134  11.305
  418   1HG2  THR  54          HG21      THR  54   2.471  -5.806   9.621
  419   2HG2  THR  54          HG23      THR  54   1.278  -7.071   9.903
  420   3HG2  THR  54          HG22      THR  54   1.593  -6.510   8.263
  421    H    VAL  55           HN       VAL  55   1.020  -5.105   6.540
  422    HA   VAL  55           HA       VAL  55   3.840  -5.539   6.438
  423    HB   VAL  55           HB       VAL  55   1.886  -5.337   4.119
  424   1HG1  VAL  55          HG11      VAL  55   4.750  -6.070   4.387
  425   2HG1  VAL  55          HG13      VAL  55   3.773  -7.172   3.416
  426   3HG1  VAL  55          HG12      VAL  55   3.872  -5.465   2.983
  427   1HG2  VAL  55          HG22      VAL  55   1.565  -7.036   6.147
  428   2HG2  VAL  55          HG21      VAL  55   1.327  -7.565   4.481
  429   3HG2  VAL  55          HG23      VAL  55   2.843  -7.918   5.312
  430    H    LEU  56           HN       LEU  56   1.846  -2.791   5.570
  431    HA   LEU  56           HA       LEU  56   3.943  -1.462   4.041
  432   1HB   LEU  56           HB2      LEU  56   1.158  -0.936   4.734
  433   2HB   LEU  56           HB1      LEU  56   2.160   0.505   4.900
  434    HG   LEU  56           HG       LEU  56   3.113  -0.069   2.595
  435   1HD1  LEU  56          HD13      LEU  56   1.829  -2.431   2.908
  436   2HD1  LEU  56          HD12      LEU  56   0.598  -1.537   2.017
  437   3HD1  LEU  56          HD11      LEU  56   2.207  -1.745   1.328
  438   1HD2  LEU  56          HD21      LEU  56   1.417   1.726   3.068
  439   2HD2  LEU  56          HD23      LEU  56   1.277   1.035   1.453
  440   3HD2  LEU  56          HD22      LEU  56   0.147   0.553   2.718
  441    NH1  ARG  57           NH2      ARG  57   1.502   0.803  14.062
  442    NH2  ARG  57           NH1      ARG  57   2.806   2.634  13.845
  443    H    ARG  57           HN       ARG  57   2.869  -1.578   7.381
  444    HA   ARG  57           HA       ARG  57   4.189   0.742   8.363
  445   1HB   ARG  57           HB2      ARG  57   3.436  -1.906   9.597
  446   2HB   ARG  57           HB1      ARG  57   4.375  -0.727  10.515
  447   1HG   ARG  57           HG2      ARG  57   2.508   0.946   9.675
  448   2HG   ARG  57           HG1      ARG  57   1.561  -0.532   9.506
  449   1HD   ARG  57           HD2      ARG  57   1.078  -0.150  11.705
  450   2HD   ARG  57           HD1      ARG  57   2.633  -0.939  11.964
  451    HE   ARG  57           HE       ARG  57   3.293   1.728  11.617
  452   1HH1  ARG  57          HH21      ARG  57   1.122  -0.046  13.698
  453   2HH1  ARG  57          HH22      ARG  57   1.252   1.103  14.984
  454   1HH2  ARG  57          HH11      ARG  57   3.434   3.196  13.307
  455   2HH2  ARG  57          HH12      ARG  57   2.546   2.919  14.767
  456    H    GLN  58           HN       GLN  58   5.305  -2.603   7.900
  457    HA   GLN  58           HA       GLN  58   7.990  -2.099   8.838
  458   1HB   GLN  58           HB2      GLN  58   6.719  -4.243   7.134
  459   2HB   GLN  58           HB1      GLN  58   8.464  -4.202   7.390
  460   1HG   GLN  58           HG2      GLN  58   8.232  -4.462   9.743
  461   2HG   GLN  58           HG1      GLN  58   6.507  -4.100   9.688
  462   1HE2  GLN  58          HE22      GLN  58   7.788  -7.887   8.973
  463   2HE2  GLN  58          HE21      GLN  58   8.890  -6.635   9.289
  464    H    PHE  59           HN       PHE  59   6.337  -1.811   5.745
  465    HA   PHE  59           HA       PHE  59   8.510  -1.521   3.975
  466   1HB   PHE  59           HB2      PHE  59   5.860  -1.338   3.677
  467   2HB   PHE  59           HB1      PHE  59   6.210   0.384   3.752
  468    HD1  PHE  59           HD2      PHE  59   8.200   1.205   2.219
  469    HD2  PHE  59           HD1      PHE  59   6.027  -2.452   1.639
  470    HE1  PHE  59           HE2      PHE  59   8.921   1.153  -0.152
  471    HE2  PHE  59           HE1      PHE  59   6.744  -2.503  -0.733
  472    HZ   PHE  59           HZ       PHE  59   8.191  -0.700  -1.629
  473    OH   TYR  60           OH       TYR  60   5.827   3.853  11.685
  474    H    TYR  60           HN       TYR  60   6.976   0.993   6.018
  475    HA   TYR  60           HA       TYR  60   9.124   2.846   5.230
  476   1HB   TYR  60           HB2      TYR  60   7.744   4.557   5.904
  477   2HB   TYR  60           HB1      TYR  60   6.519   3.324   5.615
  478    HD1  TYR  60           HD2      TYR  60   5.533   2.058   7.505
  479    HD2  TYR  60           HD1      TYR  60   8.315   5.270   8.140
  480    HE1  TYR  60           HE2      TYR  60   4.857   2.174   9.889
  481    HE2  TYR  60           HE1      TYR  60   7.638   5.385  10.523
  482    HH   TYR  60           HH       TYR  60   4.888   3.658  11.736
  483    H    SER  61           HN       SER  61   8.648   0.612   7.734
  484    HA   SER  61           HA       SER  61  10.169   2.211   9.694
  485   1HB   SER  61           HB2      SER  61   8.512  -0.208   9.752
  486   2HB   SER  61           HB1      SER  61   9.969  -0.338  10.732
  487    HG   SER  61           HG       SER  61   8.513   0.636  12.033
  488    H    HIS  62           HN       HIS  62  10.553  -1.093   8.424
  489    HA   HIS  62           HA       HIS  62  13.455  -0.919   8.920
  490   1HB   HIS  62           HB2      HIS  62  11.647  -3.190   8.071
  491   2HB   HIS  62           HB1      HIS  62  13.392  -3.353   8.275
  492    HD1  HIS  62           HD1      HIS  62  12.486  -5.097  10.230
  493    HD2  HIS  62           HD2      HIS  62  12.030  -1.019  10.965
  494    HE1  HIS  62           HE1      HIS  62  12.114  -4.855  12.724
  495    H    HIS  63           HN       HIS  63  11.335  -1.688   6.129
  496    HA   HIS  63           HA       HIS  63  13.360  -2.087   4.233
  497   1HB   HIS  63           HB2      HIS  63  11.296  -2.598   3.361
  498   2HB   HIS  63           HB1      HIS  63  10.524  -1.183   4.070
  499    HD1  HIS  63           HD1      HIS  63  13.090  -1.981   1.365
  500    HD2  HIS  63           HD2      HIS  63  10.207   0.887   2.263
  501    HE1  HIS  63           HE1      HIS  63  13.013  -0.403  -0.612
  502    H    GLU  64           HN       GLU  64  12.341   0.920   5.691
  503    HA   GLU  64           HA       GLU  64  13.786   2.473   3.631
  504   1HB   GLU  64           HB2      GLU  64  11.712   3.452   4.448
  505   2HB   GLU  64           HB1      GLU  64  12.278   3.350   6.112
  506   1HG   GLU  64           HG2      GLU  64  12.485   5.610   4.680
  507   2HG   GLU  64           HG1      GLU  64  13.683   5.165   5.890
  508    H    LYS  65           HN       LYS  65  15.581   0.836   4.650
  509    HA   LYS  65           HA       LYS  65  17.548   2.505   5.875
  510   1HB   LYS  65           HB2      LYS  65  15.768   1.769   7.761
  511   2HB   LYS  65           HB1      LYS  65  16.823   0.355   7.803
  512   1HG   LYS  65           HG2      LYS  65  18.725   2.221   7.800
  513   2HG   LYS  65           HG1      LYS  65  17.432   3.195   8.502
  514   1HD   LYS  65           HD2      LYS  65  17.408   2.002  10.447
  515   2HD   LYS  65           HD1      LYS  65  17.728   0.472   9.629
  516   1HE   LYS  65           HE2      LYS  65  19.922   0.621  10.101
  517   2HE   LYS  65           HE1      LYS  65  20.009   2.216   9.356
  518   1HZ   LYS  65           HZ1      LYS  65  18.729   2.091  11.960
  519   2HZ   LYS  65           HZ3      LYS  65  20.398   1.792  11.946
  520   3HZ   LYS  65           HZ2      LYS  65  19.794   3.253  11.324
  521    H    ASP  66           HN       ASP  66  17.311   0.642   3.684
  522    HA   ASP  66           HA       ASP  66  19.485  -1.246   4.458
  523   1HB   ASP  66           HB2      ASP  66  16.926  -2.123   4.069
  524   2HB   ASP  66           HB1      ASP  66  17.572  -2.245   2.434
  525    H    THR  67           HN       THR  67  20.732  -1.976   2.524
  526    HA   THR  67           HA       THR  67  20.948   0.239   0.580
  527    HB   THR  67           HB       THR  67  22.702  -2.211   0.920
  528    HG1  THR  67           HG1      THR  67  23.474   0.340   1.709
  529   1HG2  THR  67          HG22      THR  67  22.638   0.023  -0.965
  530   2HG2  THR  67          HG21      THR  67  24.183  -0.108  -0.126
  531   3HG2  THR  67          HG23      THR  67  23.557  -1.480  -1.039
  532    NH1  ARG  68           NH2      ARG  68  16.365  -8.337  -2.401
  533    NH2  ARG  68           NH1      ARG  68  15.248  -8.732  -0.479
  534    H    ARG  68           HN       ARG  68  18.907  -2.228   0.629
  535    HA   ARG  68           HA       ARG  68  19.485  -3.525  -1.908
  536   1HB   ARG  68           HB2      ARG  68  17.153  -3.510  -0.006
  537   2HB   ARG  68           HB1      ARG  68  16.984  -4.223  -1.610
  538   1HG   ARG  68           HG2      ARG  68  19.460  -5.100  -0.425
  539   2HG   ARG  68           HG1      ARG  68  18.128  -5.423   0.683
  540   1HD   ARG  68           HD2      ARG  68  17.570  -6.060  -2.148
  541   2HD   ARG  68           HD1      ARG  68  18.811  -7.060  -1.392
  542    HE   ARG  68           HE       ARG  68  16.741  -7.026   0.458
  543   1HH1  ARG  68          HH21      ARG  68  17.072  -7.854  -2.916
  544   2HH1  ARG  68          HH22      ARG  68  15.799  -9.021  -2.860
  545   1HH2  ARG  68          HH11      ARG  68  15.096  -8.549   0.493
  546   2HH2  ARG  68          HH12      ARG  68  14.690  -9.415  -0.951
  547    H    CYS  69           HN       CYS  69  17.090  -1.082  -0.843
  548    HA   CYS  69           HA       CYS  69  16.410  -0.552  -3.671
  549   1HB   CYS  69           HB2      CYS  69  14.646  -0.631  -1.865
  550   2HB   CYS  69           HB1      CYS  69  15.351   0.841  -1.197
  551    H    LEU  70           HN       LEU  70  18.257   0.882  -1.049
  552    HA   LEU  70           HA       LEU  70  18.447   3.547  -1.966
  553   1HB   LEU  70           HB2      LEU  70  20.504   1.801  -0.587
  554   2HB   LEU  70           HB1      LEU  70  20.743   3.522  -0.883
  555    HG   LEU  70           HG       LEU  70  18.458   2.310   0.702
  556   1HD1  LEU  70          HD12      LEU  70  21.160   3.115   1.400
  557   2HD1  LEU  70          HD11      LEU  70  19.972   4.089   2.265
  558   3HD1  LEU  70          HD13      LEU  70  19.941   2.330   2.405
  559   1HD2  LEU  70          HD22      LEU  70  18.982   4.987  -0.434
  560   2HD2  LEU  70          HD21      LEU  70  17.461   4.268   0.095
  561   3HD2  LEU  70          HD23      LEU  70  18.552   4.990   1.276
  562    H    GLY  71           HN       GLY  71  20.951   1.049  -2.550
  563   1HA   GLY  71           HA2      GLY  71  21.830   0.536  -4.760
  564   2HA   GLY  71           HA1      GLY  71  21.213   2.088  -5.328
  565    H    ALA  72           HN       ALA  72  22.764   3.606  -5.623
  566    HA   ALA  72           HA       ALA  72  24.842   4.069  -3.645
  567   1HB   ALA  72           HB2      ALA  72  25.425   2.118  -5.560
  568   2HB   ALA  72           HB1      ALA  72  26.211   3.574  -6.170
  569   3HB   ALA  72           HB3      ALA  72  26.595   2.975  -4.557
  570    H    THR  73           HN       THR  73  22.742   5.574  -5.013
  571    HA   THR  73           HA       THR  73  24.463   7.597  -6.393
  572    HB   THR  73           HB       THR  73  21.799   8.034  -7.187
  573    HG1  THR  73           HG1      THR  73  21.796   5.712  -8.204
  574   1HG2  THR  73          HG22      THR  73  23.977   8.297  -8.458
  575   2HG2  THR  73          HG21      THR  73  23.943   6.554  -8.726
  576   3HG2  THR  73          HG23      THR  73  22.661   7.573  -9.382
  577    H    ALA  74           HN       ALA  74  23.725   9.847  -6.090
  578    HA   ALA  74           HA       ALA  74  22.737  10.253  -3.344
  579   1HB   ALA  74           HB2      ALA  74  24.013  11.978  -5.443
  580   2HB   ALA  74           HB1      ALA  74  23.114  12.746  -4.133
  581   3HB   ALA  74           HB3      ALA  74  24.500  11.716  -3.768
  582    H    GLN  75           HN       GLN  75  21.706  10.908  -6.673
  583    HA   GLN  75           HA       GLN  75  19.401  12.475  -6.007
  584   1HB   GLN  75           HB2      GLN  75  18.628  11.938  -8.276
  585   2HB   GLN  75           HB1      GLN  75  20.345  12.340  -8.297
  586   1HG   GLN  75           HG2      GLN  75  20.799   9.837  -8.096
  587   2HG   GLN  75           HG1      GLN  75  19.086   9.594  -8.437
  588   1HE2  GLN  75          HE22      GLN  75  21.498  10.072 -11.535
  589   2HE2  GLN  75          HE21      GLN  75  21.974   9.537  -9.995
  590    H    GLN  76           HN       GLN  76  19.903   8.982  -6.366
  591    HA   GLN  76           HA       GLN  76  17.159   8.213  -6.163
  592   1HB   GLN  76           HB2      GLN  76  19.359   6.830  -6.710
  593   2HB   GLN  76           HB1      GLN  76  19.298   6.486  -4.981
  594   1HG   GLN  76           HG2      GLN  76  17.850   4.833  -5.535
  595   2HG   GLN  76           HG1      GLN  76  16.671   6.126  -5.756
  596   1HE2  GLN  76          HE22      GLN  76  17.791   3.997  -8.948
  597   2HE2  GLN  76          HE21      GLN  76  18.099   3.523  -7.349
  598    H    PHE  77           HN       PHE  77  19.442   9.299  -3.750
  599    HA   PHE  77           HA       PHE  77  18.091   8.144  -1.472
  600   1HB   PHE  77           HB2      PHE  77  20.400   9.766  -1.936
  601   2HB   PHE  77           HB1      PHE  77  19.395  10.575  -0.733
  602    HD1  PHE  77           HD2      PHE  77  18.411   9.035   1.159
  603    HD2  PHE  77           HD1      PHE  77  21.819   8.035  -1.256
  604    HE1  PHE  77           HE2      PHE  77  19.149   7.406   2.877
  605    HE2  PHE  77           HE1      PHE  77  22.558   6.405   0.460
  606    HZ   PHE  77           HZ       PHE  77  21.222   6.090   2.527
  607    H    HIS  78           HN       HIS  78  18.059  11.442  -2.872
  608    HA   HIS  78           HA       HIS  78  16.112  12.520  -1.111
  609   1HB   HIS  78           HB2      HIS  78  17.338  14.002  -2.569
  610   2HB   HIS  78           HB1      HIS  78  16.740  13.168  -4.004
  611    HD1  HIS  78           HD1      HIS  78  14.463  13.852  -4.896
  612    HD2  HIS  78           HD2      HIS  78  15.279  15.523  -1.165
  613    HE1  HIS  78           HE1      HIS  78  12.618  15.525  -4.440
  614    NH1  ARG  79           NH2      ARG  79  10.051  11.338  -8.834
  615    NH2  ARG  79           NH1      ARG  79  10.421  13.564  -8.774
  616    H    ARG  79           HN       ARG  79  15.693  10.921  -4.268
  617    HA   ARG  79           HA       ARG  79  12.837  11.109  -4.308
  618   1HB   ARG  79           HB2      ARG  79  14.865   9.385  -5.695
  619   2HB   ARG  79           HB1      ARG  79  13.153   8.978  -5.827
  620   1HG   ARG  79           HG2      ARG  79  13.857  11.835  -6.246
  621   2HG   ARG  79           HG1      ARG  79  14.374  10.710  -7.503
  622   1HD   ARG  79           HD2      ARG  79  12.214  10.149  -8.090
  623   2HD   ARG  79           HD1      ARG  79  11.584  10.454  -6.471
  624    HE   ARG  79           HE       ARG  79  12.342  12.961  -7.368
  625   1HH1  ARG  79          HH21      ARG  79  10.296  10.405  -8.575
  626   2HH1  ARG  79          HH22      ARG  79   9.252  11.496  -9.414
  627   1HH2  ARG  79          HH11      ARG  79  10.959  14.349  -8.464
  628   2HH2  ARG  79          HH12      ARG  79   9.618  13.705  -9.352
  629    H    HIS  80           HN       HIS  80  15.038   8.909  -2.702
  630    HA   HIS  80           HA       HIS  80  13.195   6.780  -2.188
  631   1HB   HIS  80           HB2      HIS  80  15.851   7.197  -1.673
  632   2HB   HIS  80           HB1      HIS  80  15.157   7.373  -0.062
  633    HD1  HIS  80           HD1      HIS  80  13.261   5.329   0.437
  634    HD2  HIS  80           HD2      HIS  80  16.356   4.552  -2.245
  635    HE1  HIS  80           HE1      HIS  80  13.436   2.808   0.255
  636    H    LYS  81           HN       LYS  81  14.093   9.639  -0.238
  637    HA   LYS  81           HA       LYS  81  12.365   9.115   1.952
  638   1HB   LYS  81           HB2      LYS  81  14.195  10.954   1.623
  639   2HB   LYS  81           HB1      LYS  81  12.864  11.914   0.975
  640   1HG   LYS  81           HG2      LYS  81  11.862  12.140   3.013
  641   2HG   LYS  81           HG1      LYS  81  12.291  10.505   3.516
  642   1HD   LYS  81           HD2      LYS  81  13.500  12.172   4.869
  643   2HD   LYS  81           HD1      LYS  81  14.625  11.236   3.883
  644   1HE   LYS  81           HE2      LYS  81  15.135  13.016   2.526
  645   2HE   LYS  81           HE1      LYS  81  13.522  13.716   2.661
  646   1HZ   LYS  81           HZ2      LYS  81  14.062  14.369   4.941
  647   2HZ   LYS  81           HZ1      LYS  81  15.635  13.757   4.748
  648   3HZ   LYS  81           HZ3      LYS  81  15.119  15.077   3.817
  649    H    GLN  82           HN       GLN  82  11.645  10.252  -1.269
  650    HA   GLN  82           HA       GLN  82   9.070  11.426  -0.584
  651   1HB   GLN  82           HB2      GLN  82  10.613  10.858  -3.055
  652   2HB   GLN  82           HB1      GLN  82   8.858  10.890  -3.234
  653   1HG   GLN  82           HG2      GLN  82  10.196  13.077  -1.680
  654   2HG   GLN  82           HG1      GLN  82  10.248  13.126  -3.444
  655   1HE2  GLN  82          HE22      GLN  82   7.115  14.789  -3.177
  656   2HE2  GLN  82          HE21      GLN  82   8.766  14.973  -3.526
  657    H    LEU  83           HN       LEU  83  10.197   8.260  -1.678
  658    HA   LEU  83           HA       LEU  83   7.540   7.197  -2.148
  659   1HB   LEU  83           HB2      LEU  83   9.616   6.270  -3.182
  660   2HB   LEU  83           HB1      LEU  83  10.125   5.714  -1.587
  661    HG   LEU  83           HG       LEU  83   7.384   4.918  -2.277
  662   1HD1  LEU  83          HD12      LEU  83   9.655   4.377  -4.120
  663   2HD1  LEU  83          HD11      LEU  83   8.626   3.001  -3.717
  664   3HD1  LEU  83          HD13      LEU  83   7.924   4.441  -4.455
  665   1HD2  LEU  83          HD23      LEU  83   9.861   3.786  -1.048
  666   2HD2  LEU  83          HD22      LEU  83   8.205   3.775  -0.444
  667   3HD2  LEU  83          HD21      LEU  83   8.689   2.648  -1.711
  668    H    ILE  84           HN       ILE  84   9.924   6.679   0.455
  669    HA   ILE  84           HA       ILE  84   8.280   5.078   2.119
  670    HB   ILE  84           HB       ILE  84  10.397   7.043   3.045
  671   1HG1  ILE  84          HG12      ILE  84  11.429   5.754   1.312
  672   2HG1  ILE  84          HG11      ILE  84  11.896   4.994   2.830
  673   1HG2  ILE  84          HG23      ILE  84   8.807   5.633   4.634
  674   2HG2  ILE  84          HG22      ILE  84   9.921   4.332   4.213
  675   3HG2  ILE  84          HG21      ILE  84  10.526   5.793   4.991
  676   1HD1  ILE  84          HD11      ILE  84  10.031   3.366   2.560
  677   2HD1  ILE  84          HD13      ILE  84   9.669   4.081   0.990
  678   3HD1  ILE  84          HD12      ILE  84  11.209   3.268   1.253
  679    NH1  ARG  85           NH2      ARG  85   6.517  15.832   2.173
  680    NH2  ARG  85           NH1      ARG  85   4.419  15.470   1.418
  681    H    ARG  85           HN       ARG  85   8.660   8.618   1.967
  682    HA   ARG  85           HA       ARG  85   7.012   9.232   4.215
  683   1HB   ARG  85           HB2      ARG  85   8.477  10.892   3.084
  684   2HB   ARG  85           HB1      ARG  85   7.410  10.852   1.680
  685   1HG   ARG  85           HG2      ARG  85   5.515  11.526   3.216
  686   2HG   ARG  85           HG1      ARG  85   6.721  11.785   4.478
  687   1HD   ARG  85           HD2      ARG  85   7.191  13.815   3.635
  688   2HD   ARG  85           HD1      ARG  85   7.620  13.085   2.087
  689    HE   ARG  85           HE       ARG  85   4.856  13.139   2.038
  690   1HH1  ARG  85          HH21      ARG  85   7.371  15.501   2.570
  691   2HH1  ARG  85          HH22      ARG  85   6.420  16.802   1.947
  692   1HH2  ARG  85          HH11      ARG  85   3.655  14.849   1.237
  693   2HH2  ARG  85          HH12      ARG  85   4.335  16.441   1.199
  694    H    PHE  86           HN       PHE  86   6.224   8.901   0.758
  695    HA   PHE  86           HA       PHE  86   3.468   9.540   0.930
  696   1HB   PHE  86           HB2      PHE  86   5.246   8.391  -1.016
  697   2HB   PHE  86           HB1      PHE  86   3.761   7.441  -0.965
  698    HD1  PHE  86           HD1      PHE  86   5.210  10.762  -1.634
  699    HD2  PHE  86           HD2      PHE  86   1.602   8.430  -1.534
  700    HE1  PHE  86           HE1      PHE  86   4.027  12.537  -2.899
  701    HE2  PHE  86           HE2      PHE  86   0.420  10.206  -2.800
  702    HZ   PHE  86           HZ       PHE  86   1.633  12.260  -3.482
  703    H    LEU  87           HN       LEU  87   5.187   6.523   1.608
  704    HA   LEU  87           HA       LEU  87   2.816   4.902   1.893
  705   1HB   LEU  87           HB2      LEU  87   5.378   4.244   1.684
  706   2HB   LEU  87           HB1      LEU  87   5.311   4.313   3.446
  707    HG   LEU  87           HG       LEU  87   3.026   2.902   2.271
  708   1HD1  LEU  87          HD12      LEU  87   5.130   2.410   0.761
  709   2HD1  LEU  87          HD11      LEU  87   5.629   1.414   2.128
  710   3HD1  LEU  87          HD13      LEU  87   4.108   1.079   1.302
  711   1HD2  LEU  87          HD23      LEU  87   4.971   2.655   4.515
  712   2HD2  LEU  87          HD22      LEU  87   3.214   2.505   4.529
  713   3HD2  LEU  87          HD21      LEU  87   4.209   1.165   3.957
  714    H    LYS  88           HN       LYS  88   4.684   6.942   4.091
  715    HA   LYS  88           HA       LYS  88   3.506   6.081   6.539
  716   1HB   LYS  88           HB2      LYS  88   4.762   8.666   5.627
  717   2HB   LYS  88           HB1      LYS  88   4.039   8.536   7.231
  718   1HG   LYS  88           HG2      LYS  88   5.490   6.280   7.265
  719   2HG   LYS  88           HG1      LYS  88   6.476   7.214   6.140
  720   1HD   LYS  88           HD2      LYS  88   5.566   8.273   8.827
  721   2HD   LYS  88           HD1      LYS  88   7.123   7.485   8.570
  722   1HE   LYS  88           HE2      LYS  88   7.974   9.432   7.832
  723   2HE   LYS  88           HE1      LYS  88   6.802   9.432   6.515
  724   1HZ   LYS  88           HZ1      LYS  88   6.127  10.357   9.244
  725   2HZ   LYS  88           HZ3      LYS  88   6.746  11.401   8.060
  726   3HZ   LYS  88           HZ2      LYS  88   5.261  10.616   7.806
  727    NH1  ARG  89           NH2      ARG  89  -1.502  14.312   1.567
  728    NH2  ARG  89           NH1      ARG  89  -2.139  13.115  -0.239
  729    H    ARG  89           HN       ARG  89   2.475   8.546   4.182
  730    HA   ARG  89           HA       ARG  89   0.225   9.456   5.732
  731   1HB   ARG  89           HB2      ARG  89   1.146  10.789   3.885
  732   2HB   ARG  89           HB1      ARG  89   0.684   9.531   2.736
  733   1HG   ARG  89           HG2      ARG  89  -1.578   9.999   2.917
  734   2HG   ARG  89           HG1      ARG  89  -1.419  10.652   4.547
  735   1HD   ARG  89           HD2      ARG  89  -1.463  12.700   3.598
  736   2HD   ARG  89           HD1      ARG  89   0.157  12.346   2.995
  737    HE   ARG  89           HE       ARG  89  -1.535  11.176   1.132
  738   1HH1  ARG  89          HH21      ARG  89  -1.149  14.363   2.500
  739   2HH1  ARG  89          HH22      ARG  89  -1.724  15.155   1.076
  740   1HH2  ARG  89          HH11      ARG  89  -2.277  12.235  -0.694
  741   2HH2  ARG  89          HH12      ARG  89  -2.356  13.965  -0.719
  742    H    LEU  90           HN       LEU  90   0.467   7.151   3.017
  743    HA   LEU  90           HA       LEU  90  -2.317   6.437   3.069
  744   1HB   LEU  90           HB2      LEU  90  -0.702   6.020   1.163
  745   2HB   LEU  90           HB1      LEU  90  -0.036   4.692   2.112
  746    HG   LEU  90           HG       LEU  90  -2.288   3.658   2.220
  747   1HD1  LEU  90          HD12      LEU  90  -2.995   6.236   0.957
  748   2HD1  LEU  90          HD11      LEU  90  -3.769   4.823   0.240
  749   3HD1  LEU  90          HD13      LEU  90  -3.979   5.166   1.957
  750   1HD2  LEU  90          HD23      LEU  90  -1.191   4.331  -0.521
  751   2HD2  LEU  90          HD22      LEU  90  -0.854   2.894   0.445
  752   3HD2  LEU  90          HD21      LEU  90  -2.454   3.129  -0.258
  753    H    ASP  91           HN       ASP  91   0.226   5.673   5.249
  754    HA   ASP  91           HA       ASP  91  -0.631   3.036   6.007
  755   1HB   ASP  91           HB2      ASP  91   1.470   4.718   6.700
  756   2HB   ASP  91           HB1      ASP  91   0.515   4.621   8.180
  757    NH1  ARG  92           NH2      ARG  92  -0.331   5.631  13.312
  758    NH2  ARG  92           NH1      ARG  92   0.913   7.367  12.578
  759    H    ARG  92           HN       ARG  92  -1.437   6.294   7.231
  760    HA   ARG  92           HA       ARG  92  -3.364   5.099   9.125
  761   1HB   ARG  92           HB2      ARG  92  -1.798   7.337   9.287
  762   2HB   ARG  92           HB1      ARG  92  -3.351   8.029   8.819
  763   1HG   ARG  92           HG2      ARG  92  -3.533   7.960  11.155
  764   2HG   ARG  92           HG1      ARG  92  -4.321   6.456  10.675
  765   1HD   ARG  92           HD2      ARG  92  -2.763   6.002  12.502
  766   2HD   ARG  92           HD1      ARG  92  -2.160   5.256  11.022
  767    HE   ARG  92           HE       ARG  92  -0.959   7.754  11.047
  768   1HH1  ARG  92          HH21      ARG  92  -1.158   5.073  13.274
  769   2HH1  ARG  92          HH22      ARG  92   0.389   5.407  13.969
  770   1HH2  ARG  92          HH11      ARG  92   1.038   8.151  11.968
  771   2HH2  ARG  92          HH12      ARG  92   1.624   7.130  13.240
  772    H    ASN  93           HN       ASN  93  -3.386   6.494   5.943
  773    HA   ASN  93           HA       ASN  93  -6.215   7.253   6.027
  774   1HB   ASN  93           HB2      ASN  93  -4.145   7.023   3.841
  775   2HB   ASN  93           HB1      ASN  93  -5.842   7.319   3.463
  776   1HD2  ASN  93          HD22      ASN  93  -5.361  10.760   3.985
  777   2HD2  ASN  93          HD21      ASN  93  -6.024   9.525   3.027
  778    H    LEU  94           HN       LEU  94  -4.414   4.781   4.195
  779    HA   LEU  94           HA       LEU  94  -6.606   3.265   3.278
  780   1HB   LEU  94           HB2      LEU  94  -4.106   3.035   2.729
  781   2HB   LEU  94           HB1      LEU  94  -3.978   2.082   4.204
  782    HG   LEU  94           HG       LEU  94  -6.068   0.829   3.091
  783   1HD1  LEU  94          HD13      LEU  94  -4.947   2.492   0.985
  784   2HD1  LEU  94          HD12      LEU  94  -4.879   0.781   0.564
  785   3HD1  LEU  94          HD11      LEU  94  -6.422   1.526   0.978
  786   1HD2  LEU  94          HD23      LEU  94  -3.897  -0.158   3.809
  787   2HD2  LEU  94          HD22      LEU  94  -4.446  -0.833   2.277
  788   3HD2  LEU  94          HD21      LEU  94  -3.174   0.384   2.296
  789    CH2  TRP  95           CH2      TRP  95  -2.540   0.244  13.168
  790    H    TRP  95           HN       TRP  95  -4.743   2.972   6.268
  791    HA   TRP  95           HA       TRP  95  -6.188   0.783   7.430
  792   1HB   TRP  95           HB2      TRP  95  -3.977   1.428   8.194
  793   2HB   TRP  95           HB1      TRP  95  -4.498   3.064   8.515
  794    HD1  TRP  95           HD1      TRP  95  -7.116   2.069  10.386
  795    HE1  TRP  95           HE1      TRP  95  -6.587   1.360  12.766
  796    HE3  TRP  95           HE3      TRP  95  -2.190   0.963   9.850
  797    HZ2  TRP  95           HZ2      TRP  95  -4.369   0.437  14.280
  798    HZ3  TRP  95           HZ3      TRP  95  -0.878   0.161  11.800
  799    HH2  TRP  95           HH2      TRP  95  -1.975  -0.112  14.011
  800    H    GLY  96           HN       GLY  96  -6.623   4.293   7.441
  801   1HA   GLY  96           HA2      GLY  96  -8.417   4.833   9.435
  802   2HA   GLY  96           HA1      GLY  96  -8.582   5.553   7.837
  803    H    LEU  97           HN       LEU  97  -9.251   3.238   6.372
  804    HA   LEU  97           HA       LEU  97 -12.033   2.876   7.320
  805   1HB   LEU  97           HB2      LEU  97 -10.588   2.469   4.731
  806   2HB   LEU  97           HB1      LEU  97 -12.055   1.535   5.024
  807    HG   LEU  97           HG       LEU  97 -12.845   4.022   5.839
  808   1HD1  LEU  97          HD13      LEU  97 -10.800   4.324   3.632
  809   2HD1  LEU  97          HD12      LEU  97 -12.093   5.499   3.876
  810   3HD1  LEU  97          HD11      LEU  97 -10.907   5.218   5.150
  811   1HD2  LEU  97          HD21      LEU  97 -13.826   2.286   4.168
  812   2HD2  LEU  97          HD23      LEU  97 -14.229   3.986   3.927
  813   3HD2  LEU  97          HD22      LEU  97 -12.987   3.224   2.933
  814    H    ALA  98           HN       ALA  98  -9.062   1.060   6.945
  815    HA   ALA  98           HA       ALA  98 -10.248  -1.558   7.212
  816   1HB   ALA  98           HB3      ALA  98  -7.687  -0.493   6.659
  817   2HB   ALA  98           HB2      ALA  98  -7.505  -1.508   8.089
  818   3HB   ALA  98           HB1      ALA  98  -8.191  -2.177   6.616
  819    H    GLY  99           HN       GLY  99  -7.869  -0.157   9.451
  820   1HA   GLY  99           HA2      GLY  99  -8.136   0.071  11.855
  821   2HA   GLY  99           HA1      GLY  99  -9.563  -0.975  11.762
  822    H    LEU 100           HN       LEU 100  -6.091  -0.896  11.725
  823    HA   LEU 100           HA       LEU 100  -5.765  -3.760  11.378
  824   1HB   LEU 100           HB2      LEU 100  -4.155  -2.045  10.540
  825   2HB   LEU 100           HB1      LEU 100  -3.758  -1.666  12.207
  826    HG   LEU 100           HG       LEU 100  -2.836  -3.852  12.575
  827   1HD1  LEU 100          HD11      LEU 100  -4.411  -4.493  10.161
  828   2HD1  LEU 100          HD13      LEU 100  -2.806  -5.218  10.200
  829   3HD1  LEU 100          HD12      LEU 100  -3.944  -5.531  11.507
  830   1HD2  LEU 100          HD21      LEU 100  -1.935  -2.062  10.541
  831   2HD2  LEU 100          HD23      LEU 100  -0.966  -3.119  11.569
  832   3HD2  LEU 100          HD22      LEU 100  -1.571  -3.707  10.019
  833    H    ASN 101           HN       ASN 101  -6.923  -2.177  13.996
  834    HA   ASN 101           HA       ASN 101  -5.288  -3.132  16.135
  835   1HB   ASN 101           HB2      ASN 101  -8.282  -2.641  15.983
  836   2HB   ASN 101           HB1      ASN 101  -7.423  -3.009  17.479
  837   1HD2  ASN 101          HD22      ASN 101  -5.502   0.153  17.188
  838   2HD2  ASN 101          HD21      ASN 101  -5.131  -1.496  17.343
  839    H    SER 102           HN       SER 102  -8.488  -4.501  15.354
  840    HA   SER 102           HA       SER 102  -7.445  -7.190  16.024
  841   1HB   SER 102           HB2      SER 102 -10.256  -6.249  15.383
  842   2HB   SER 102           HB1      SER 102  -9.821  -7.872  15.908
  843    HG   SER 102           HG       SER 102  -9.179  -5.530  17.369
  844    H    CYS 103           HN       CYS 103  -6.100  -6.961  13.902
  845    HA   CYS 103           HA       CYS 103  -7.712  -8.170  11.713
  846   1HB   CYS 103           HB2      CYS 103  -7.590  -5.877  11.035
  847   2HB   CYS 103           HB1      CYS 103  -5.889  -5.768  11.473
  848    HA   PRO 104           HA       PRO 104  -3.956 -10.630  12.779
  849   1HB   PRO 104           HB2      PRO 104  -5.377 -12.821  11.520
  850   2HB   PRO 104           HB1      PRO 104  -4.922 -12.639  13.220
  851   1HG   PRO 104           HG2      PRO 104  -7.550 -12.399  12.091
  852   2HG   PRO 104           HG1      PRO 104  -7.075 -12.148  13.775
  853   1HD   PRO 104           HD2      PRO 104  -7.864 -10.153  11.852
  854   2HD   PRO 104           HD1      PRO 104  -7.371  -9.904  13.539
  855    H    VAL 105           HN       VAL 105  -2.660  -9.651  11.189
  856    HA   VAL 105           HA       VAL 105  -3.082  -9.548   8.432
  857    HB   VAL 105           HB       VAL 105  -0.577  -9.456   8.219
  858   1HG1  VAL 105          HG12      VAL 105  -2.321  -7.772   9.869
  859   2HG1  VAL 105          HG11      VAL 105  -0.612  -7.600  10.273
  860   3HG1  VAL 105          HG13      VAL 105  -1.162  -7.313   8.623
  861   1HG2  VAL 105          HG23      VAL 105  -0.825 -10.719  10.835
  862   2HG2  VAL 105          HG22      VAL 105   0.595 -10.563   9.803
  863   3HG2  VAL 105          HG21      VAL 105   0.167  -9.263  10.915
  864    H    LYS 106           HN       LYS 106  -3.888 -11.410   7.445
  865    HA   LYS 106           HA       LYS 106  -2.707 -14.030   7.888
  866   1HB   LYS 106           HB2      LYS 106  -5.032 -13.023   6.624
  867   2HB   LYS 106           HB1      LYS 106  -4.108 -13.845   5.366
  868   1HG   LYS 106           HG2      LYS 106  -4.531 -15.141   8.054
  869   2HG   LYS 106           HG1      LYS 106  -5.759 -15.261   6.794
  870   1HD   LYS 106           HD2      LYS 106  -2.895 -15.899   6.142
  871   2HD   LYS 106           HD1      LYS 106  -3.894 -17.104   6.953
  872   1HE   LYS 106           HE2      LYS 106  -5.100 -17.526   5.081
  873   2HE   LYS 106           HE1      LYS 106  -5.237 -15.814   4.680
  874   1HZ   LYS 106           HZ2      LYS 106  -2.585 -16.939   4.402
  875   2HZ   LYS 106           HZ1      LYS 106  -3.739 -17.557   3.318
  876   3HZ   LYS 106           HZ3      LYS 106  -3.436 -15.889   3.372
  877    H    GLU 107           HN       GLU 107  -0.539 -14.077   7.348
  878    HA   GLU 107           HA       GLU 107   0.388 -12.858   4.828
  879   1HB   GLU 107           HB2      GLU 107   1.729 -14.213   7.155
  880   2HB   GLU 107           HB1      GLU 107   2.607 -13.928   5.654
  881   1HG   GLU 107           HG2      GLU 107   1.969 -11.511   5.801
  882   2HG   GLU 107           HG1      GLU 107   1.250 -11.839   7.377
  883    H    ALA 108           HN       ALA 108   0.587 -13.906   2.986
  884    HA   ALA 108           HA       ALA 108   0.087 -16.812   2.880
  885   1HB   ALA 108           HB2      ALA 108  -0.945 -15.110   1.278
  886   2HB   ALA 108           HB1      ALA 108   0.668 -14.926   0.589
  887   3HB   ALA 108           HB3      ALA 108  -0.149 -16.488   0.517
  888    H    ASP 109           HN       ASP 109   1.729 -17.181   0.504
  889    HA   ASP 109           HA       ASP 109   4.220 -17.882   1.795
  890   1HB   ASP 109           HB2      ASP 109   2.892 -18.627  -0.559
  891   2HB   ASP 109           HB1      ASP 109   4.364 -17.827  -1.113
  892    H    GLN 110           HN       GLN 110   6.273 -17.188   0.183
  893    HA   GLN 110           HA       GLN 110   6.422 -14.272   0.606
  894   1HB   GLN 110           HB2      GLN 110   8.269 -16.322   0.846
  895   2HB   GLN 110           HB1      GLN 110   8.733 -15.555  -0.672
  896   1HG   GLN 110           HG2      GLN 110   9.908 -14.247   0.849
  897   2HG   GLN 110           HG1      GLN 110   8.409 -13.329   0.712
  898   1HE2  GLN 110          HE22      GLN 110   8.822 -13.639   4.333
  899   2HE2  GLN 110          HE21      GLN 110   9.438 -12.726   3.041
  900    H    SER 111           HN       SER 111   4.981 -13.586  -1.082
  901    HA   SER 111           HA       SER 111   5.480 -14.336  -3.856
  902   1HB   SER 111           HB2      SER 111   3.791 -12.592  -4.360
  903   2HB   SER 111           HB1      SER 111   3.223 -13.683  -3.099
  904    HG   SER 111           HG       SER 111   4.412 -11.123  -2.750
  905    H    THR 112           HN       THR 112   5.470 -12.001  -5.269
  906    HA   THR 112           HA       THR 112   8.042 -10.746  -4.419
  907    HB   THR 112           HB       THR 112   8.271 -10.108  -6.825
  908    HG1  THR 112           HG1      THR 112   5.724 -10.805  -6.846
  909   1HG2  THR 112          HG21      THR 112   8.479 -12.693  -5.636
  910   2HG2  THR 112          HG23      THR 112   7.939 -12.904  -7.302
  911   3HG2  THR 112          HG22      THR 112   9.430 -12.025  -6.963
  912    H    LEU 113           HN       LEU 113   8.150  -8.492  -4.256
  913    HA   LEU 113           HA       LEU 113   5.723  -7.110  -3.674
  914   1HB   LEU 113           HB2      LEU 113   8.064  -6.540  -2.847
  915   2HB   LEU 113           HB1      LEU 113   8.335  -5.780  -4.415
  916    HG   LEU 113           HG       LEU 113   6.368  -4.320  -4.035
  917   1HD1  LEU 113          HD13      LEU 113   6.199  -6.005  -1.557
  918   2HD1  LEU 113          HD12      LEU 113   5.655  -4.329  -1.489
  919   3HD1  LEU 113          HD11      LEU 113   4.904  -5.454  -2.621
  920   1HD2  LEU 113          HD21      LEU 113   8.865  -4.060  -2.966
  921   2HD2  LEU 113          HD23      LEU 113   7.618  -2.819  -2.851
  922   3HD2  LEU 113          HD22      LEU 113   7.873  -3.940  -1.514
  923    H    GLU 114           HN       GLU 114   7.208  -7.767  -6.718
  924    HA   GLU 114           HA       GLU 114   6.267  -5.425  -8.119
  925   1HB   GLU 114           HB2      GLU 114   7.671  -7.852  -8.761
  926   2HB   GLU 114           HB1      GLU 114   6.347  -7.632  -9.905
  927   1HG   GLU 114           HG2      GLU 114   7.116  -5.288 -10.286
  928   2HG   GLU 114           HG1      GLU 114   8.493  -5.600  -9.230
  929    H    ASN 115           HN       ASN 115   4.977  -8.720  -7.725
  930    HA   ASN 115           HA       ASN 115   2.535  -8.138  -9.182
  931   1HB   ASN 115           HB2      ASN 115   3.370 -10.398  -7.353
  932   2HB   ASN 115           HB1      ASN 115   1.773 -10.322  -8.098
  933   1HD2  ASN 115          HD22      ASN 115   3.461 -12.197 -10.659
  934   2HD2  ASN 115          HD21      ASN 115   2.521 -12.367  -9.256
  935    H    PHE 116           HN       PHE 116   3.585  -7.581  -5.917
  936    HA   PHE 116           HA       PHE 116   0.929  -7.545  -4.735
  937   1HB   PHE 116           HB2      PHE 116   2.906  -7.878  -3.325
  938   2HB   PHE 116           HB1      PHE 116   3.542  -6.307  -3.812
  939    HD1  PHE 116           HD1      PHE 116   0.398  -7.798  -2.393
  940    HD2  PHE 116           HD2      PHE 116   3.129  -4.482  -2.426
  941    HE1  PHE 116           HE1      PHE 116  -0.905  -6.706  -0.586
  942    HE2  PHE 116           HE2      PHE 116   1.827  -3.390  -0.621
  943    HZ   PHE 116           HZ       PHE 116  -0.190  -4.501   0.300
  944    H    LEU 117           HN       LEU 117   3.196  -5.028  -5.854
  945    HA   LEU 117           HA       LEU 117   1.418  -2.832  -5.327
  946   1HB   LEU 117           HB2      LEU 117   4.049  -3.209  -6.413
  947   2HB   LEU 117           HB1      LEU 117   3.127  -2.186  -7.515
  948    HG   LEU 117           HG       LEU 117   4.290  -0.859  -5.763
  949   1HD1  LEU 117          HD12      LEU 117   1.530  -0.769  -6.491
  950   2HD1  LEU 117          HD11      LEU 117   1.656  -0.305  -4.794
  951   3HD1  LEU 117          HD13      LEU 117   2.575   0.571  -6.019
  952   1HD2  LEU 117          HD21      LEU 117   3.892  -2.831  -4.064
  953   2HD2  LEU 117          HD23      LEU 117   3.904  -1.168  -3.478
  954   3HD2  LEU 117          HD22      LEU 117   2.371  -1.997  -3.748
  955    H    GLU 118           HN       GLU 118   1.896  -4.989  -8.072
  956    HA   GLU 118           HA       GLU 118   0.365  -3.517  -9.988
  957   1HB   GLU 118           HB2      GLU 118   1.483  -5.224 -11.047
  958   2HB   GLU 118           HB1      GLU 118   1.308  -6.324  -9.678
  959   1HG   GLU 118           HG2      GLU 118  -0.898  -6.908 -10.279
  960   2HG   GLU 118           HG1      GLU 118  -1.075  -5.507 -11.336
  961    NH1  ARG 119           NH2      ARG 119  -4.688 -11.909  -7.672
  962    NH2  ARG 119           NH1      ARG 119  -2.809 -13.161  -7.714
  963    H    ARG 119           HN       ARG 119  -0.621  -6.352  -8.050
  964    HA   ARG 119           HA       ARG 119  -3.393  -6.187  -8.655
  965   1HB   ARG 119           HB2      ARG 119  -2.079  -7.218  -6.121
  966   2HB   ARG 119           HB1      ARG 119  -3.717  -7.588  -6.657
  967   1HG   ARG 119           HG2      ARG 119  -1.889  -8.111  -8.813
  968   2HG   ARG 119           HG1      ARG 119  -1.318  -8.937  -7.362
  969   1HD   ARG 119           HD2      ARG 119  -4.001  -9.463  -7.242
  970   2HD   ARG 119           HD1      ARG 119  -3.737  -9.437  -8.986
  971    HE   ARG 119           HE       ARG 119  -1.671 -11.011  -8.030
  972   1HH1  ARG 119          HH21      ARG 119  -5.148 -11.024  -7.718
  973   2HH1  ARG 119          HH22      ARG 119  -5.227 -12.741  -7.541
  974   1HH2  ARG 119          HH11      ARG 119  -1.816 -13.236  -7.795
  975   2HH2  ARG 119          HH12      ARG 119  -3.363 -13.984  -7.585
  976    H    LEU 120           HN       LEU 120  -1.418  -4.251  -6.529
  977    HA   LEU 120           HA       LEU 120  -3.529  -3.341  -4.785
  978   1HB   LEU 120           HB2      LEU 120  -0.720  -2.800  -5.188
  979   2HB   LEU 120           HB1      LEU 120  -1.606  -1.281  -5.043
  980    HG   LEU 120           HG       LEU 120  -1.766  -3.607  -3.101
  981   1HD1  LEU 120          HD13      LEU 120   0.213  -1.671  -3.349
  982   2HD1  LEU 120          HD12      LEU 120  -0.860  -1.001  -2.121
  983   3HD1  LEU 120          HD11      LEU 120  -0.142  -2.596  -1.890
  984   1HD2  LEU 120          HD21      LEU 120  -3.477  -1.313  -3.608
  985   2HD2  LEU 120          HD23      LEU 120  -3.728  -2.662  -2.501
  986   3HD2  LEU 120          HD22      LEU 120  -2.808  -1.250  -1.978
  987    H    LYS 121           HN       LYS 121  -2.019  -1.917  -7.695
  988    HA   LYS 121           HA       LYS 121  -3.721   0.379  -7.846
  989   1HB   LYS 121           HB2      LYS 121  -1.532  -0.284  -9.178
  990   2HB   LYS 121           HB1      LYS 121  -2.689  -0.976 -10.315
  991   1HG   LYS 121           HG2      LYS 121  -3.785   1.155 -10.611
  992   2HG   LYS 121           HG1      LYS 121  -2.842   1.877  -9.305
  993   1HD   LYS 121           HD2      LYS 121  -1.836   2.569 -11.389
  994   2HD   LYS 121           HD1      LYS 121  -0.761   1.383 -10.648
  995   1HE   LYS 121           HE2      LYS 121  -2.014  -0.374 -12.060
  996   2HE   LYS 121           HE1      LYS 121  -2.655   0.994 -12.968
  997   1HZ   LYS 121           HZ3      LYS 121  -0.215   1.705 -13.126
  998   2HZ   LYS 121           HZ2      LYS 121   0.143   0.100 -12.698
  999   3HZ   LYS 121           HZ1      LYS 121  -0.742   0.430 -14.111
 1000    H    THR 122           HN       THR 122  -3.822  -2.638  -9.678
 1001    HA   THR 122           HA       THR 122  -6.179  -2.341 -11.109
 1002    HB   THR 122           HB       THR 122  -6.262  -4.992 -10.139
 1003    HG1  THR 122           HG1      THR 122  -4.229  -4.504  -9.187
 1004   1HG2  THR 122          HG21      THR 122  -6.596  -4.237 -12.467
 1005   2HG2  THR 122          HG23      THR 122  -4.885  -3.821 -12.572
 1006   3HG2  THR 122          HG22      THR 122  -5.372  -5.504 -12.380
 1007    H    ILE 123           HN       ILE 123  -5.896  -3.373  -7.738
 1008    HA   ILE 123           HA       ILE 123  -8.691  -3.918  -7.362
 1009    HB   ILE 123           HB       ILE 123  -6.467  -3.278  -5.419
 1010   1HG1  ILE 123          HG12      ILE 123  -6.575  -5.457  -6.825
 1011   2HG1  ILE 123          HG11      ILE 123  -6.351  -5.612  -5.082
 1012   1HG2  ILE 123          HG23      ILE 123  -9.396  -3.685  -5.005
 1013   2HG2  ILE 123          HG22      ILE 123  -8.296  -4.449  -3.858
 1014   3HG2  ILE 123          HG21      ILE 123  -8.259  -2.701  -4.086
 1015   1HD1  ILE 123          HD11      ILE 123  -9.120  -5.610  -6.266
 1016   2HD1  ILE 123          HD13      ILE 123  -8.163  -7.090  -6.235
 1017   3HD1  ILE 123          HD12      ILE 123  -8.576  -6.275  -4.726
 1018    H    MET 124           HN       MET 124  -6.746  -1.022  -6.581
 1019    HA   MET 124           HA       MET 124  -8.829   0.446  -5.333
 1020   1HB   MET 124           HB2      MET 124  -6.489   1.515  -6.930
 1021   2HB   MET 124           HB1      MET 124  -7.467   2.445  -5.795
 1022   1HG   MET 124           HG2      MET 124  -5.952  -0.061  -5.017
 1023   2HG   MET 124           HG1      MET 124  -5.296   1.567  -4.842
 1024   1HE   MET 124           HE2      MET 124  -5.138   2.530  -3.109
 1025   2HE   MET 124           HE1      MET 124  -6.601   3.493  -2.952
 1026   3HE   MET 124           HE3      MET 124  -6.047   2.491  -1.604
 1027    NH1  ARG 125           NH2      ARG 125  -8.185  -0.338 -15.312
 1028    NH2  ARG 125           NH1      ARG 125  -6.664   1.241 -15.850
 1029    H    ARG 125           HN       ARG 125  -7.809   0.523  -8.757
 1030    HA   ARG 125           HA       ARG 125  -9.894   2.414  -9.464
 1031   1HB   ARG 125           HB2      ARG 125  -7.768   2.279 -10.708
 1032   2HB   ARG 125           HB1      ARG 125  -8.183   0.646 -11.233
 1033   1HG   ARG 125           HG2      ARG 125 -10.416   2.299 -11.829
 1034   2HG   ARG 125           HG1      ARG 125  -8.979   3.154 -12.390
 1035   1HD   ARG 125           HD2      ARG 125  -9.139   0.234 -12.977
 1036   2HD   ARG 125           HD1      ARG 125 -10.198   1.302 -13.897
 1037    HE   ARG 125           HE       ARG 125  -7.719   2.530 -14.050
 1038   1HH1  ARG 125          HH21      ARG 125  -8.951  -0.658 -14.758
 1039   2HH1  ARG 125          HH22      ARG 125  -7.810  -0.928 -16.025
 1040   1HH2  ARG 125          HH11      ARG 125  -6.258   2.143 -15.706
 1041   2HH2  ARG 125          HH12      ARG 125  -6.302   0.638 -16.562
 1042    H    GLU 126           HN       GLU 126  -9.394  -0.997 -10.358
 1043    HA   GLU 126           HA       GLU 126 -11.702  -1.521 -11.765
 1044   1HB   GLU 126           HB2      GLU 126  -9.986  -3.208 -11.440
 1045   2HB   GLU 126           HB1      GLU 126 -10.374  -3.315  -9.721
 1046   1HG   GLU 126           HG2      GLU 126 -12.090  -4.724 -10.118
 1047   2HG   GLU 126           HG1      GLU 126 -12.752  -3.661 -11.361
 1048    H    LYS 127           HN       LYS 127 -11.480  -1.529  -8.186
 1049    HA   LYS 127           HA       LYS 127 -14.370  -2.129  -8.040
 1050   1HB   LYS 127           HB2      LYS 127 -12.163  -2.613  -6.369
 1051   2HB   LYS 127           HB1      LYS 127 -13.142  -1.430  -5.504
 1052   1HG   LYS 127           HG2      LYS 127 -14.981  -3.282  -6.571
 1053   2HG   LYS 127           HG1      LYS 127 -13.653  -4.248  -5.931
 1054   1HD   LYS 127           HD2      LYS 127 -13.847  -3.213  -3.761
 1055   2HD   LYS 127           HD1      LYS 127 -15.001  -2.029  -4.374
 1056   1HE   LYS 127           HE2      LYS 127 -16.514  -3.981  -4.971
 1057   2HE   LYS 127           HE1      LYS 127 -15.415  -5.009  -4.053
 1058   1HZ   LYS 127           HZ3      LYS 127 -15.802  -3.079  -2.295
 1059   2HZ   LYS 127           HZ2      LYS 127 -17.285  -2.983  -3.118
 1060   3HZ   LYS 127           HZ1      LYS 127 -16.807  -4.442  -2.389
 1061    OH   TYR 128           OH       TYR 128 -11.533  -0.777  -1.684
 1062    H    TYR 128           HN       TYR 128 -12.202   0.564  -7.143
 1063    HA   TYR 128           HA       TYR 128 -14.549   2.189  -6.397
 1064   1HB   TYR 128           HB2      TYR 128 -11.664   3.076  -6.458
 1065   2HB   TYR 128           HB1      TYR 128 -12.993   3.771  -5.529
 1066    HD1  TYR 128           HD2      TYR 128 -14.344   1.290  -4.601
 1067    HD2  TYR 128           HD1      TYR 128 -10.177   2.314  -4.750
 1068    HE1  TYR 128           HE2      TYR 128 -13.892  -0.297  -2.754
 1069    HE2  TYR 128           HE1      TYR 128  -9.722   0.722  -2.900
 1070    HH   TYR 128           HH       TYR 128 -11.205  -1.593  -2.070
 1071    H    SER 129           HN       SER 129 -13.965   1.405  -9.291
 1072    HA   SER 129           HA       SER 129 -13.393   4.045 -10.490
 1073   1HB   SER 129           HB2      SER 129 -12.417   2.342 -11.779
 1074   2HB   SER 129           HB1      SER 129 -13.792   1.262 -11.571
 1075    HG   SER 129           HG       SER 129 -14.706   2.158 -13.239
 1076    H    LYS 130           HN       LYS 130 -16.089   1.901  -9.825
 1077    HA   LYS 130           HA       LYS 130 -17.911   3.911 -11.080
 1078   1HB   LYS 130           HB2      LYS 130 -17.687   1.144 -11.570
 1079   2HB   LYS 130           HB1      LYS 130 -19.150   1.330 -10.607
 1080   1HG   LYS 130           HG2      LYS 130 -18.899   3.380 -12.691
 1081   2HG   LYS 130           HG1      LYS 130 -18.959   1.744 -13.344
 1082   1HD   LYS 130           HD2      LYS 130 -20.898   2.075 -11.207
 1083   2HD   LYS 130           HD1      LYS 130 -21.142   3.275 -12.477
 1084   1HE   LYS 130           HE2      LYS 130 -21.067   1.429 -14.166
 1085   2HE   LYS 130           HE1      LYS 130 -20.985   0.270 -12.840
 1086   1HZ   LYS 130           HZ1      LYS 130 -23.076   1.638 -12.056
 1087   2HZ   LYS 130           HZ3      LYS 130 -23.216   1.939 -13.718
 1088   3HZ   LYS 130           HZ2      LYS 130 -23.216   0.340 -13.143
 1089    H    CYS 131           HN       CYS 131 -16.940   4.203  -8.415
 1090    HA   CYS 131           HA       CYS 131 -18.550   3.091  -6.384
 1091   1HB   CYS 131           HB2      CYS 131 -16.564   4.522  -5.952
 1092   2HB   CYS 131           HB1      CYS 131 -17.474   5.926  -6.511
 1093    H    SER 132           HN       SER 132 -19.122   6.054  -8.303
 1094    HA   SER 132           HA       SER 132 -21.689   6.584  -7.079
 1095   1HB   SER 132           HB2      SER 132 -20.120   7.656  -9.357
 1096   2HB   SER 132           HB1      SER 132 -21.867   7.840  -9.480
 1097    HG   SER 132           HG       SER 132 -21.490   9.499  -8.229
 1098    H    SER 133           HN       SER 133 -23.638   5.666  -7.558
 1099    HA   SER 133           HA       SER 133 -23.710   3.737  -9.827
 1100   1HB   SER 133           HB2      SER 133 -25.311   4.017  -7.287
 1101   2HB   SER 133           HB1      SER 133 -25.901   3.041  -8.629
 1102    HG   SER 133           HG       SER 133 -24.593   1.557  -7.949
   
  Start of MODEL          10
 Raw file had 1102 H/Q atoms
  Start of MODEL   10
    1   1H    GLU   1           HT1      GLU   1 -15.481   3.109  12.372
    2   2H    GLU   1           HT3      GLU   1 -14.038   2.906  13.240
    3   3H    GLU   1           HT2      GLU   1 -15.526   2.512  13.962
    4    HA   GLU   1           HA       GLU   1 -15.285   4.531  14.905
    5   1HB   GLU   1           HB2      GLU   1 -13.029   4.698  13.606
    6   2HB   GLU   1           HB1      GLU   1 -13.945   5.687  12.469
    7   1HG   GLU   1           HG2      GLU   1 -14.678   6.659  14.989
    8   2HG   GLU   1           HG1      GLU   1 -12.940   6.383  15.107
    9    H    ALA   2           HN       ALA   2 -15.582   5.121  11.376
   10    HA   ALA   2           HA       ALA   2 -17.912   6.843  11.878
   11   1HB   ALA   2           HB2      ALA   2 -15.953   6.790   9.920
   12   2HB   ALA   2           HB1      ALA   2 -17.364   6.137   9.085
   13   3HB   ALA   2           HB3      ALA   2 -17.445   7.727   9.845
   14    H    GLU   3           HN       GLU   3 -19.503   6.274   9.659
   15    HA   GLU   3           HA       GLU   3 -20.209   3.411   9.783
   16   1HB   GLU   3           HB2      GLU   3 -21.638   5.505  11.252
   17   2HB   GLU   3           HB1      GLU   3 -22.688   4.598  10.162
   18   1HG   GLU   3           HG2      GLU   3 -22.594   2.753  11.459
   19   2HG   GLU   3           HG1      GLU   3 -20.839   2.855  11.597
   20    H    ALA   4           HN       ALA   4 -21.428   6.606   8.705
   21    HA   ALA   4           HA       ALA   4 -21.469   5.596   5.929
   22   1HB   ALA   4           HB1      ALA   4 -23.735   5.164   7.173
   23   2HB   ALA   4           HB3      ALA   4 -23.970   6.900   6.974
   24   3HB   ALA   4           HB2      ALA   4 -23.765   5.871   5.557
   25    H    HIS   5           HN       HIS   5 -19.683   7.393   6.594
   26    HA   HIS   5           HA       HIS   5 -20.827  10.113   6.209
   27   1HB   HIS   5           HB2      HIS   5 -18.850   9.225   7.882
   28   2HB   HIS   5           HB1      HIS   5 -17.904   9.800   6.510
   29    HD1  HIS   5           HD1      HIS   5 -20.291  12.017   5.904
   30    HD2  HIS   5           HD2      HIS   5 -17.984  11.575   9.348
   31    HE1  HIS   5           HE1      HIS   5 -20.328  14.258   7.084
   32    H    LYS   6           HN       LYS   6 -18.610  11.310   4.955
   33    HA   LYS   6           HA       LYS   6 -19.033  10.424   2.200
   34   1HB   LYS   6           HB2      LYS   6 -17.314  12.600   3.424
   35   2HB   LYS   6           HB1      LYS   6 -17.407  12.297   1.688
   36   1HG   LYS   6           HG2      LYS   6 -20.021  12.426   2.153
   37   2HG   LYS   6           HG1      LYS   6 -19.493  13.385   3.537
   38   1HD   LYS   6           HD2      LYS   6 -18.343  14.950   2.112
   39   2HD   LYS   6           HD1      LYS   6 -18.579  13.920   0.700
   40   1HE   LYS   6           HE2      LYS   6 -21.071  14.618   2.109
   41   2HE   LYS   6           HE1      LYS   6 -20.232  15.996   1.397
   42   1HZ   LYS   6           HZ3      LYS   6 -20.324  13.692  -0.318
   43   2HZ   LYS   6           HZ2      LYS   6 -21.863  14.302   0.066
   44   3HZ   LYS   6           HZ1      LYS   6 -20.703  15.311  -0.656
   45    H    CYS   7           HN       CYS   7 -18.097   8.279   2.333
   46    HA   CYS   7           HA       CYS   7 -15.222   8.080   2.947
   47   1HB   CYS   7           HB2      CYS   7 -15.842   6.004   3.543
   48   2HB   CYS   7           HB1      CYS   7 -17.464   6.288   2.914
   49    H    ASP   8           HN       ASP   8 -17.293   8.323   0.145
   50    HA   ASP   8           HA       ASP   8 -15.549   7.149  -1.787
   51   1HB   ASP   8           HB2      ASP   8 -17.963   7.828  -2.142
   52   2HB   ASP   8           HB1      ASP   8 -17.401   9.495  -2.260
   53    H    ILE   9           HN       ILE   9 -15.362  10.182  -0.084
   54    HA   ILE   9           HA       ILE   9 -13.691  11.546  -2.020
   55    HB   ILE   9           HB       ILE   9 -14.268  11.981   0.914
   56   1HG1  ILE   9          HG12      ILE   9 -14.885  13.650  -1.543
   57   2HG1  ILE   9          HG11      ILE   9 -16.011  12.497  -0.828
   58   1HG2  ILE   9          HG23      ILE   9 -12.204  13.212  -0.855
   59   2HG2  ILE   9          HG22      ILE   9 -13.105  14.290   0.213
   60   3HG2  ILE   9          HG21      ILE   9 -12.178  12.952   0.890
   61   1HD1  ILE   9          HD11      ILE   9 -15.752  13.753   1.359
   62   2HD1  ILE   9          HD13      ILE   9 -14.869  14.988   0.461
   63   3HD1  ILE   9          HD12      ILE   9 -16.559  14.657   0.078
   64    H    THR  10           HN       THR  10 -12.835  10.322   1.237
   65    HA   THR  10           HA       THR  10 -10.024  10.445   0.841
   66    HB   THR  10           HB       THR  10 -11.517   8.476   2.587
   67    HG1  THR  10           HG1      THR  10 -11.841  10.080   3.950
   68   1HG2  THR  10          HG21      THR  10  -8.736   9.056   2.148
   69   2HG2  THR  10          HG23      THR  10  -9.168   9.536   3.789
   70   3HG2  THR  10          HG22      THR  10  -9.450   7.880   3.250
   71    H    LEU  11           HN       LEU  11 -12.361   8.031  -0.119
   72    HA   LEU  11           HA       LEU  11 -10.529   5.862  -0.526
   73   1HB   LEU  11           HB2      LEU  11 -13.330   6.449  -1.122
   74   2HB   LEU  11           HB1      LEU  11 -12.558   5.476  -2.373
   75    HG   LEU  11           HG       LEU  11 -13.562   4.085  -0.559
   76   1HD1  LEU  11          HD12      LEU  11 -10.915   3.964  -1.641
   77   2HD1  LEU  11          HD11      LEU  11 -10.861   3.374   0.021
   78   3HD1  LEU  11          HD13      LEU  11 -11.954   2.627  -1.144
   79   1HD2  LEU  11          HD22      LEU  11 -13.060   5.792   1.249
   80   2HD2  LEU  11          HD21      LEU  11 -12.634   4.133   1.667
   81   3HD2  LEU  11          HD23      LEU  11 -11.378   5.269   1.178
   82    H    GLN  12           HN       GLN  12 -12.096   7.900  -3.041
   83    HA   GLN  12           HA       GLN  12 -10.475   7.021  -5.177
   84   1HB   GLN  12           HB2      GLN  12 -11.077   9.159  -6.295
   85   2HB   GLN  12           HB1      GLN  12 -12.474   8.376  -5.556
   86   1HG   GLN  12           HG2      GLN  12 -12.019   9.832  -3.502
   87   2HG   GLN  12           HG1      GLN  12 -10.916  10.752  -4.525
   88   1HE2  GLN  12          HE22      GLN  12 -13.825  12.684  -5.255
   89   2HE2  GLN  12          HE21      GLN  12 -12.386  12.638  -4.356
   90    H    GLU  13           HN       GLU  13  -9.906   9.714  -2.916
   91    HA   GLU  13           HA       GLU  13  -7.514  10.674  -4.145
   92   1HB   GLU  13           HB2      GLU  13  -9.007  11.411  -1.954
   93   2HB   GLU  13           HB1      GLU  13  -7.549  10.765  -1.199
   94   1HG   GLU  13           HG2      GLU  13  -6.264  12.485  -1.931
   95   2HG   GLU  13           HG1      GLU  13  -7.019  12.489  -3.526
   96    H    ILE  14           HN       ILE  14  -8.131   8.048  -1.893
   97    HA   ILE  14           HA       ILE  14  -5.388   7.491  -1.248
   98    HB   ILE  14           HB       ILE  14  -7.960   6.427  -0.614
   99   1HG1  ILE  14          HG12      ILE  14  -5.367   5.407   0.514
  100   2HG1  ILE  14          HG11      ILE  14  -5.847   7.084   0.783
  101   1HG2  ILE  14          HG22      ILE  14  -5.958   4.324  -1.492
  102   2HG2  ILE  14          HG21      ILE  14  -7.465   4.012  -0.637
  103   3HG2  ILE  14          HG23      ILE  14  -7.505   4.661  -2.274
  104   1HD1  ILE  14          HD11      ILE  14  -8.071   6.214   1.615
  105   2HD1  ILE  14          HD13      ILE  14  -7.385   4.591   1.551
  106   3HD1  ILE  14          HD12      ILE  14  -6.695   5.799   2.633
  107    H    ILE  15           HN       ILE  15  -7.492   6.589  -3.913
  108    HA   ILE  15           HA       ILE  15  -5.837   4.476  -4.957
  109    HB   ILE  15           HB       ILE  15  -8.084   6.162  -5.965
  110   1HG1  ILE  15          HG12      ILE  15  -8.538   3.590  -6.723
  111   2HG1  ILE  15          HG11      ILE  15  -7.457   3.326  -5.354
  112   1HG2  ILE  15          HG23      ILE  15  -6.104   4.682  -7.699
  113   2HG2  ILE  15          HG22      ILE  15  -7.769   4.948  -8.213
  114   3HG2  ILE  15          HG21      ILE  15  -6.713   6.324  -7.894
  115   1HD1  ILE  15          HD11      ILE  15  -9.914   5.092  -5.239
  116   2HD1  ILE  15          HD13      ILE  15  -9.892   3.406  -4.724
  117   3HD1  ILE  15          HD12      ILE  15  -8.896   4.597  -3.886
  118    H    LYS  16           HN       LYS  16  -6.041   7.972  -5.634
  119    HA   LYS  16           HA       LYS  16  -4.079   8.057  -7.694
  120   1HB   LYS  16           HB2      LYS  16  -5.544   9.941  -6.169
  121   2HB   LYS  16           HB1      LYS  16  -3.842  10.351  -5.951
  122   1HG   LYS  16           HG2      LYS  16  -4.273  11.500  -7.914
  123   2HG   LYS  16           HG1      LYS  16  -3.769   9.947  -8.579
  124   1HD   LYS  16           HD2      LYS  16  -5.761  10.223  -9.720
  125   2HD   LYS  16           HD1      LYS  16  -6.356   9.386  -8.286
  126   1HE   LYS  16           HE2      LYS  16  -7.095  11.417  -7.283
  127   2HE   LYS  16           HE1      LYS  16  -6.200  12.400  -8.441
  128   1HZ   LYS  16           HZ2      LYS  16  -7.975  10.631  -9.770
  129   2HZ   LYS  16           HZ1      LYS  16  -8.820  11.578  -8.641
  130   3HZ   LYS  16           HZ3      LYS  16  -7.892  12.326  -9.849
  131    H    THR  17           HN       THR  17  -3.773   8.361  -4.169
  132    HA   THR  17           HA       THR  17  -0.963   8.675  -4.009
  133    HB   THR  17           HB       THR  17  -2.634   7.049  -2.076
  134    HG1  THR  17           HG1      THR  17  -3.421   8.896  -1.291
  135   1HG2  THR  17          HG22      THR  17  -0.089   7.282  -1.847
  136   2HG2  THR  17          HG21      THR  17  -0.392   8.985  -1.502
  137   3HG2  THR  17          HG23      THR  17  -1.056   7.741  -0.445
  138    H    LEU  18           HN       LEU  18  -2.974   5.826  -4.463
  139    HA   LEU  18           HA       LEU  18  -1.090   3.775  -4.024
  140   1HB   LEU  18           HB2      LEU  18  -3.665   3.794  -4.798
  141   2HB   LEU  18           HB1      LEU  18  -2.917   3.522  -6.369
  142    HG   LEU  18           HG       LEU  18  -2.760   1.801  -3.896
  143   1HD1  LEU  18          HD12      LEU  18  -4.452   1.665  -5.958
  144   2HD1  LEU  18          HD11      LEU  18  -3.097   0.814  -6.697
  145   3HD1  LEU  18          HD13      LEU  18  -3.810   0.207  -5.205
  146   1HD2  LEU  18          HD21      LEU  18  -0.896   1.860  -6.285
  147   2HD2  LEU  18          HD23      LEU  18  -0.461   1.970  -4.579
  148   3HD2  LEU  18          HD22      LEU  18  -1.064   0.451  -5.239
  149    H    ASN  19           HN       ASN  19  -1.849   5.497  -7.062
  150    HA   ASN  19           HA       ASN  19   0.142   4.237  -8.658
  151   1HB   ASN  19           HB2      ASN  19  -1.284   6.886  -8.823
  152   2HB   ASN  19           HB1      ASN  19  -0.032   6.461  -9.991
  153   1HD2  ASN  19          HD22      ASN  19  -3.686   4.705 -10.224
  154   2HD2  ASN  19          HD21      ASN  19  -3.328   5.834  -9.008
  155    H    SER  20           HN       SER  20   0.344   6.924  -6.389
  156    HA   SER  20           HA       SER  20   2.896   7.926  -7.240
  157   1HB   SER  20           HB2      SER  20   1.548   7.979  -4.526
  158   2HB   SER  20           HB1      SER  20   3.017   8.871  -4.917
  159    HG   SER  20           HG       SER  20   0.853   9.119  -6.653
  160    H    LEU  21           HN       LEU  21   1.998   5.357  -4.946
  161    HA   LEU  21           HA       LEU  21   4.676   4.922  -3.985
  162   1HB   LEU  21           HB2      LEU  21   2.400   2.924  -4.116
  163   2HB   LEU  21           HB1      LEU  21   3.821   2.830  -3.077
  164    HG   LEU  21           HG       LEU  21   1.795   5.083  -2.994
  165   1HD1  LEU  21          HD12      LEU  21   2.120   2.587  -1.313
  166   2HD1  LEU  21          HD11      LEU  21   1.202   3.993  -0.772
  167   3HD1  LEU  21          HD13      LEU  21   0.690   3.104  -2.206
  168   1HD2  LEU  21          HD23      LEU  21   4.190   4.330  -1.296
  169   2HD2  LEU  21          HD22      LEU  21   3.944   5.824  -2.201
  170   3HD2  LEU  21          HD21      LEU  21   2.964   5.487  -0.773
  171    H    THR  22           HN       THR  22   3.174   4.146  -6.990
  172    HA   THR  22           HA       THR  22   5.033   1.916  -7.537
  173    HB   THR  22           HB       THR  22   3.339   3.051  -9.700
  174    HG1  THR  22           HG1      THR  22   1.623   1.667  -8.602
  175   1HG2  THR  22          HG22      THR  22   4.158   0.344  -8.665
  176   2HG2  THR  22          HG21      THR  22   2.831   0.506  -9.816
  177   3HG2  THR  22          HG23      THR  22   4.449   1.053 -10.254
  178    H    GLU  23           HN       GLU  23   5.936   4.825  -7.192
  179    HA   GLU  23           HA       GLU  23   6.859   5.524  -9.891
  180   1HB   GLU  23           HB2      GLU  23   6.273   7.021  -7.667
  181   2HB   GLU  23           HB1      GLU  23   8.034   6.952  -7.591
  182   1HG   GLU  23           HG2      GLU  23   7.535   8.858  -8.933
  183   2HG   GLU  23           HG1      GLU  23   8.018   7.599 -10.069
  184    H    GLN  24           HN       GLN  24   8.120   4.022  -6.975
  185    HA   GLN  24           HA       GLN  24  10.825   3.875  -8.233
  186   1HB   GLN  24           HB2      GLN  24  10.633   4.722  -5.874
  187   2HB   GLN  24           HB1      GLN  24  10.014   3.136  -5.409
  188   1HG   GLN  24           HG2      GLN  24  12.085   2.249  -5.387
  189   2HG   GLN  24           HG1      GLN  24  12.442   2.896  -6.987
  190   1HE2  GLN  24          HE22      GLN  24  14.781   5.022  -5.406
  191   2HE2  GLN  24          HE21      GLN  24  14.532   3.768  -6.522
  192    H    LYS  25           HN       LYS  25   9.264   2.296  -9.605
  193    HA   LYS  25           HA       LYS  25   9.070  -0.368  -8.367
  194   1HB   LYS  25           HB2      LYS  25   7.235   0.387  -9.802
  195   2HB   LYS  25           HB1      LYS  25   8.355   0.605 -11.146
  196   1HG   LYS  25           HG2      LYS  25   8.567  -1.661 -11.520
  197   2HG   LYS  25           HG1      LYS  25   8.297  -2.071  -9.826
  198   1HD   LYS  25           HD2      LYS  25   5.937  -1.717 -10.019
  199   2HD   LYS  25           HD1      LYS  25   6.114  -0.959 -11.601
  200   1HE   LYS  25           HE2      LYS  25   6.434  -2.975 -12.685
  201   2HE   LYS  25           HE1      LYS  25   7.139  -3.747 -11.265
  202   1HZ   LYS  25           HZ2      LYS  25   4.408  -2.926 -10.898
  203   2HZ   LYS  25           HZ1      LYS  25   4.599  -4.085 -12.125
  204   3HZ   LYS  25           HZ3      LYS  25   5.148  -4.416 -10.555
  205    H    THR  26           HN       THR  26  11.559  -0.324  -8.153
  206    HA   THR  26           HA       THR  26  12.650  -2.031 -10.205
  207    HB   THR  26           HB       THR  26  14.532   0.086 -10.273
  208    HG1  THR  26           HG1      THR  26  12.833   1.467  -9.701
  209   1HG2  THR  26          HG23      THR  26  13.947  -1.689 -11.994
  210   2HG2  THR  26          HG22      THR  26  12.554  -0.695 -12.424
  211   3HG2  THR  26          HG21      THR  26  14.188  -0.066 -12.639
  212    H    LEU  27           HN       LEU  27  13.806   0.383  -7.812
  213    HA   LEU  27           HA       LEU  27  15.840  -1.551  -6.909
  214   1HB   LEU  27           HB2      LEU  27  15.530   1.312  -6.889
  215   2HB   LEU  27           HB1      LEU  27  15.841   0.743  -5.250
  216    HG   LEU  27           HG       LEU  27  17.534  -0.601  -7.216
  217   1HD1  LEU  27          HD11      LEU  27  17.429   2.400  -7.117
  218   2HD1  LEU  27          HD13      LEU  27  18.971   1.587  -7.378
  219   3HD1  LEU  27          HD12      LEU  27  17.643   1.342  -8.512
  220   1HD2  LEU  27          HD21      LEU  27  18.075   1.110  -4.768
  221   2HD2  LEU  27          HD23      LEU  27  17.916  -0.646  -4.788
  222   3HD2  LEU  27          HD22      LEU  27  19.279   0.126  -5.600
  223    H    CYS  28           HN       CYS  28  12.960   0.074  -5.601
  224    HA   CYS  28           HA       CYS  28  13.277  -1.411  -3.066
  225   1HB   CYS  28           HB2      CYS  28  11.734   0.928  -3.970
  226   2HB   CYS  28           HB1      CYS  28  10.873  -0.123  -2.847
  227    H    THR  29           HN       THR  29  11.276  -1.517  -5.972
  228    HA   THR  29           HA       THR  29   9.299  -3.305  -4.841
  229    HB   THR  29           HB       THR  29   8.918  -3.822  -7.377
  230    HG1  THR  29           HG1      THR  29  10.271  -2.878  -8.645
  231   1HG2  THR  29          HG22      THR  29   7.544  -2.328  -5.908
  232   2HG2  THR  29          HG21      THR  29   8.609  -0.989  -6.339
  233   3HG2  THR  29          HG23      THR  29   7.628  -1.771  -7.579
  234    H    GLU  30           HN       GLU  30  12.563  -3.822  -5.628
  235    HA   GLU  30           HA       GLU  30  12.159  -6.653  -6.376
  236   1HB   GLU  30           HB2      GLU  30  14.445  -4.740  -6.353
  237   2HB   GLU  30           HB1      GLU  30  14.830  -6.441  -6.082
  238   1HG   GLU  30           HG2      GLU  30  13.899  -7.096  -8.165
  239   2HG   GLU  30           HG1      GLU  30  13.062  -5.556  -8.364
  240    H    LEU  31           HN       LEU  31  11.039  -6.399  -4.009
  241    HA   LEU  31           HA       LEU  31  12.917  -7.731  -2.156
  242   1HB   LEU  31           HB2      LEU  31  11.525  -5.115  -1.707
  243   2HB   LEU  31           HB1      LEU  31  11.672  -6.225  -0.344
  244    HG   LEU  31           HG       LEU  31  14.155  -5.940  -1.886
  245   1HD1  LEU  31          HD13      LEU  31  12.689  -3.554  -0.897
  246   2HD1  LEU  31          HD12      LEU  31  14.396  -3.645  -0.463
  247   3HD1  LEU  31          HD11      LEU  31  13.915  -3.678  -2.159
  248   1HD2  LEU  31          HD21      LEU  31  13.379  -6.772   0.626
  249   2HD2  LEU  31          HD23      LEU  31  15.039  -6.403   0.156
  250   3HD2  LEU  31          HD22      LEU  31  14.055  -5.176   0.956
  251    H    THR  32           HN       THR  32  11.766  -9.630  -2.384
  252    HA   THR  32           HA       THR  32   9.070 -10.098  -2.689
  253    HB   THR  32           HB       THR  32   9.516 -12.227  -1.274
  254    HG1  THR  32           HG1      THR  32  12.033 -12.324  -1.412
  255   1HG2  THR  32          HG21      THR  32  11.158 -11.484  -3.709
  256   2HG2  THR  32          HG23      THR  32  10.950 -13.132  -3.120
  257   3HG2  THR  32          HG22      THR  32   9.558 -12.222  -3.703
  258    H    VAL  33           HN       VAL  33   7.300  -9.641  -1.570
  259    HA   VAL  33           HA       VAL  33   7.501  -9.207   1.382
  260    HB   VAL  33           HB       VAL  33   5.837  -7.466   1.190
  261   1HG1  VAL  33          HG13      VAL  33   8.367  -7.214   0.247
  262   2HG1  VAL  33          HG12      VAL  33   7.457  -6.734  -1.185
  263   3HG1  VAL  33          HG11      VAL  33   7.231  -5.869   0.335
  264   1HG2  VAL  33          HG23      VAL  33   5.379  -8.772  -1.403
  265   2HG2  VAL  33          HG22      VAL  33   4.271  -7.816  -0.418
  266   3HG2  VAL  33          HG21      VAL  33   5.403  -7.011  -1.505
  267    H    THR  34           HN       THR  34   4.622  -8.961   1.673
  268    HA   THR  34           HA       THR  34   3.953 -11.831   1.471
  269    HB   THR  34           HB       THR  34   3.316  -9.689   3.280
  270    HG1  THR  34           HG1      THR  34   3.734 -11.521   4.244
  271   1HG2  THR  34          HG21      THR  34   0.900 -11.089   2.095
  272   2HG2  THR  34          HG23      THR  34   0.894 -10.077   3.534
  273   3HG2  THR  34          HG22      THR  34   1.262  -9.367   1.966
  274    H    ASP  35           HN       ASP  35   1.994 -12.563   0.494
  275    HA   ASP  35           HA       ASP  35   0.902 -10.691  -1.568
  276   1HB   ASP  35           HB2      ASP  35   2.159 -12.749  -2.389
  277   2HB   ASP  35           HB1      ASP  35   0.870 -13.719  -1.676
  278    H    ILE  36           HN       ILE  36  -0.959  -9.918  -0.606
  279    HA   ILE  36           HA       ILE  36  -2.645 -11.787   0.947
  280    HB   ILE  36           HB       ILE  36  -3.768  -9.864   1.769
  281   1HG1  ILE  36          HG12      ILE  36  -2.574  -8.468  -0.641
  282   2HG1  ILE  36          HG11      ILE  36  -4.283  -8.699  -0.270
  283   1HG2  ILE  36          HG21      ILE  36  -1.168 -10.172   2.202
  284   2HG2  ILE  36          HG23      ILE  36  -1.067  -8.648   1.321
  285   3HG2  ILE  36          HG22      ILE  36  -2.015  -8.747   2.804
  286   1HD1  ILE  36          HD13      ILE  36  -3.756  -7.363   1.902
  287   2HD1  ILE  36          HD12      ILE  36  -2.306  -6.844   1.044
  288   3HD1  ILE  36          HD11      ILE  36  -3.901  -6.474   0.387
  289    H    PHE  37           HN       PHE  37  -2.388 -11.871  -2.089
  290    HA   PHE  37           HA       PHE  37  -5.305 -11.578  -2.675
  291   1HB   PHE  37           HB2      PHE  37  -2.972 -11.244  -4.587
  292   2HB   PHE  37           HB1      PHE  37  -4.677 -11.151  -5.029
  293    HD1  PHE  37           HD2      PHE  37  -6.128  -9.361  -3.994
  294    HD2  PHE  37           HD1      PHE  37  -1.851  -9.387  -3.600
  295    HE1  PHE  37           HE2      PHE  37  -6.176  -6.972  -3.334
  296    HE2  PHE  37           HE1      PHE  37  -1.898  -6.998  -2.939
  297    HZ   PHE  37           HZ       PHE  37  -4.061  -5.791  -2.806
  298    H    ALA  38           HN       ALA  38  -3.874 -13.890  -1.582
  299    HA   ALA  38           HA       ALA  38  -3.465 -15.799  -3.736
  300   1HB   ALA  38           HB3      ALA  38  -3.453 -15.863  -0.757
  301   2HB   ALA  38           HB2      ALA  38  -3.744 -17.389  -1.591
  302   3HB   ALA  38           HB1      ALA  38  -2.262 -16.485  -1.899
  303    H    ALA  39           HN       ALA  39  -6.099 -15.100  -1.458
  304    HA   ALA  39           HA       ALA  39  -7.975 -16.450  -3.297
  305   1HB   ALA  39           HB1      ALA  39  -6.954 -17.956  -1.266
  306   2HB   ALA  39           HB3      ALA  39  -8.353 -17.236  -0.468
  307   3HB   ALA  39           HB2      ALA  39  -8.569 -18.186  -1.938
  308    H    SER  40           HN       SER  40  -9.120 -14.536  -3.598
  309    HA   SER  40           HA       SER  40 -10.100 -13.134  -1.154
  310   1HB   SER  40           HB2      SER  40 -10.846 -11.448  -3.048
  311   2HB   SER  40           HB1      SER  40  -9.172 -11.484  -2.503
  312    HG   SER  40           HG       SER  40  -8.591 -12.297  -4.365
  313    H    LYS  41           HN       LYS  41 -11.345 -15.553  -1.646
  314    HA   LYS  41           HA       LYS  41 -13.684 -15.269  -3.328
  315   1HB   LYS  41           HB2      LYS  41 -12.435 -17.366  -1.969
  316   2HB   LYS  41           HB1      LYS  41 -13.989 -17.185  -1.155
  317   1HG   LYS  41           HG2      LYS  41 -15.163 -17.320  -3.300
  318   2HG   LYS  41           HG1      LYS  41 -13.625 -17.427  -4.157
  319   1HD   LYS  41           HD2      LYS  41 -13.138 -19.497  -2.732
  320   2HD   LYS  41           HD1      LYS  41 -14.840 -19.450  -2.267
  321   1HE   LYS  41           HE2      LYS  41 -15.320 -20.567  -4.162
  322   2HE   LYS  41           HE1      LYS  41 -14.818 -19.139  -5.065
  323   1HZ   LYS  41           HZ2      LYS  41 -13.020 -21.323  -4.164
  324   2HZ   LYS  41           HZ1      LYS  41 -13.596 -21.116  -5.748
  325   3HZ   LYS  41           HZ3      LYS  41 -12.557 -19.961  -5.067
  326    H    ASP  42           HN       ASP  42 -12.924 -14.299  -0.062
  327    HA   ASP  42           HA       ASP  42 -15.610 -13.107   0.151
  328   1HB   ASP  42           HB2      ASP  42 -15.879 -14.075   2.480
  329   2HB   ASP  42           HB1      ASP  42 -16.059 -15.237   1.166
  330    H    THR  43           HN       THR  43 -13.702 -11.436  -0.179
  331    HA   THR  43           HA       THR  43 -12.755 -10.621   2.540
  332    HB   THR  43           HB       THR  43 -11.192  -9.232   0.710
  333    HG1  THR  43           HG1      THR  43 -11.350 -11.938  -0.098
  334   1HG2  THR  43          HG21      THR  43 -10.888 -11.533   2.553
  335   2HG2  THR  43          HG23      THR  43  -9.604 -11.324   1.364
  336   3HG2  THR  43          HG22      THR  43  -9.989 -10.018   2.484
  337    H    THR  44           HN       THR  44 -12.068  -8.015   2.064
  338    HA   THR  44           HA       THR  44 -14.315  -6.704   0.673
  339    HB   THR  44           HB       THR  44 -14.279  -5.324   3.078
  340    HG1  THR  44           HG1      THR  44 -14.753  -7.227   4.490
  341   1HG2  THR  44          HG21      THR  44 -16.076  -7.086   1.579
  342   2HG2  THR  44          HG23      THR  44 -16.407  -7.077   3.311
  343   3HG2  THR  44          HG22      THR  44 -16.423  -5.566   2.403
  344    H    GLU  45           HN       GLU  45 -14.032  -4.184   1.046
  345    HA   GLU  45           HA       GLU  45 -11.338  -3.566   0.147
  346   1HB   GLU  45           HB2      GLU  45 -12.134  -1.261   0.001
  347   2HB   GLU  45           HB1      GLU  45 -13.364  -2.338  -0.661
  348   1HG   GLU  45           HG2      GLU  45 -14.369  -2.334   1.724
  349   2HG   GLU  45           HG1      GLU  45 -13.353  -0.919   2.000
  350    H    LYS  46           HN       LYS  46 -13.190  -3.110   3.136
  351    HA   LYS  46           HA       LYS  46 -11.128  -1.581   4.472
  352   1HB   LYS  46           HB2      LYS  46 -12.408  -2.245   6.563
  353   2HB   LYS  46           HB1      LYS  46 -13.366  -1.417   5.337
  354   1HG   LYS  46           HG2      LYS  46 -14.675  -3.230   4.970
  355   2HG   LYS  46           HG1      LYS  46 -13.303  -4.334   4.995
  356   1HD   LYS  46           HD2      LYS  46 -14.435  -4.993   6.917
  357   2HD   LYS  46           HD1      LYS  46 -13.303  -3.811   7.578
  358   1HE   LYS  46           HE2      LYS  46 -15.198  -2.084   7.098
  359   2HE   LYS  46           HE1      LYS  46 -16.246  -3.500   7.031
  360   1HZ   LYS  46           HZ2      LYS  46 -14.433  -2.881   9.297
  361   2HZ   LYS  46           HZ1      LYS  46 -16.083  -2.477   9.262
  362   3HZ   LYS  46           HZ3      LYS  46 -15.609  -4.105   9.231
  363    H    GLU  47           HN       GLU  47 -11.760  -5.005   4.021
  364    HA   GLU  47           HA       GLU  47  -9.889  -5.876   6.076
  365   1HB   GLU  47           HB2      GLU  47 -11.414  -7.195   3.849
  366   2HB   GLU  47           HB1      GLU  47 -10.060  -8.055   4.583
  367   1HG   GLU  47           HG2      GLU  47 -11.073  -7.787   6.808
  368   2HG   GLU  47           HG1      GLU  47 -12.420  -6.897   6.095
  369    H    THR  48           HN       THR  48  -9.776  -5.132   2.637
  370    HA   THR  48           HA       THR  48  -7.096  -6.190   2.245
  371    HB   THR  48           HB       THR  48  -8.982  -4.484   0.651
  372    HG1  THR  48           HG1      THR  48  -8.365  -6.214  -0.858
  373   1HG2  THR  48          HG21      THR  48  -6.006  -4.692   0.330
  374   2HG2  THR  48          HG23      THR  48  -7.027  -4.583  -1.104
  375   3HG2  THR  48          HG22      THR  48  -7.056  -3.293   0.100
  376    H    PHE  49           HN       PHE  49  -8.444  -3.139   3.333
  377    HA   PHE  49           HA       PHE  49  -5.999  -1.620   2.920
  378   1HB   PHE  49           HB2      PHE  49  -8.433  -1.070   4.644
  379   2HB   PHE  49           HB1      PHE  49  -7.111   0.068   4.403
  380    HD1  PHE  49           HD2      PHE  49  -6.506  -0.412   1.501
  381    HD2  PHE  49           HD1      PHE  49 -10.253  -0.012   3.564
  382    HE1  PHE  49           HE2      PHE  49  -7.572   0.370  -0.583
  383    HE2  PHE  49           HE1      PHE  49 -11.318   0.777   1.471
  384    HZ   PHE  49           HZ       PHE  49  -9.977   0.969  -0.605
  385    H    CYS  50           HN       CYS  50  -7.426  -3.406   5.631
  386    HA   CYS  50           HA       CYS  50  -5.407  -2.504   7.522
  387   1HB   CYS  50           HB2      CYS  50  -7.805  -3.524   7.940
  388   2HB   CYS  50           HB1      CYS  50  -6.940  -5.059   7.883
  389    NH1  ARG  51           NH2      ARG  51  -7.549 -11.627   3.870
  390    NH2  ARG  51           NH1      ARG  51  -5.599 -12.766   3.917
  391    H    ARG  51           HN       ARG  51  -5.944  -5.629   5.843
  392    HA   ARG  51           HA       ARG  51  -3.614  -6.922   6.793
  393   1HB   ARG  51           HB2      ARG  51  -5.109  -7.188   4.174
  394   2HB   ARG  51           HB1      ARG  51  -3.774  -8.247   4.627
  395   1HG   ARG  51           HG2      ARG  51  -4.952  -9.091   6.521
  396   2HG   ARG  51           HG1      ARG  51  -6.173  -7.822   6.417
  397   1HD   ARG  51           HD2      ARG  51  -7.314  -9.570   5.407
  398   2HD   ARG  51           HD1      ARG  51  -6.547  -8.839   3.996
  399    HE   ARG  51           HE       ARG  51  -4.689 -10.695   4.862
  400   1HH1  ARG  51          HH21      ARG  51  -8.079 -10.798   4.039
  401   2HH1  ARG  51          HH22      ARG  51  -7.998 -12.432   3.483
  402   1HH2  ARG  51          HH11      ARG  51  -4.623 -12.809   4.126
  403   2HH2  ARG  51          HH12      ARG  51  -6.064 -13.562   3.529
  404    H    ALA  52           HN       ALA  52  -4.030  -5.130   3.719
  405    HA   ALA  52           HA       ALA  52  -1.262  -5.251   2.998
  406   1HB   ALA  52           HB1      ALA  52  -3.509  -3.392   2.210
  407   2HB   ALA  52           HB3      ALA  52  -1.882  -3.235   1.548
  408   3HB   ALA  52           HB2      ALA  52  -2.808  -4.710   1.272
  409    H    ALA  53           HN       ALA  53  -3.065  -3.131   5.135
  410    HA   ALA  53           HA       ALA  53  -1.102  -1.019   5.237
  411   1HB   ALA  53           HB3      ALA  53  -3.338  -1.893   7.066
  412   2HB   ALA  53           HB2      ALA  53  -2.239  -0.597   7.534
  413   3HB   ALA  53           HB1      ALA  53  -3.231  -0.433   6.085
  414    H    THR  54           HN       THR  54  -1.427  -4.135   6.825
  415    HA   THR  54           HA       THR  54   0.536  -3.654   8.894
  416    HB   THR  54           HB       THR  54  -0.788  -6.069   7.704
  417    HG1  THR  54           HG1      THR  54  -0.456  -5.930  10.382
  418   1HG2  THR  54          HG21      THR  54   1.787  -6.042   9.273
  419   2HG2  THR  54          HG23      THR  54   0.687  -7.418   9.337
  420   3HG2  THR  54          HG22      THR  54   1.409  -6.936   7.802
  421    H    VAL  55           HN       VAL  55   0.630  -5.241   5.700
  422    HA   VAL  55           HA       VAL  55   3.466  -5.714   5.715
  423    HB   VAL  55           HB       VAL  55   1.619  -5.278   3.339
  424   1HG1  VAL  55          HG13      VAL  55   4.405  -5.565   3.448
  425   2HG1  VAL  55          HG12      VAL  55   3.811  -7.176   3.047
  426   3HG1  VAL  55          HG11      VAL  55   3.385  -5.799   2.029
  427   1HG2  VAL  55          HG21      VAL  55   2.117  -7.583   5.182
  428   2HG2  VAL  55          HG23      VAL  55   0.627  -7.096   4.373
  429   3HG2  VAL  55          HG22      VAL  55   1.889  -7.935   3.469
  430    H    LEU  56           HN       LEU  56   1.540  -2.864   5.216
  431    HA   LEU  56           HA       LEU  56   3.588  -1.355   3.784
  432   1HB   LEU  56           HB2      LEU  56   0.988  -0.605   5.145
  433   2HB   LEU  56           HB1      LEU  56   2.051   0.596   4.409
  434    HG   LEU  56           HG       LEU  56   1.210  -1.816   2.825
  435   1HD1  LEU  56          HD12      LEU  56  -0.545   0.279   3.843
  436   2HD1  LEU  56          HD11      LEU  56  -0.500   0.267   2.081
  437   3HD1  LEU  56          HD13      LEU  56  -0.958  -1.191   2.960
  438   1HD2  LEU  56          HD23      LEU  56   2.812   0.428   2.366
  439   2HD2  LEU  56          HD22      LEU  56   2.192  -0.680   1.142
  440   3HD2  LEU  56          HD21      LEU  56   1.301   0.791   1.532
  441    NH1  ARG  57           NH2      ARG  57   0.283  -0.723  13.652
  442    NH2  ARG  57           NH1      ARG  57   0.685   1.433  14.194
  443    H    ARG  57           HN       ARG  57   2.656  -1.934   7.113
  444    HA   ARG  57           HA       ARG  57   4.123   0.263   8.274
  445   1HB   ARG  57           HB2      ARG  57   2.519  -1.951   9.193
  446   2HB   ARG  57           HB1      ARG  57   4.020  -1.892  10.119
  447   1HG   ARG  57           HG2      ARG  57   3.630   0.499  10.599
  448   2HG   ARG  57           HG1      ARG  57   2.124   0.435   9.683
  449   1HD   ARG  57           HD2      ARG  57   1.142  -1.104  11.244
  450   2HD   ARG  57           HD1      ARG  57   2.686  -1.357  12.058
  451    HE   ARG  57           HE       ARG  57   2.243   1.366  12.303
  452   1HH1  ARG  57          HH21      ARG  57   0.446  -1.524  13.077
  453   2HH1  ARG  57          HH22      ARG  57  -0.372  -0.780  14.406
  454   1HH2  ARG  57          HH11      ARG  57   1.165   2.295  14.031
  455   2HH2  ARG  57          HH12      ARG  57   0.029   1.360  14.945
  456    H    GLN  58           HN       GLN  58   4.876  -3.159   7.641
  457    HA   GLN  58           HA       GLN  58   7.523  -3.029   8.794
  458   1HB   GLN  58           HB2      GLN  58   5.875  -4.992   7.451
  459   2HB   GLN  58           HB1      GLN  58   7.510  -5.016   6.788
  460   1HG   GLN  58           HG2      GLN  58   6.927  -5.050   9.758
  461   2HG   GLN  58           HG1      GLN  58   7.165  -6.514   8.803
  462   1HE2  GLN  58          HE22      GLN  58  10.400  -4.710  10.187
  463   2HE2  GLN  58          HE21      GLN  58   8.843  -4.583  10.851
  464    H    PHE  59           HN       PHE  59   6.184  -2.449   5.587
  465    HA   PHE  59           HA       PHE  59   8.824  -2.111   4.362
  466   1HB   PHE  59           HB2      PHE  59   7.144  -2.942   2.901
  467   2HB   PHE  59           HB1      PHE  59   5.983  -1.721   3.415
  468    HD1  PHE  59           HD1      PHE  59   8.985  -2.375   1.373
  469    HD2  PHE  59           HD2      PHE  59   6.091   0.566   2.573
  470    HE1  PHE  59           HE1      PHE  59   9.746  -0.880  -0.453
  471    HE2  PHE  59           HE2      PHE  59   6.854   2.060   0.748
  472    HZ   PHE  59           HZ       PHE  59   8.680   1.338  -0.766
  473    OH   TYR  60           OH       TYR  60   7.306   6.601  10.190
  474    H    TYR  60           HN       TYR  60   6.779  -0.113   6.254
  475    HA   TYR  60           HA       TYR  60   7.670   2.372   4.947
  476   1HB   TYR  60           HB2      TYR  60   5.555   2.810   5.695
  477   2HB   TYR  60           HB1      TYR  60   5.660   1.626   6.997
  478    HD1  TYR  60           HD1      TYR  60   7.227   4.883   5.968
  479    HD2  TYR  60           HD2      TYR  60   5.797   2.418   9.183
  480    HE1  TYR  60           HE1      TYR  60   7.716   6.703   7.579
  481    HE2  TYR  60           HE2      TYR  60   6.288   4.238  10.796
  482    HH   TYR  60           HH       TYR  60   7.416   7.416   9.695
  483    H    SER  61           HN       SER  61   8.065   0.813   8.147
  484    HA   SER  61           HA       SER  61  10.105   2.834   8.836
  485   1HB   SER  61           HB2      SER  61   9.629   0.526  10.634
  486   2HB   SER  61           HB1      SER  61   9.761   2.241  11.014
  487    HG   SER  61           HG       SER  61   7.621   1.419  11.259
  488    H    HIS  62           HN       HIS  62   9.950  -0.527   7.822
  489    HA   HIS  62           HA       HIS  62  12.780  -0.951   8.538
  490   1HB   HIS  62           HB2      HIS  62  10.807  -2.677   8.663
  491   2HB   HIS  62           HB1      HIS  62  11.168  -2.916   6.952
  492    HD1  HIS  62           HD1      HIS  62  14.336  -2.162   7.719
  493    HD2  HIS  62           HD2      HIS  62  11.988  -5.331   9.071
  494    HE1  HIS  62           HE1      HIS  62  15.939  -3.964   8.491
  495    H    HIS  63           HN       HIS  63  10.962  -1.491   5.483
  496    HA   HIS  63           HA       HIS  63  13.244  -1.687   3.845
  497   1HB   HIS  63           HB2      HIS  63  10.435  -0.764   3.220
  498   2HB   HIS  63           HB1      HIS  63  11.668  -0.981   1.977
  499    HD1  HIS  63           HD1      HIS  63  11.367  -3.204   0.890
  500    HD2  HIS  63           HD2      HIS  63  10.588  -3.390   4.981
  501    HE1  HIS  63           HE1      HIS  63  10.838  -5.626   1.409
  502    H    GLU  64           HN       GLU  64  11.718   1.193   5.130
  503    HA   GLU  64           HA       GLU  64  12.859   3.057   3.262
  504   1HB   GLU  64           HB2      GLU  64  11.317   4.215   4.467
  505   2HB   GLU  64           HB1      GLU  64  11.515   3.178   5.880
  506   1HG   GLU  64           HG2      GLU  64  13.490   4.356   6.579
  507   2HG   GLU  64           HG1      GLU  64  13.568   5.243   5.056
  508    H    LYS  65           HN       LYS  65  14.021   1.712   6.344
  509    HA   LYS  65           HA       LYS  65  16.559   3.217   6.028
  510   1HB   LYS  65           HB2      LYS  65  15.143   2.760   8.257
  511   2HB   LYS  65           HB1      LYS  65  16.144   1.308   8.280
  512   1HG   LYS  65           HG2      LYS  65  17.636   2.678   9.339
  513   2HG   LYS  65           HG1      LYS  65  18.026   3.177   7.693
  514   1HD   LYS  65           HD2      LYS  65  15.917   4.800   8.161
  515   2HD   LYS  65           HD1      LYS  65  16.530   4.634   9.807
  516   1HE   LYS  65           HE2      LYS  65  18.754   5.019   8.036
  517   2HE   LYS  65           HE1      LYS  65  17.558   6.278   7.724
  518   1HZ   LYS  65           HZ1      LYS  65  17.481   6.655  10.160
  519   2HZ   LYS  65           HZ3      LYS  65  18.780   5.579  10.336
  520   3HZ   LYS  65           HZ2      LYS  65  18.985   7.019   9.459
  521    H    ASP  66           HN       ASP  66  15.740   0.883   4.281
  522    HA   ASP  66           HA       ASP  66  17.677  -1.198   5.078
  523   1HB   ASP  66           HB2      ASP  66  15.294  -1.299   3.696
  524   2HB   ASP  66           HB1      ASP  66  16.481  -1.379   2.393
  525    H    THR  67           HN       THR  67  19.777  -0.778   4.621
  526    HA   THR  67           HA       THR  67  20.765   1.213   2.907
  527    HB   THR  67           HB       THR  67  22.267   0.202   4.469
  528    HG1  THR  67           HG1      THR  67  23.757  -0.876   2.749
  529   1HG2  THR  67          HG23      THR  67  21.447  -2.350   3.095
  530   2HG2  THR  67          HG22      THR  67  22.939  -2.258   4.030
  531   3HG2  THR  67          HG21      THR  67  21.389  -1.958   4.813
  532    NH1  ARG  68           NH2      ARG  68  21.090  -6.067   2.935
  533    NH2  ARG  68           NH1      ARG  68  20.073  -8.075   2.780
  534    H    ARG  68           HN       ARG  68  19.576  -1.983   2.119
  535    HA   ARG  68           HA       ARG  68  20.814  -2.338  -0.412
  536   1HB   ARG  68           HB2      ARG  68  18.014  -3.168   0.406
  537   2HB   ARG  68           HB1      ARG  68  18.966  -3.859  -0.909
  538   1HG   ARG  68           HG2      ARG  68  20.363  -3.818   1.681
  539   2HG   ARG  68           HG1      ARG  68  18.921  -4.832   1.664
  540   1HD   ARG  68           HD2      ARG  68  20.059  -5.506  -0.721
  541   2HD   ARG  68           HD1      ARG  68  21.495  -5.184   0.245
  542    HE   ARG  68           HE       ARG  68  19.852  -7.510   0.411
  543   1HH1  ARG  68          HH21      ARG  68  21.438  -5.234   2.514
  544   2HH1  ARG  68          HH22      ARG  68  21.232  -6.224   3.912
  545   1HH2  ARG  68          HH11      ARG  68  19.631  -8.785   2.233
  546   2HH2  ARG  68          HH12      ARG  68  20.234  -8.223   3.757
  547    H    CYS  69           HN       CYS  69  17.473  -1.130   0.164
  548    HA   CYS  69           HA       CYS  69  17.252  -0.110  -2.526
  549   1HB   CYS  69           HB2      CYS  69  15.382  -0.693  -0.764
  550   2HB   CYS  69           HB1      CYS  69  15.593   0.992  -0.282
  551    H    LEU  70           HN       LEU  70  18.880   1.116   0.236
  552    HA   LEU  70           HA       LEU  70  18.548   3.936  -0.473
  553   1HB   LEU  70           HB2      LEU  70  20.351   2.492   1.481
  554   2HB   LEU  70           HB1      LEU  70  20.396   4.238   1.248
  555    HG   LEU  70           HG       LEU  70  17.933   2.654   2.039
  556   1HD1  LEU  70          HD11      LEU  70  19.784   4.442   3.647
  557   2HD1  LEU  70          HD13      LEU  70  18.234   3.831   4.225
  558   3HD1  LEU  70          HD12      LEU  70  19.547   2.708   3.869
  559   1HD2  LEU  70          HD22      LEU  70  18.500   5.561   1.486
  560   2HD2  LEU  70          HD21      LEU  70  17.158   4.571   0.916
  561   3HD2  LEU  70          HD23      LEU  70  17.210   5.102   2.596
  562    H    GLY  71           HN       GLY  71  21.653   2.250  -0.024
  563   1HA   GLY  71           HA2      GLY  71  23.252   1.867  -1.835
  564   2HA   GLY  71           HA1      GLY  71  22.447   3.138  -2.755
  565    H    ALA  72           HN       ALA  72  24.701   4.016  -2.944
  566    HA   ALA  72           HA       ALA  72  25.333   5.688  -0.548
  567   1HB   ALA  72           HB2      ALA  72  27.076   3.855  -2.094
  568   2HB   ALA  72           HB1      ALA  72  27.771   5.432  -1.722
  569   3HB   ALA  72           HB3      ALA  72  27.208   4.387  -0.417
  570    H    THR  73           HN       THR  73  23.750   6.311  -2.938
  571    HA   THR  73           HA       THR  73  25.489   8.464  -4.074
  572    HB   THR  73           HB       THR  73  23.160   7.221  -5.540
  573    HG1  THR  73           HG1      THR  73  25.891   6.514  -5.785
  574   1HG2  THR  73          HG23      THR  73  24.524   9.485  -6.053
  575   2HG2  THR  73          HG22      THR  73  25.577   8.328  -6.869
  576   3HG2  THR  73          HG21      THR  73  23.880   8.455  -7.332
  577    H    ALA  74           HN       ALA  74  24.667  10.513  -3.851
  578    HA   ALA  74           HA       ALA  74  22.348  10.966  -2.221
  579   1HB   ALA  74           HB1      ALA  74  24.435  12.547  -3.423
  580   2HB   ALA  74           HB3      ALA  74  22.874  13.316  -3.710
  581   3HB   ALA  74           HB2      ALA  74  23.387  12.953  -2.063
  582    H    GLN  75           HN       GLN  75  22.757  10.593  -5.669
  583    HA   GLN  75           HA       GLN  75  20.415  11.963  -6.548
  584   1HB   GLN  75           HB2      GLN  75  22.122   9.758  -7.643
  585   2HB   GLN  75           HB1      GLN  75  20.566  10.083  -8.411
  586   1HG   GLN  75           HG2      GLN  75  21.213  12.161  -9.163
  587   2HG   GLN  75           HG1      GLN  75  22.305  12.429  -7.805
  588   1HE2  GLN  75          HE22      GLN  75  23.670  10.448 -11.127
  589   2HE2  GLN  75          HE21      GLN  75  22.002  10.660 -10.900
  590    H    GLN  76           HN       GLN  76  20.820   8.428  -6.102
  591    HA   GLN  76           HA       GLN  76  17.981   7.927  -6.183
  592   1HB   GLN  76           HB2      GLN  76  18.544   5.663  -5.624
  593   2HB   GLN  76           HB1      GLN  76  19.837   6.256  -6.669
  594   1HG   GLN  76           HG2      GLN  76  21.064   6.911  -4.509
  595   2HG   GLN  76           HG1      GLN  76  19.878   5.911  -3.667
  596   1HE2  GLN  76          HE22      GLN  76  21.132   2.834  -5.073
  597   2HE2  GLN  76          HE21      GLN  76  19.705   3.572  -4.526
  598    H    PHE  77           HN       PHE  77  20.150   8.899  -3.634
  599    HA   PHE  77           HA       PHE  77  18.678   7.898  -1.399
  600   1HB   PHE  77           HB2      PHE  77  20.989   9.433  -1.775
  601   2HB   PHE  77           HB1      PHE  77  19.893  10.488  -0.883
  602    HD1  PHE  77           HD2      PHE  77  18.392   8.895   0.885
  603    HD2  PHE  77           HD1      PHE  77  22.459   8.307  -0.364
  604    HE1  PHE  77           HE2      PHE  77  18.843   7.613   2.960
  605    HE2  PHE  77           HE1      PHE  77  22.911   7.025   1.711
  606    HZ   PHE  77           HZ       PHE  77  21.102   6.678   3.373
  607    H    HIS  78           HN       HIS  78  18.731  11.273  -2.610
  608    HA   HIS  78           HA       HIS  78  16.443  12.092  -1.126
  609   1HB   HIS  78           HB2      HIS  78  18.212  13.514  -2.400
  610   2HB   HIS  78           HB1      HIS  78  17.162  13.282  -3.798
  611    HD1  HIS  78           HD1      HIS  78  14.626  14.122  -3.497
  612    HD2  HIS  78           HD2      HIS  78  17.312  15.440  -0.594
  613    HE1  HIS  78           HE1      HIS  78  13.504  16.057  -2.308
  614    NH1  ARG  79           NH2      ARG  79  15.956  12.906  -9.293
  615    NH2  ARG  79           NH1      ARG  79  17.406  11.969 -10.746
  616    H    ARG  79           HN       ARG  79  16.743  10.822  -4.432
  617    HA   ARG  79           HA       ARG  79  14.036  11.183  -5.218
  618   1HB   ARG  79           HB2      ARG  79  16.241   9.329  -6.045
  619   2HB   ARG  79           HB1      ARG  79  14.608   9.019  -6.633
  620   1HG   ARG  79           HG2      ARG  79  14.923  11.764  -6.980
  621   2HG   ARG  79           HG1      ARG  79  16.495  11.102  -7.425
  622   1HD   ARG  79           HD2      ARG  79  14.693   9.345  -8.597
  623   2HD   ARG  79           HD1      ARG  79  13.934  10.918  -8.831
  624    HE   ARG  79           HE       ARG  79  16.160   9.915 -10.294
  625   1HH1  ARG  79          HH21      ARG  79  15.162  12.844  -8.692
  626   2HH1  ARG  79          HH22      ARG  79  16.401  13.790  -9.433
  627   1HH2  ARG  79          HH11      ARG  79  17.734  11.173 -11.256
  628   2HH2  ARG  79          HH12      ARG  79  17.837  12.862 -10.881
  629    H    HIS  80           HN       HIS  80  15.500   8.818  -3.091
  630    HA   HIS  80           HA       HIS  80  13.080   7.125  -3.137
  631   1HB   HIS  80           HB2      HIS  80  15.040   5.830  -2.957
  632   2HB   HIS  80           HB1      HIS  80  15.765   6.928  -1.783
  633    HD1  HIS  80           HD1      HIS  80  13.225   4.172  -2.085
  634    HD2  HIS  80           HD2      HIS  80  14.889   6.563   0.896
  635    HE1  HIS  80           HE1      HIS  80  12.503   3.168   0.127
  636    H    LYS  81           HN       LYS  81  14.475   9.679  -1.212
  637    HA   LYS  81           HA       LYS  81  13.091   9.127   1.241
  638   1HB   LYS  81           HB2      LYS  81  15.028  10.724   0.958
  639   2HB   LYS  81           HB1      LYS  81  13.907  11.846   0.186
  640   1HG   LYS  81           HG2      LYS  81  12.459  11.640   2.272
  641   2HG   LYS  81           HG1      LYS  81  13.819  10.808   3.026
  642   1HD   LYS  81           HD2      LYS  81  14.370  13.404   1.659
  643   2HD   LYS  81           HD1      LYS  81  13.538  13.456   3.215
  644   1HE   LYS  81           HE2      LYS  81  15.394  11.857   4.042
  645   2HE   LYS  81           HE1      LYS  81  16.267  12.334   2.585
  646   1HZ   LYS  81           HZ1      LYS  81  15.158  14.282   4.524
  647   2HZ   LYS  81           HZ3      LYS  81  16.746  13.692   4.610
  648   3HZ   LYS  81           HZ2      LYS  81  16.246  14.585   3.255
  649    H    GLN  82           HN       GLN  82  12.185  10.798  -1.720
  650    HA   GLN  82           HA       GLN  82   9.784  12.004  -0.662
  651   1HB   GLN  82           HB2      GLN  82  11.123  12.466  -2.893
  652   2HB   GLN  82           HB1      GLN  82  10.041  11.239  -3.551
  653   1HG   GLN  82           HG2      GLN  82   8.106  12.553  -2.621
  654   2HG   GLN  82           HG1      GLN  82   9.246  13.827  -2.188
  655   1HE2  GLN  82          HE22      GLN  82   8.315  13.214  -6.137
  656   2HE2  GLN  82          HE21      GLN  82   7.942  12.019  -4.990
  657    H    LEU  83           HN       LEU  83  10.387   9.010  -2.523
  658    HA   LEU  83           HA       LEU  83   7.700   8.145  -2.729
  659   1HB   LEU  83           HB2      LEU  83   9.363   6.947  -3.959
  660   2HB   LEU  83           HB1      LEU  83  10.291   6.598  -2.502
  661    HG   LEU  83           HG       LEU  83   7.506   5.652  -2.378
  662   1HD1  LEU  83          HD12      LEU  83   9.036   5.166  -4.776
  663   2HD1  LEU  83          HD11      LEU  83   8.810   3.655  -3.896
  664   3HD1  LEU  83          HD13      LEU  83   7.410   4.616  -4.373
  665   1HD2  LEU  83          HD23      LEU  83   9.959   5.121  -1.156
  666   2HD2  LEU  83          HD22      LEU  83   8.477   4.186  -0.954
  667   3HD2  LEU  83          HD21      LEU  83   9.670   3.700  -2.159
  668    H    ILE  84           HN       ILE  84  10.076   7.513  -0.135
  669    HA   ILE  84           HA       ILE  84   8.462   5.858   1.488
  670    HB   ILE  84           HB       ILE  84  10.507   7.941   2.316
  671   1HG1  ILE  84          HG12      ILE  84  11.418   6.215   0.832
  672   2HG1  ILE  84          HG11      ILE  84  12.004   5.959   2.474
  673   1HG2  ILE  84          HG23      ILE  84   9.234   5.659   3.851
  674   2HG2  ILE  84          HG22      ILE  84  10.660   6.543   4.394
  675   3HG2  ILE  84          HG21      ILE  84   9.118   7.380   4.221
  676   1HD1  ILE  84          HD12      ILE  84   9.957   4.379   2.730
  677   2HD1  ILE  84          HD11      ILE  84   9.899   4.413   0.968
  678   3HD1  ILE  84          HD13      ILE  84  11.335   3.804   1.791
  679    NH1  ARG  85           NH2      ARG  85   9.321  15.858   3.957
  680    NH2  ARG  85           NH1      ARG  85   9.719  15.056   6.030
  681    H    ARG  85           HN       ARG  85   8.634   9.426   1.390
  682    HA   ARG  85           HA       ARG  85   6.861   9.926   3.553
  683   1HB   ARG  85           HB2      ARG  85   7.355  11.508   1.014
  684   2HB   ARG  85           HB1      ARG  85   6.424  12.114   2.384
  685   1HG   ARG  85           HG2      ARG  85   8.597  11.344   3.729
  686   2HG   ARG  85           HG1      ARG  85   9.361  11.612   2.162
  687   1HD   ARG  85           HD2      ARG  85   9.172  13.860   2.337
  688   2HD   ARG  85           HD1      ARG  85   7.505  13.757   2.907
  689    HE   ARG  85           HE       ARG  85   8.988  12.916   5.082
  690   1HH1  ARG  85          HH21      ARG  85   9.032  15.726   3.011
  691   2HH1  ARG  85          HH22      ARG  85   9.604  16.767   4.266
  692   1HH2  ARG  85          HH11      ARG  85   9.736  14.296   6.680
  693   2HH2  ARG  85          HH12      ARG  85  10.000  15.969   6.322
  694    H    PHE  86           HN       PHE  86   6.187   9.459   0.092
  695    HA   PHE  86           HA       PHE  86   3.387   9.890   0.178
  696   1HB   PHE  86           HB2      PHE  86   5.295   8.925  -1.700
  697   2HB   PHE  86           HB1      PHE  86   3.996   7.735  -1.628
  698    HD1  PHE  86           HD2      PHE  86   1.565   8.666  -1.697
  699    HD2  PHE  86           HD1      PHE  86   5.014  10.879  -2.970
  700    HE1  PHE  86           HE2      PHE  86   0.106  10.160  -3.037
  701    HE2  PHE  86           HE1      PHE  86   3.560  12.374  -4.312
  702    HZ   PHE  86           HZ       PHE  86   1.107  12.015  -4.346
  703    H    LEU  87           HN       LEU  87   5.322   7.037   0.948
  704    HA   LEU  87           HA       LEU  87   3.086   5.245   1.253
  705   1HB   LEU  87           HB2      LEU  87   5.586   4.670   0.936
  706   2HB   LEU  87           HB1      LEU  87   5.760   4.998   2.655
  707    HG   LEU  87           HG       LEU  87   5.412   2.565   2.067
  708   1HD1  LEU  87          HD12      LEU  87   4.522   4.008   4.213
  709   2HD1  LEU  87          HD11      LEU  87   3.038   3.211   3.690
  710   3HD1  LEU  87          HD13      LEU  87   4.460   2.250   4.099
  711   1HD2  LEU  87          HD21      LEU  87   3.494   3.452   0.369
  712   2HD2  LEU  87          HD23      LEU  87   3.526   1.812   1.021
  713   3HD2  LEU  87          HD22      LEU  87   2.499   3.037   1.765
  714    H    LYS  88           HN       LYS  88   4.729   7.504   3.399
  715    HA   LYS  88           HA       LYS  88   3.652   6.524   5.861
  716   1HB   LYS  88           HB2      LYS  88   4.982   8.988   4.923
  717   2HB   LYS  88           HB1      LYS  88   3.905   9.211   6.302
  718   1HG   LYS  88           HG2      LYS  88   5.111   7.060   7.223
  719   2HG   LYS  88           HG1      LYS  88   6.379   7.524   6.088
  720   1HD   LYS  88           HD2      LYS  88   6.980   8.631   8.089
  721   2HD   LYS  88           HD1      LYS  88   6.178   9.882   7.138
  722   1HE   LYS  88           HE2      LYS  88   4.013   9.014   8.360
  723   2HE   LYS  88           HE1      LYS  88   5.166   8.392   9.539
  724   1HZ   LYS  88           HZ3      LYS  88   5.277  11.190   8.594
  725   2HZ   LYS  88           HZ2      LYS  88   4.278  10.731   9.889
  726   3HZ   LYS  88           HZ1      LYS  88   5.960  10.519   9.995
  727    NH1  ARG  89           NH2      ARG  89  -2.298  13.423   2.132
  728    NH2  ARG  89           NH1      ARG  89  -2.981  12.592   0.148
  729    H    ARG  89           HN       ARG  89   2.421   8.866   3.488
  730    HA   ARG  89           HA       ARG  89   0.129   9.655   5.035
  731   1HB   ARG  89           HB2      ARG  89   1.234  10.504   2.687
  732   2HB   ARG  89           HB1      ARG  89  -0.168   9.614   2.092
  733   1HG   ARG  89           HG2      ARG  89  -0.436  11.593   4.352
  734   2HG   ARG  89           HG1      ARG  89  -0.482  12.120   2.671
  735   1HD   ARG  89           HD2      ARG  89  -2.185   9.793   3.371
  736   2HD   ARG  89           HD1      ARG  89  -2.693  11.343   4.029
  737    HE   ARG  89           HE       ARG  89  -3.000  10.452   1.320
  738   1HH1  ARG  89          HH21      ARG  89  -2.070  13.299   3.097
  739   2HH1  ARG  89          HH22      ARG  89  -2.278  14.339   1.733
  740   1HH2  ARG  89          HH11      ARG  89  -3.277  11.820  -0.416
  741   2HH2  ARG  89          HH12      ARG  89  -2.960  13.514  -0.239
  742    H    LEU  90           HN       LEU  90   0.501   7.283   2.399
  743    HA   LEU  90           HA       LEU  90  -2.216   6.328   2.593
  744   1HB   LEU  90           HB2      LEU  90  -0.665   6.104   0.595
  745   2HB   LEU  90           HB1      LEU  90   0.153   4.816   1.478
  746    HG   LEU  90           HG       LEU  90  -2.684   4.372   1.594
  747   1HD1  LEU  90          HD12      LEU  90  -1.522   5.090  -1.086
  748   2HD1  LEU  90          HD11      LEU  90  -2.776   3.856  -0.978
  749   3HD1  LEU  90          HD13      LEU  90  -3.102   5.496  -0.418
  750   1HD2  LEU  90          HD23      LEU  90  -0.547   2.828   1.668
  751   2HD2  LEU  90          HD22      LEU  90  -2.049   2.208   0.982
  752   3HD2  LEU  90          HD21      LEU  90  -0.764   2.779  -0.082
  753    H    ASP  91           HN       ASP  91   0.450   5.835   4.661
  754    HA   ASP  91           HA       ASP  91   0.028   3.084   5.361
  755   1HB   ASP  91           HB2      ASP  91   2.076   3.916   6.100
  756   2HB   ASP  91           HB1      ASP  91   1.370   5.427   6.674
  757    NH1  ARG  92           NH2      ARG  92  -3.621   7.046  13.089
  758    NH2  ARG  92           NH1      ARG  92  -5.798   6.851  13.653
  759    H    ARG  92           HN       ARG  92  -0.965   6.061   7.108
  760    HA   ARG  92           HA       ARG  92  -2.808   4.462   8.752
  761   1HB   ARG  92           HB2      ARG  92  -1.567   6.241   9.847
  762   2HB   ARG  92           HB1      ARG  92  -2.192   7.428   8.703
  763   1HG   ARG  92           HG2      ARG  92  -3.440   7.500  10.833
  764   2HG   ARG  92           HG1      ARG  92  -4.482   7.013   9.503
  765   1HD   ARG  92           HD2      ARG  92  -4.396   4.720  10.139
  766   2HD   ARG  92           HD1      ARG  92  -3.060   4.991  11.254
  767    HE   ARG  92           HE       ARG  92  -5.875   5.228  11.831
  768   1HH1  ARG  92          HH21      ARG  92  -2.839   6.773  12.531
  769   2HH1  ARG  92          HH22      ARG  92  -3.497   7.710  13.826
  770   1HH2  ARG  92          HH11      ARG  92  -6.695   6.430  13.520
  771   2HH2  ARG  92          HH12      ARG  92  -5.661   7.512  14.391
  772    H    ASN  93           HN       ASN  93  -2.991   6.472   5.903
  773    HA   ASN  93           HA       ASN  93  -5.834   7.048   6.175
  774   1HB   ASN  93           HB2      ASN  93  -3.735   7.460   4.098
  775   2HB   ASN  93           HB1      ASN  93  -5.416   7.453   3.562
  776   1HD2  ASN  93          HD22      ASN  93  -4.039  10.536   5.864
  777   2HD2  ASN  93          HD21      ASN  93  -3.077   9.159   5.618
  778    H    LEU  94           HN       LEU  94  -3.928   4.552   4.530
  779    HA   LEU  94           HA       LEU  94  -6.013   3.470   2.937
  780   1HB   LEU  94           HB2      LEU  94  -3.535   2.885   2.865
  781   2HB   LEU  94           HB1      LEU  94  -3.837   1.833   4.249
  782    HG   LEU  94           HG       LEU  94  -5.579   0.646   2.928
  783   1HD1  LEU  94          HD12      LEU  94  -4.738   2.692   0.890
  784   2HD1  LEU  94          HD11      LEU  94  -5.351   1.125   0.364
  785   3HD1  LEU  94          HD13      LEU  94  -6.364   2.184   1.344
  786   1HD2  LEU  94          HD21      LEU  94  -2.733   0.618   2.519
  787   2HD2  LEU  94          HD23      LEU  94  -3.866  -0.731   2.433
  788   3HD2  LEU  94          HD22      LEU  94  -3.534   0.235   0.995
  789    CH2  TRP  95           CH2      TRP  95  -7.283  -0.290  12.850
  790    H    TRP  95           HN       TRP  95  -4.848   2.098   6.048
  791    HA   TRP  95           HA       TRP  95  -7.365   0.609   6.305
  792   1HB   TRP  95           HB2      TRP  95  -6.175  -0.725   7.641
  793   2HB   TRP  95           HB1      TRP  95  -4.765   0.238   7.205
  794    HD1  TRP  95           HD1      TRP  95  -4.223   2.344   8.829
  795    HE1  TRP  95           HE1      TRP  95  -4.540   2.585  11.378
  796    HE3  TRP  95           HE3      TRP  95  -7.579  -1.404   9.640
  797    HZ2  TRP  95           HZ2      TRP  95  -6.026   1.339  13.482
  798    HZ3  TRP  95           HZ3      TRP  95  -8.429  -1.860  11.923
  799    HH2  TRP  95           HH2      TRP  95  -7.653  -0.493  13.842
  800    H    GLY  96           HN       GLY  96  -6.258   3.688   7.268
  801   1HA   GLY  96           HA2      GLY  96  -7.550   4.048   9.760
  802   2HA   GLY  96           HA1      GLY  96  -7.305   5.339   8.579
  803    H    LEU  97           HN       LEU  97  -8.839   3.844   6.503
  804    HA   LEU  97           HA       LEU  97 -11.486   4.856   7.184
  805   1HB   LEU  97           HB2      LEU  97 -10.191   3.580   4.811
  806   2HB   LEU  97           HB1      LEU  97 -11.950   3.505   4.922
  807    HG   LEU  97           HG       LEU  97 -10.982   5.540   3.706
  808   1HD1  LEU  97          HD12      LEU  97 -12.945   5.562   5.962
  809   2HD1  LEU  97          HD11      LEU  97 -12.500   7.106   5.235
  810   3HD1  LEU  97          HD13      LEU  97 -13.214   5.836   4.241
  811   1HD2  LEU  97          HD22      LEU  97  -9.152   5.846   5.437
  812   2HD2  LEU  97          HD21      LEU  97 -10.057   7.310   5.055
  813   3HD2  LEU  97          HD23      LEU  97 -10.397   6.428   6.544
  814    H    ALA  98           HN       ALA  98  -9.913   1.718   7.032
  815    HA   ALA  98           HA       ALA  98 -12.051  -0.064   7.070
  816   1HB   ALA  98           HB2      ALA  98  -9.650  -0.721   7.088
  817   2HB   ALA  98           HB1      ALA  98  -9.552  -0.242   8.782
  818   3HB   ALA  98           HB3      ALA  98 -10.582  -1.593   8.304
  819    H    GLY  99           HN       GLY  99 -10.582   1.513   9.917
  820   1HA   GLY  99           HA2      GLY  99 -11.566   2.095  11.975
  821   2HA   GLY  99           HA1      GLY  99 -13.139   1.814  11.227
  822    H    LEU 100           HN       LEU 100 -10.665  -0.669  11.263
  823    HA   LEU 100           HA       LEU 100 -12.375  -2.215  13.169
  824   1HB   LEU 100           HB2      LEU 100 -11.707  -2.906  10.614
  825   2HB   LEU 100           HB1      LEU 100 -10.393  -3.665  11.514
  826    HG   LEU 100           HG       LEU 100 -12.404  -4.440  13.084
  827   1HD1  LEU 100          HD11      LEU 100 -13.937  -3.108  11.404
  828   2HD1  LEU 100          HD13      LEU 100 -13.776  -4.560  10.416
  829   3HD1  LEU 100          HD12      LEU 100 -14.473  -4.666  12.032
  830   1HD2  LEU 100          HD23      LEU 100 -10.810  -5.602  11.085
  831   2HD2  LEU 100          HD22      LEU 100 -11.757  -6.457  12.303
  832   3HD2  LEU 100          HD21      LEU 100 -12.454  -6.126  10.717
  833    H    ASN 101           HN       ASN 101 -10.302  -4.254  13.545
  834    HA   ASN 101           HA       ASN 101  -8.482  -2.667  15.299
  835   1HB   ASN 101           HB2      ASN 101  -8.654  -5.611  15.624
  836   2HB   ASN 101           HB1      ASN 101  -8.633  -4.343  16.850
  837   1HD2  ASN 101          HD22      ASN 101 -12.122  -5.988  16.080
  838   2HD2  ASN 101          HD21      ASN 101 -10.605  -6.724  15.885
  839    H    SER 102           HN       SER 102  -6.591  -4.811  15.669
  840    HA   SER 102           HA       SER 102  -4.759  -4.310  13.587
  841   1HB   SER 102           HB2      SER 102  -4.305  -5.378  15.868
  842   2HB   SER 102           HB1      SER 102  -4.845  -6.896  15.155
  843    HG   SER 102           HG       SER 102  -2.473  -5.677  14.939
  844    H    CYS 103           HN       CYS 103  -3.831  -6.303  12.226
  845    HA   CYS 103           HA       CYS 103  -6.019  -7.973  11.134
  846   1HB   CYS 103           HB2      CYS 103  -4.767  -7.053   8.831
  847   2HB   CYS 103           HB1      CYS 103  -6.349  -6.538   9.416
  848    HA   PRO 104           HA       PRO 104  -1.904 -10.036  11.675
  849   1HB   PRO 104           HB2      PRO 104  -3.455 -12.423  12.164
  850   2HB   PRO 104           HB1      PRO 104  -2.422 -11.538  13.293
  851   1HG   PRO 104           HG2      PRO 104  -5.298 -11.622  13.254
  852   2HG   PRO 104           HG1      PRO 104  -4.259 -10.713  14.358
  853   1HD   PRO 104           HD2      PRO 104  -5.897  -9.676  12.228
  854   2HD   PRO 104           HD1      PRO 104  -4.832  -8.768  13.322
  855    H    VAL 105           HN       VAL 105  -1.558  -9.872   9.384
  856    HA   VAL 105           HA       VAL 105  -3.033 -11.148   7.346
  857    HB   VAL 105           HB       VAL 105  -1.264  -9.599   6.762
  858   1HG1  VAL 105          HG12      VAL 105   0.216 -11.194   8.682
  859   2HG1  VAL 105          HG11      VAL 105   1.117 -11.037   7.174
  860   3HG1  VAL 105          HG13      VAL 105   0.591  -9.594   8.041
  861   1HG2  VAL 105          HG21      VAL 105  -1.750 -11.579   5.236
  862   2HG2  VAL 105          HG23      VAL 105  -0.166 -10.835   5.022
  863   3HG2  VAL 105          HG22      VAL 105  -0.313 -12.348   5.912
  864    H    LYS 106           HN       LYS 106  -3.184 -13.273   6.669
  865    HA   LYS 106           HA       LYS 106  -1.351 -15.237   7.978
  866   1HB   LYS 106           HB2      LYS 106  -4.329 -15.179   7.831
  867   2HB   LYS 106           HB1      LYS 106  -3.543 -16.749   7.664
  868   1HG   LYS 106           HG2      LYS 106  -2.230 -15.423   9.793
  869   2HG   LYS 106           HG1      LYS 106  -3.960 -15.194  10.052
  870   1HD   LYS 106           HD2      LYS 106  -3.888 -17.824   9.311
  871   2HD   LYS 106           HD1      LYS 106  -2.353 -17.668  10.166
  872   1HE   LYS 106           HE2      LYS 106  -4.877 -16.552  11.364
  873   2HE   LYS 106           HE1      LYS 106  -4.488 -18.262  11.540
  874   1HZ   LYS 106           HZ3      LYS 106  -2.183 -16.773  12.079
  875   2HZ   LYS 106           HZ2      LYS 106  -3.457 -16.097  12.977
  876   3HZ   LYS 106           HZ1      LYS 106  -3.077 -17.744  13.143
  877    H    GLU 107           HN       GLU 107  -3.969 -15.864   5.653
  878    HA   GLU 107           HA       GLU 107  -2.393 -17.531   4.000
  879   1HB   GLU 107           HB2      GLU 107  -4.887 -17.405   3.934
  880   2HB   GLU 107           HB1      GLU 107  -4.758 -15.831   3.147
  881   1HG   GLU 107           HG2      GLU 107  -3.446 -16.894   1.313
  882   2HG   GLU 107           HG1      GLU 107  -3.702 -18.464   2.074
  883    H    ALA 108           HN       ALA 108  -0.407 -16.644   3.391
  884    HA   ALA 108           HA       ALA 108  -0.502 -14.664   1.242
  885   1HB   ALA 108           HB1      ALA 108  -0.512 -13.220   3.249
  886   2HB   ALA 108           HB3      ALA 108   0.952 -14.019   3.823
  887   3HB   ALA 108           HB2      ALA 108   0.995 -13.054   2.348
  888    H    ASP 109           HN       ASP 109   1.165 -15.034  -0.157
  889    HA   ASP 109           HA       ASP 109   3.309 -16.904   0.761
  890   1HB   ASP 109           HB2      ASP 109   2.439 -16.346  -2.088
  891   2HB   ASP 109           HB1      ASP 109   3.494 -17.644  -1.529
  892    H    GLN 110           HN       GLN 110   5.412 -16.536  -0.600
  893    HA   GLN 110           HA       GLN 110   6.159 -13.732  -0.216
  894   1HB   GLN 110           HB2      GLN 110   7.527 -16.218  -0.295
  895   2HB   GLN 110           HB1      GLN 110   8.166 -15.250  -1.623
  896   1HG   GLN 110           HG2      GLN 110   9.457 -14.230  -0.073
  897   2HG   GLN 110           HG1      GLN 110   7.984 -13.424   0.461
  898   1HE2  GLN 110          HE22      GLN 110   7.526 -16.199   2.973
  899   2HE2  GLN 110          HE21      GLN 110   6.648 -15.710   1.605
  900    H    SER 111           HN       SER 111   5.182 -12.455  -1.775
  901    HA   SER 111           HA       SER 111   5.788 -13.159  -4.625
  902   1HB   SER 111           HB2      SER 111   3.441 -11.649  -3.443
  903   2HB   SER 111           HB1      SER 111   3.784 -11.726  -5.170
  904    HG   SER 111           HG       SER 111   3.734 -14.066  -4.884
  905    H    THR 112           HN       THR 112   6.995 -11.662  -5.734
  906    HA   THR 112           HA       THR 112   8.372  -9.578  -4.439
  907    HB   THR 112           HB       THR 112   9.078  -8.831  -6.591
  908    HG1  THR 112           HG1      THR 112   7.902  -9.424  -8.454
  909   1HG2  THR 112          HG23      THR 112   9.459 -11.334  -5.835
  910   2HG2  THR 112          HG22      THR 112   8.450 -11.683  -7.239
  911   3HG2  THR 112          HG21      THR 112   9.961 -10.797  -7.438
  912    H    LEU 113           HN       LEU 113   8.009  -7.361  -4.208
  913    HA   LEU 113           HA       LEU 113   5.338  -6.502  -3.844
  914   1HB   LEU 113           HB2      LEU 113   7.488  -5.467  -2.906
  915   2HB   LEU 113           HB1      LEU 113   7.618  -4.618  -4.448
  916    HG   LEU 113           HG       LEU 113   4.966  -4.231  -3.741
  917   1HD1  LEU 113          HD13      LEU 113   6.741  -4.224  -1.294
  918   2HD1  LEU 113          HD12      LEU 113   5.265  -3.263  -1.380
  919   3HD1  LEU 113          HD11      LEU 113   5.182  -5.020  -1.507
  920   1HD2  LEU 113          HD22      LEU 113   7.489  -2.631  -3.664
  921   2HD2  LEU 113          HD21      LEU 113   6.023  -2.372  -4.612
  922   3HD2  LEU 113          HD23      LEU 113   6.059  -1.934  -2.903
  923    H    GLU 114           HN       GLU 114   7.187  -6.701  -6.782
  924    HA   GLU 114           HA       GLU 114   5.971  -4.636  -8.293
  925   1HB   GLU 114           HB2      GLU 114   6.768  -7.404  -9.242
  926   2HB   GLU 114           HB1      GLU 114   6.517  -5.994 -10.270
  927   1HG   GLU 114           HG2      GLU 114   8.474  -4.977  -9.594
  928   2HG   GLU 114           HG1      GLU 114   8.442  -5.736  -8.002
  929    H    ASN 115           HN       ASN 115   4.992  -8.071  -8.127
  930    HA   ASN 115           HA       ASN 115   2.476  -7.612  -9.457
  931   1HB   ASN 115           HB2      ASN 115   3.456  -9.897  -7.724
  932   2HB   ASN 115           HB1      ASN 115   1.917  -9.911  -8.588
  933   1HD2  ASN 115          HD22      ASN 115   3.558 -11.185 -11.426
  934   2HD2  ASN 115          HD21      ASN 115   2.254 -11.299 -10.345
  935    H    PHE 116           HN       PHE 116   3.503  -7.118  -6.181
  936    HA   PHE 116           HA       PHE 116   0.932  -7.461  -4.915
  937   1HB   PHE 116           HB2      PHE 116   2.957  -7.413  -3.563
  938   2HB   PHE 116           HB1      PHE 116   3.343  -5.791  -4.137
  939    HD1  PHE 116           HD1      PHE 116   0.619  -7.702  -2.406
  940    HD2  PHE 116           HD2      PHE 116   2.608  -3.928  -2.922
  941    HE1  PHE 116           HE1      PHE 116  -0.750  -6.730  -0.581
  942    HE2  PHE 116           HE2      PHE 116   1.237  -2.958  -1.096
  943    HZ   PHE 116           HZ       PHE 116  -0.441  -4.359   0.074
  944    H    LEU 117           HN       LEU 117   2.695  -4.422  -5.566
  945    HA   LEU 117           HA       LEU 117   0.510  -2.681  -5.267
  946   1HB   LEU 117           HB2      LEU 117   3.183  -2.557  -6.473
  947   2HB   LEU 117           HB1      LEU 117   2.018  -1.493  -7.261
  948    HG   LEU 117           HG       LEU 117   1.397  -0.991  -4.681
  949   1HD1  LEU 117          HD11      LEU 117   3.837  -2.465  -4.559
  950   2HD1  LEU 117          HD13      LEU 117   4.199  -0.794  -4.129
  951   3HD1  LEU 117          HD12      LEU 117   2.970  -1.688  -3.234
  952   1HD2  LEU 117          HD22      LEU 117   3.012   0.254  -6.761
  953   2HD2  LEU 117          HD21      LEU 117   1.894   1.003  -5.620
  954   3HD2  LEU 117          HD23      LEU 117   3.570   0.717  -5.154
  955    H    GLU 118           HN       GLU 118   1.398  -4.772  -7.943
  956    HA   GLU 118           HA       GLU 118  -0.191  -3.573  -9.986
  957   1HB   GLU 118           HB2      GLU 118   1.463  -5.409 -10.356
  958   2HB   GLU 118           HB1      GLU 118   0.362  -6.524  -9.547
  959   1HG   GLU 118           HG2      GLU 118  -0.917  -6.735 -11.391
  960   2HG   GLU 118           HG1      GLU 118  -0.987  -4.988 -11.623
  961    NH1  ARG 119           NH2      ARG 119  -1.336  -9.225 -10.382
  962    NH2  ARG 119           NH1      ARG 119  -0.960 -11.448 -10.250
  963    H    ARG 119           HN       ARG 119  -0.985  -6.252  -7.765
  964    HA   ARG 119           HA       ARG 119  -3.781  -6.330  -8.501
  965   1HB   ARG 119           HB2      ARG 119  -2.496  -7.305  -5.928
  966   2HB   ARG 119           HB1      ARG 119  -4.041  -7.826  -6.601
  967   1HG   ARG 119           HG2      ARG 119  -1.630  -8.092  -8.337
  968   2HG   ARG 119           HG1      ARG 119  -1.790  -9.218  -6.996
  969   1HD   ARG 119           HD2      ARG 119  -4.100  -9.753  -7.779
  970   2HD   ARG 119           HD1      ARG 119  -3.834  -8.733  -9.189
  971    HE   ARG 119           HE       ARG 119  -2.963 -11.453  -8.848
  972   1HH1  ARG 119          HH21      ARG 119  -1.893  -8.425 -10.173
  973   2HH1  ARG 119          HH22      ARG 119  -0.537  -9.133 -10.976
  974   1HH2  ARG 119          HH11      ARG 119  -1.227 -12.355  -9.927
  975   2HH2  ARG 119          HH12      ARG 119  -0.169 -11.345 -10.853
  976    H    LEU 120           HN       LEU 120  -1.992  -4.099  -6.602
  977    HA   LEU 120           HA       LEU 120  -4.190  -3.463  -4.778
  978   1HB   LEU 120           HB2      LEU 120  -1.431  -2.870  -4.899
  979   2HB   LEU 120           HB1      LEU 120  -2.260  -1.327  -5.085
  980    HG   LEU 120           HG       LEU 120  -3.620  -2.781  -3.043
  981   1HD1  LEU 120          HD11      LEU 120  -0.643  -3.017  -3.016
  982   2HD1  LEU 120          HD13      LEU 120  -1.463  -2.702  -1.487
  983   3HD1  LEU 120          HD12      LEU 120  -1.864  -4.142  -2.421
  984   1HD2  LEU 120          HD23      LEU 120  -2.817  -0.204  -3.555
  985   2HD2  LEU 120          HD22      LEU 120  -3.497  -0.747  -2.025
  986   3HD2  LEU 120          HD21      LEU 120  -1.748  -0.650  -2.227
  987    H    LYS 121           HN       LYS 121  -2.836  -2.184  -7.783
  988    HA   LYS 121           HA       LYS 121  -4.587   0.127  -7.895
  989   1HB   LYS 121           HB2      LYS 121  -2.336  -0.307  -9.139
  990   2HB   LYS 121           HB1      LYS 121  -3.332  -1.188 -10.298
  991   1HG   LYS 121           HG2      LYS 121  -4.814   0.902 -10.381
  992   2HG   LYS 121           HG1      LYS 121  -3.500   1.735  -9.547
  993   1HD   LYS 121           HD2      LYS 121  -3.082   2.108 -11.855
  994   2HD   LYS 121           HD1      LYS 121  -1.969   0.819 -11.397
  995   1HE   LYS 121           HE2      LYS 121  -4.089  -0.686 -12.095
  996   2HE   LYS 121           HE1      LYS 121  -4.380   0.707 -13.137
  997   1HZ   LYS 121           HZ1      LYS 121  -1.870   0.442 -13.659
  998   2HZ   LYS 121           HZ3      LYS 121  -2.098  -1.145 -13.107
  999   3HZ   LYS 121           HZ2      LYS 121  -2.999  -0.569 -14.427
 1000    H    THR 122           HN       THR 122  -4.675  -3.173  -9.054
 1001    HA   THR 122           HA       THR 122  -6.989  -2.818 -10.760
 1002    HB   THR 122           HB       THR 122  -6.863  -5.530  -9.953
 1003    HG1  THR 122           HG1      THR 122  -4.500  -5.689 -10.583
 1004   1HG2  THR 122          HG22      THR 122  -7.126  -4.262 -12.241
 1005   2HG2  THR 122          HG21      THR 122  -5.375  -4.457 -12.323
 1006   3HG2  THR 122          HG23      THR 122  -6.417  -5.877 -12.211
 1007    H    ILE 123           HN       ILE 123  -6.591  -4.404  -7.603
 1008    HA   ILE 123           HA       ILE 123  -9.378  -4.781  -7.093
 1009    HB   ILE 123           HB       ILE 123  -7.080  -4.443  -5.153
 1010   1HG1  ILE 123          HG12      ILE 123  -6.761  -6.272  -6.808
 1011   2HG1  ILE 123          HG11      ILE 123  -6.991  -6.900  -5.176
 1012   1HG2  ILE 123          HG23      ILE 123  -9.892  -5.522  -4.841
 1013   2HG2  ILE 123          HG22      ILE 123  -8.606  -5.855  -3.681
 1014   3HG2  ILE 123          HG21      ILE 123  -9.142  -4.197  -3.952
 1015   1HD1  ILE 123          HD11      ILE 123  -9.413  -7.244  -5.694
 1016   2HD1  ILE 123          HD13      ILE 123  -9.099  -6.728  -7.350
 1017   3HD1  ILE 123          HD12      ILE 123  -8.351  -8.198  -6.729
 1018    H    MET 124           HN       MET 124  -7.297  -1.999  -6.729
 1019    HA   MET 124           HA       MET 124  -9.030  -0.623  -4.848
 1020   1HB   MET 124           HB2      MET 124  -6.630   0.133  -6.462
 1021   2HB   MET 124           HB1      MET 124  -7.609   1.397  -5.726
 1022   1HG   MET 124           HG2      MET 124  -6.875  -0.936  -4.021
 1023   2HG   MET 124           HG1      MET 124  -5.615   0.243  -4.384
 1024   1HE   MET 124           HE3      MET 124  -5.336   2.156  -3.900
 1025   2HE   MET 124           HE2      MET 124  -6.478   3.401  -3.415
 1026   3HE   MET 124           HE1      MET 124  -5.586   2.509  -2.186
 1027    NH1  ARG 125           NH2      ARG 125 -10.771   6.146  -9.915
 1028    NH2  ARG 125           NH1      ARG 125 -10.872   6.710 -12.100
 1029    H    ARG 125           HN       ARG 125  -8.413  -0.124  -8.341
 1030    HA   ARG 125           HA       ARG 125 -10.368   1.959  -8.562
 1031   1HB   ARG 125           HB2      ARG 125  -8.466   1.446 -10.175
 1032   2HB   ARG 125           HB1      ARG 125  -9.483   0.154 -10.816
 1033   1HG   ARG 125           HG2      ARG 125  -9.791   2.182 -12.153
 1034   2HG   ARG 125           HG1      ARG 125 -11.273   1.823 -11.268
 1035   1HD   ARG 125           HD2      ARG 125 -10.951   3.574  -9.752
 1036   2HD   ARG 125           HD1      ARG 125  -9.215   3.643 -10.049
 1037    HE   ARG 125           HE       ARG 125 -10.338   4.345 -12.485
 1038   1HH1  ARG 125          HH21      ARG 125 -10.627   5.471  -9.194
 1039   2HH1  ARG 125          HH22      ARG 125 -10.986   7.092  -9.672
 1040   1HH2  ARG 125          HH11      ARG 125 -10.807   6.462 -13.066
 1041   2HH2  ARG 125          HH12      ARG 125 -11.084   7.652 -11.839
 1042    H    GLU 126           HN       GLU 126 -10.635  -1.554  -9.003
 1043    HA   GLU 126           HA       GLU 126 -13.417  -1.241  -9.939
 1044   1HB   GLU 126           HB2      GLU 126 -11.621  -2.979 -10.739
 1045   2HB   GLU 126           HB1      GLU 126 -12.169  -3.895  -9.334
 1046   1HG   GLU 126           HG2      GLU 126 -14.566  -3.355 -10.267
 1047   2HG   GLU 126           HG1      GLU 126 -13.707  -3.097 -11.786
 1048    H    LYS 127           HN       LYS 127 -11.759  -2.381  -7.016
 1049    HA   LYS 127           HA       LYS 127 -14.319  -3.293  -5.880
 1050   1HB   LYS 127           HB2      LYS 127 -11.819  -4.240  -5.579
 1051   2HB   LYS 127           HB1      LYS 127 -11.901  -3.182  -4.170
 1052   1HG   LYS 127           HG2      LYS 127 -12.777  -5.177  -3.319
 1053   2HG   LYS 127           HG1      LYS 127 -14.239  -4.310  -3.795
 1054   1HD   LYS 127           HD2      LYS 127 -14.768  -6.062  -5.106
 1055   2HD   LYS 127           HD1      LYS 127 -13.379  -5.655  -6.114
 1056   1HE   LYS 127           HE2      LYS 127 -11.931  -7.044  -4.661
 1057   2HE   LYS 127           HE1      LYS 127 -13.337  -7.473  -3.686
 1058   1HZ   LYS 127           HZ1      LYS 127 -14.360  -8.395  -5.703
 1059   2HZ   LYS 127           HZ3      LYS 127 -12.939  -8.067  -6.567
 1060   3HZ   LYS 127           HZ2      LYS 127 -12.915  -9.188  -5.290
 1061    OH   TYR 128           OH       TYR 128 -12.926   5.569  -8.325
 1062    H    TYR 128           HN       TYR 128 -12.422  -0.374  -5.731
 1063    HA   TYR 128           HA       TYR 128 -13.500   0.395  -3.120
 1064   1HB   TYR 128           HB2      TYR 128 -12.144   2.249  -3.231
 1065   2HB   TYR 128           HB1      TYR 128 -11.283   1.191  -4.339
 1066    HD1  TYR 128           HD2      TYR 128 -12.774   1.273  -6.813
 1067    HD2  TYR 128           HD1      TYR 128 -12.048   4.437  -3.998
 1068    HE1  TYR 128           HE2      TYR 128 -13.095   2.949  -8.614
 1069    HE2  TYR 128           HE1      TYR 128 -12.369   6.111  -5.800
 1070    HH   TYR 128           HH       TYR 128 -13.851   5.825  -8.335
 1071    H    SER 129           HN       SER 129 -15.018   0.131  -6.042
 1072    HA   SER 129           HA       SER 129 -16.557   2.640  -5.830
 1073   1HB   SER 129           HB2      SER 129 -17.250   2.231  -7.980
 1074   2HB   SER 129           HB1      SER 129 -15.790   1.247  -7.996
 1075    HG   SER 129           HG       SER 129 -18.471   0.504  -7.895
 1076    H    LYS 130           HN       LYS 130 -16.698   0.225  -3.839
 1077    HA   LYS 130           HA       LYS 130 -19.649  -0.188  -4.072
 1078   1HB   LYS 130           HB2      LYS 130 -17.984  -2.196  -4.072
 1079   2HB   LYS 130           HB1      LYS 130 -17.853  -1.873  -2.342
 1080   1HG   LYS 130           HG2      LYS 130 -20.607  -1.777  -2.899
 1081   2HG   LYS 130           HG1      LYS 130 -20.002  -3.170  -3.797
 1082   1HD   LYS 130           HD2      LYS 130 -18.784  -3.846  -1.650
 1083   2HD   LYS 130           HD1      LYS 130 -19.769  -2.632  -0.832
 1084   1HE   LYS 130           HE2      LYS 130 -21.152  -4.602  -2.607
 1085   2HE   LYS 130           HE1      LYS 130 -20.592  -5.155  -1.028
 1086   1HZ   LYS 130           HZ2      LYS 130 -21.824  -2.643  -0.750
 1087   2HZ   LYS 130           HZ1      LYS 130 -22.871  -3.668  -1.609
 1088   3HZ   LYS 130           HZ3      LYS 130 -22.294  -4.133  -0.083
 1089    H    CYS 131           HN       CYS 131 -18.209   2.132  -2.822
 1090    HA   CYS 131           HA       CYS 131 -18.814   1.714   0.051
 1091   1HB   CYS 131           HB2      CYS 131 -16.701   2.880  -0.649
 1092   2HB   CYS 131           HB1      CYS 131 -17.694   4.179  -1.310
 1093    H    SER 132           HN       SER 132 -19.457   4.410  -2.226
 1094    HA   SER 132           HA       SER 132 -22.325   4.288  -1.660
 1095   1HB   SER 132           HB2      SER 132 -20.945   6.841  -0.858
 1096   2HB   SER 132           HB1      SER 132 -22.560   6.280  -0.435
 1097    HG   SER 132           HG       SER 132 -20.305   5.957   0.909
 1098    H    SER 133           HN       SER 133 -21.190   4.022  -4.094
 1099    HA   SER 133           HA       SER 133 -21.107   6.676  -5.403
 1100   1HB   SER 133           HB2      SER 133 -20.495   3.862  -6.289
 1101   2HB   SER 133           HB1      SER 133 -20.707   5.151  -7.472
 1102    HG   SER 133           HG       SER 133 -18.706   5.599  -7.028
   
  Start of MODEL          11
 Raw file had 1102 H/Q atoms
  Start of MODEL   11
    1   1H    GLU   1           HT1      GLU   1 -21.367  19.577   5.278
    2   2H    GLU   1           HT3      GLU   1 -19.825  20.257   5.092
    3   3H    GLU   1           HT2      GLU   1 -21.014  21.080   5.985
    4    HA   GLU   1           HA       GLU   1 -22.132  21.797   4.153
    5   1HB   GLU   1           HB2      GLU   1 -19.344  22.039   4.073
    6   2HB   GLU   1           HB1      GLU   1 -19.790  21.543   2.440
    7   1HG   GLU   1           HG2      GLU   1 -19.852  23.987   2.610
    8   2HG   GLU   1           HG1      GLU   1 -21.484  23.361   2.375
    9    H    ALA   2           HN       ALA   2 -19.978  19.172   3.002
   10    HA   ALA   2           HA       ALA   2 -22.265  18.225   1.325
   11   1HB   ALA   2           HB1      ALA   2 -19.397  18.706   0.593
   12   2HB   ALA   2           HB3      ALA   2 -20.265  17.385  -0.193
   13   3HB   ALA   2           HB2      ALA   2 -20.858  19.040  -0.337
   14    H    GLU   3           HN       GLU   3 -22.833  16.554   2.760
   15    HA   GLU   3           HA       GLU   3 -20.925  14.810   4.018
   16   1HB   GLU   3           HB2      GLU   3 -23.514  15.228   4.462
   17   2HB   GLU   3           HB1      GLU   3 -23.686  13.849   3.372
   18   1HG   GLU   3           HG2      GLU   3 -22.026  12.612   4.822
   19   2HG   GLU   3           HG1      GLU   3 -22.131  13.947   5.969
   20    H    ALA   4           HN       ALA   4 -20.206  12.746   3.381
   21    HA   ALA   4           HA       ALA   4 -21.003  11.816   0.663
   22   1HB   ALA   4           HB1      ALA   4 -18.641  13.149   1.068
   23   2HB   ALA   4           HB3      ALA   4 -18.143  11.473   1.305
   24   3HB   ALA   4           HB2      ALA   4 -18.906  11.961  -0.208
   25    H    HIS   5           HN       HIS   5 -20.338   9.513   0.306
   26    HA   HIS   5           HA       HIS   5 -21.089   7.844   2.488
   27   1HB   HIS   5           HB2      HIS   5 -19.524   7.162  -0.021
   28   2HB   HIS   5           HB1      HIS   5 -20.254   5.978   1.063
   29    HD1  HIS   5           HD1      HIS   5 -22.753   5.571   0.858
   30    HD2  HIS   5           HD2      HIS   5 -21.472   8.814  -1.428
   31    HE1  HIS   5           HE1      HIS   5 -24.722   6.254  -0.583
   32    H    LYS   6           HN       LYS   6 -19.259   5.822   2.780
   33    HA   LYS   6           HA       LYS   6 -17.055   7.241   4.177
   34   1HB   LYS   6           HB2      LYS   6 -18.277   4.499   4.482
   35   2HB   LYS   6           HB1      LYS   6 -16.718   4.894   5.207
   36   1HG   LYS   6           HG2      LYS   6 -18.145   5.468   6.945
   37   2HG   LYS   6           HG1      LYS   6 -18.032   7.011   6.100
   38   1HD   LYS   6           HD2      LYS   6 -20.250   6.986   5.744
   39   2HD   LYS   6           HD1      LYS   6 -20.086   5.479   4.843
   40   1HE   LYS   6           HE2      LYS   6 -19.860   4.595   7.430
   41   2HE   LYS   6           HE1      LYS   6 -21.009   5.920   7.606
   42   1HZ   LYS   6           HZ2      LYS   6 -22.301   4.942   5.778
   43   2HZ   LYS   6           HZ1      LYS   6 -21.229   3.625   5.736
   44   3HZ   LYS   6           HZ3      LYS   6 -22.179   3.898   7.114
   45    H    CYS   7           HN       CYS   7 -17.041   6.822   1.299
   46    HA   CYS   7           HA       CYS   7 -14.338   5.841   1.035
   47   1HB   CYS   7           HB2      CYS   7 -14.910   3.917  -0.496
   48   2HB   CYS   7           HB1      CYS   7 -15.330   3.648   1.196
   49    H    ASP   8           HN       ASP   8 -16.230   8.089   0.169
   50    HA   ASP   8           HA       ASP   8 -16.089   7.832  -2.771
   51   1HB   ASP   8           HB2      ASP   8 -17.708   9.325  -0.903
   52   2HB   ASP   8           HB1      ASP   8 -16.961  10.422  -2.065
   53    H    ILE   9           HN       ILE   9 -15.152  10.328  -0.400
   54    HA   ILE   9           HA       ILE   9 -13.110  11.323  -2.285
   55    HB   ILE   9           HB       ILE   9 -13.849  12.318   0.482
   56   1HG1  ILE   9          HG12      ILE   9 -14.816  13.114  -2.282
   57   2HG1  ILE   9          HG11      ILE   9 -15.791  12.447  -0.971
   58   1HG2  ILE   9          HG22      ILE   9 -11.596  12.973  -0.446
   59   2HG2  ILE   9          HG21      ILE   9 -12.440  13.724  -1.802
   60   3HG2  ILE   9          HG23      ILE   9 -12.682  14.334  -0.165
   61   1HD1  ILE   9          HD13      ILE   9 -14.968  14.495   0.395
   62   2HD1  ILE   9          HD12      ILE   9 -14.525  15.175  -1.170
   63   3HD1  ILE   9          HD11      ILE   9 -16.206  14.763  -0.831
   64    H    THR  10           HN       THR  10 -13.242   9.797   0.941
   65    HA   THR  10           HA       THR  10 -10.510  10.020   1.612
   66    HB   THR  10           HB       THR  10 -12.183   7.552   2.145
   67    HG1  THR  10           HG1      THR  10 -12.374   9.091   4.177
   68   1HG2  THR  10          HG23      THR  10  -9.739   7.538   2.736
   69   2HG2  THR  10          HG22      THR  10 -10.033   8.922   3.789
   70   3HG2  THR  10          HG21      THR  10 -10.801   7.373   4.134
   71    H    LEU  11           HN       LEU  11 -12.116   7.395  -0.220
   72    HA   LEU  11           HA       LEU  11  -9.584   6.103  -0.825
   73   1HB   LEU  11           HB2      LEU  11 -12.434   5.724  -1.674
   74   2HB   LEU  11           HB1      LEU  11 -11.151   4.963  -2.615
   75    HG   LEU  11           HG       LEU  11 -10.272   3.907  -0.560
   76   1HD1  LEU  11          HD13      LEU  11 -12.397   5.615   0.641
   77   2HD1  LEU  11          HD12      LEU  11 -12.159   4.019   1.351
   78   3HD1  LEU  11          HD11      LEU  11 -10.819   5.163   1.286
   79   1HD2  LEU  11          HD23      LEU  11 -13.097   3.474  -1.469
   80   2HD2  LEU  11          HD22      LEU  11 -11.696   2.416  -1.634
   81   3HD2  LEU  11          HD21      LEU  11 -12.511   2.563  -0.077
   82    H    GLN  12           HN       GLN  12 -11.336   8.748  -2.219
   83    HA   GLN  12           HA       GLN  12 -10.420   8.515  -4.926
   84   1HB   GLN  12           HB2      GLN  12 -12.234  10.040  -4.351
   85   2HB   GLN  12           HB1      GLN  12 -11.169  10.953  -3.282
   86   1HG   GLN  12           HG2      GLN  12 -10.204  12.077  -5.002
   87   2HG   GLN  12           HG1      GLN  12 -10.143  10.641  -6.025
   88   1HE2  GLN  12          HE22      GLN  12 -12.620  12.495  -7.860
   89   2HE2  GLN  12          HE21      GLN  12 -10.953  12.193  -7.768
   90    H    GLU  13           HN       GLU  13  -9.218  10.672  -2.332
   91    HA   GLU  13           HA       GLU  13  -6.805  11.347  -3.727
   92   1HB   GLU  13           HB2      GLU  13  -7.647  11.506  -0.831
   93   2HB   GLU  13           HB1      GLU  13  -6.022  11.968  -1.339
   94   1HG   GLU  13           HG2      GLU  13  -6.929  13.618  -2.889
   95   2HG   GLU  13           HG1      GLU  13  -8.575  13.107  -2.516
   96    H    ILE  14           HN       ILE  14  -7.604   8.824  -1.363
   97    HA   ILE  14           HA       ILE  14  -4.982   7.816  -0.928
   98    HB   ILE  14           HB       ILE  14  -7.716   6.936  -0.474
   99   1HG1  ILE  14          HG12      ILE  14  -5.194   5.949   0.857
  100   2HG1  ILE  14          HG11      ILE  14  -5.834   7.566   1.162
  101   1HG2  ILE  14          HG22      ILE  14  -5.683   4.835  -1.276
  102   2HG2  ILE  14          HG21      ILE  14  -7.181   4.492  -0.415
  103   3HG2  ILE  14          HG23      ILE  14  -7.240   5.153  -2.046
  104   1HD1  ILE  14          HD12      ILE  14  -8.027   5.777   1.332
  105   2HD1  ILE  14          HD11      ILE  14  -6.711   5.057   2.258
  106   3HD1  ILE  14          HD13      ILE  14  -7.274   6.683   2.645
  107    H    ILE  15           HN       ILE  15  -7.165   7.494  -3.643
  108    HA   ILE  15           HA       ILE  15  -5.746   5.271  -4.874
  109    HB   ILE  15           HB       ILE  15  -8.009   7.064  -5.544
  110   1HG1  ILE  15          HG12      ILE  15  -7.755   4.221  -6.453
  111   2HG1  ILE  15          HG11      ILE  15  -7.848   4.511  -4.715
  112   1HG2  ILE  15          HG21      ILE  15  -6.180   5.854  -7.619
  113   2HG2  ILE  15          HG23      ILE  15  -7.879   6.186  -7.957
  114   3HG2  ILE  15          HG22      ILE  15  -6.793   7.507  -7.527
  115   1HD1  ILE  15          HD11      ILE  15  -9.822   6.166  -5.628
  116   2HD1  ILE  15          HD13      ILE  15  -9.918   4.846  -6.792
  117   3HD1  ILE  15          HD12      ILE  15 -10.093   4.516  -5.069
  118    H    LYS  16           HN       LYS  16  -5.801   8.806  -5.267
  119    HA   LYS  16           HA       LYS  16  -4.075   9.009  -7.504
  120   1HB   LYS  16           HB2      LYS  16  -5.279  10.809  -5.798
  121   2HB   LYS  16           HB1      LYS  16  -3.572  11.010  -5.403
  122   1HG   LYS  16           HG2      LYS  16  -3.754  12.482  -7.184
  123   2HG   LYS  16           HG1      LYS  16  -3.304  11.009  -8.043
  124   1HD   LYS  16           HD2      LYS  16  -5.202  11.996  -9.183
  125   2HD   LYS  16           HD1      LYS  16  -5.751  10.530  -8.368
  126   1HE   LYS  16           HE2      LYS  16  -7.221  11.709  -7.138
  127   2HE   LYS  16           HE1      LYS  16  -5.938  12.772  -6.563
  128   1HZ   LYS  16           HZ2      LYS  16  -6.131  13.969  -8.721
  129   2HZ   LYS  16           HZ1      LYS  16  -7.520  13.048  -9.056
  130   3HZ   LYS  16           HZ3      LYS  16  -7.501  14.098  -7.725
  131    H    THR  17           HN       THR  17  -3.261   8.927  -4.036
  132    HA   THR  17           HA       THR  17  -0.409   8.925  -4.426
  133    HB   THR  17           HB       THR  17  -1.966   7.757  -2.099
  134    HG1  THR  17           HG1      THR  17  -2.515   9.727  -1.712
  135   1HG2  THR  17          HG21      THR  17   0.801   7.904  -2.681
  136   2HG2  THR  17          HG23      THR  17   0.486   9.115  -1.438
  137   3HG2  THR  17          HG22      THR  17   0.048   7.429  -1.158
  138    H    LEU  18           HN       LEU  18  -2.876   6.432  -4.324
  139    HA   LEU  18           HA       LEU  18  -1.249   4.144  -4.019
  140   1HB   LEU  18           HB2      LEU  18  -3.776   4.225  -3.998
  141   2HB   LEU  18           HB1      LEU  18  -3.740   4.419  -5.740
  142    HG   LEU  18           HG       LEU  18  -4.076   2.038  -4.624
  143   1HD1  LEU  18          HD13      LEU  18  -2.670   2.885  -7.107
  144   2HD1  LEU  18          HD12      LEU  18  -2.648   1.173  -6.697
  145   3HD1  LEU  18          HD11      LEU  18  -4.184   2.012  -6.907
  146   1HD2  LEU  18          HD22      LEU  18  -1.790   2.347  -3.434
  147   2HD2  LEU  18          HD21      LEU  18  -2.119   0.801  -4.215
  148   3HD2  LEU  18          HD23      LEU  18  -1.088   1.987  -5.011
  149    H    ASN  19           HN       ASN  19  -1.937   6.143  -6.844
  150    HA   ASN  19           HA       ASN  19  -0.483   4.316  -8.642
  151   1HB   ASN  19           HB2      ASN  19  -2.303   6.575  -8.925
  152   2HB   ASN  19           HB1      ASN  19  -0.901   6.731  -9.984
  153   1HD2  ASN  19          HD22      ASN  19  -2.564   4.587 -12.244
  154   2HD2  ASN  19          HD21      ASN  19  -1.872   6.114 -11.978
  155    H    SER  20           HN       SER  20   0.122   7.229  -6.798
  156    HA   SER  20           HA       SER  20   2.417   8.162  -8.227
  157   1HB   SER  20           HB2      SER  20   1.247   8.578  -5.530
  158   2HB   SER  20           HB1      SER  20   2.960   8.945  -5.698
  159    HG   SER  20           HG       SER  20   1.123   9.841  -7.629
  160    H    LEU  21           HN       LEU  21   2.056   5.792  -5.604
  161    HA   LEU  21           HA       LEU  21   4.938   5.398  -5.361
  162   1HB   LEU  21           HB2      LEU  21   2.775   4.837  -3.745
  163   2HB   LEU  21           HB1      LEU  21   3.209   3.242  -4.361
  164    HG   LEU  21           HG       LEU  21   5.625   3.820  -3.745
  165   1HD1  LEU  21          HD12      LEU  21   4.313   6.290  -3.088
  166   2HD1  LEU  21          HD11      LEU  21   4.996   5.599  -1.617
  167   3HD1  LEU  21          HD13      LEU  21   6.033   5.907  -3.009
  168   1HD2  LEU  21          HD21      LEU  21   3.984   2.360  -2.418
  169   2HD2  LEU  21          HD23      LEU  21   5.334   3.038  -1.508
  170   3HD2  LEU  21          HD22      LEU  21   3.734   3.767  -1.383
  171    H    THR  22           HN       THR  22   2.389   4.059  -7.330
  172    HA   THR  22           HA       THR  22   3.791   1.593  -7.960
  173    HB   THR  22           HB       THR  22   2.089   1.412  -9.783
  174    HG1  THR  22           HG1      THR  22   1.597   3.409 -10.376
  175   1HG2  THR  22          HG23      THR  22   1.265   2.043  -6.952
  176   2HG2  THR  22          HG22      THR  22   0.085   1.528  -8.158
  177   3HG2  THR  22          HG21      THR  22   1.424   0.465  -7.724
  178    H    GLU  23           HN       GLU  23   4.505   4.767  -8.806
  179    HA   GLU  23           HA       GLU  23   5.179   4.365 -11.591
  180   1HB   GLU  23           HB2      GLU  23   5.082   6.546  -9.822
  181   2HB   GLU  23           HB1      GLU  23   6.779   6.401 -10.281
  182   1HG   GLU  23           HG2      GLU  23   5.532   6.009 -12.690
  183   2HG   GLU  23           HG1      GLU  23   4.452   7.171 -11.920
  184    H    GLN  24           HN       GLN  24   6.943   4.115  -8.529
  185    HA   GLN  24           HA       GLN  24   9.223   2.912 -10.057
  186   1HB   GLN  24           HB2      GLN  24   9.167   4.665  -7.607
  187   2HB   GLN  24           HB1      GLN  24  10.520   3.568  -7.889
  188   1HG   GLN  24           HG2      GLN  24   9.833   5.024 -10.309
  189   2HG   GLN  24           HG1      GLN  24  10.204   6.127  -8.983
  190   1HE2  GLN  24          HE22      GLN  24  13.155   3.706 -10.478
  191   2HE2  GLN  24          HE21      GLN  24  11.534   3.397 -10.871
  192    H    LYS  25           HN       LYS  25   7.634   0.983  -9.733
  193    HA   LYS  25           HA       LYS  25   8.044  -0.201  -7.022
  194   1HB   LYS  25           HB2      LYS  25   6.205  -1.808  -7.784
  195   2HB   LYS  25           HB1      LYS  25   5.707  -0.140  -7.506
  196   1HG   LYS  25           HG2      LYS  25   5.634   0.341  -9.828
  197   2HG   LYS  25           HG1      LYS  25   6.552  -1.104 -10.241
  198   1HD   LYS  25           HD2      LYS  25   4.524  -2.336  -9.061
  199   2HD   LYS  25           HD1      LYS  25   3.670  -0.847  -9.472
  200   1HE   LYS  25           HE2      LYS  25   4.234  -1.106 -11.819
  201   2HE   LYS  25           HE1      LYS  25   5.248  -2.503 -11.459
  202   1HZ   LYS  25           HZ1      LYS  25   3.089  -3.432 -10.427
  203   2HZ   LYS  25           HZ3      LYS  25   2.314  -2.273 -11.395
  204   3HZ   LYS  25           HZ2      LYS  25   3.282  -3.470 -12.115
  205    H    THR  26           HN       THR  26  10.274  -0.763  -7.744
  206    HA   THR  26           HA       THR  26  10.360  -3.484  -8.755
  207    HB   THR  26           HB       THR  26  12.087  -2.550 -10.608
  208    HG1  THR  26           HG1      THR  26  11.606  -0.390 -10.166
  209   1HG2  THR  26          HG21      THR  26   9.841  -3.975 -10.681
  210   2HG2  THR  26          HG23      THR  26   9.195  -2.481 -11.359
  211   3HG2  THR  26          HG22      THR  26  10.539  -3.300 -12.153
  212    H    LEU  27           HN       LEU  27  12.209  -0.500  -8.156
  213    HA   LEU  27           HA       LEU  27  14.635  -1.969  -7.475
  214   1HB   LEU  27           HB2      LEU  27  14.330   0.510  -8.336
  215   2HB   LEU  27           HB1      LEU  27  14.140   0.866  -6.619
  216    HG   LEU  27           HG       LEU  27  16.351  -0.880  -6.804
  217   1HD1  LEU  27          HD13      LEU  27  16.142   1.041  -9.082
  218   2HD1  LEU  27          HD12      LEU  27  17.716   0.861  -8.309
  219   3HD1  LEU  27          HD11      LEU  27  16.916  -0.542  -9.017
  220   1HD2  LEU  27          HD22      LEU  27  15.871   2.021  -6.202
  221   2HD2  LEU  27          HD21      LEU  27  16.429   0.737  -5.130
  222   3HD2  LEU  27          HD23      LEU  27  17.533   1.439  -6.313
  223    H    CYS  28           HN       CYS  28  12.189  -0.154  -5.613
  224    HA   CYS  28           HA       CYS  28  13.328  -1.202  -3.096
  225   1HB   CYS  28           HB2      CYS  28  12.045   1.152  -3.704
  226   2HB   CYS  28           HB1      CYS  28  10.744   0.213  -2.972
  227    H    THR  29           HN       THR  29  10.911  -2.063  -5.394
  228    HA   THR  29           HA       THR  29   9.329  -3.626  -3.471
  229    HB   THR  29           HB       THR  29   7.940  -4.191  -5.387
  230    HG1  THR  29           HG1      THR  29   9.044  -4.424  -7.154
  231   1HG2  THR  29          HG22      THR  29   7.713  -1.931  -4.357
  232   2HG2  THR  29          HG21      THR  29   8.835  -1.302  -5.561
  233   3HG2  THR  29          HG23      THR  29   7.272  -1.946  -6.065
  234    H    GLU  30           HN       GLU  30  12.317  -4.167  -4.503
  235    HA   GLU  30           HA       GLU  30  11.992  -6.898  -5.547
  236   1HB   GLU  30           HB2      GLU  30  14.424  -6.885  -5.723
  237   2HB   GLU  30           HB1      GLU  30  13.802  -5.364  -6.360
  238   1HG   GLU  30           HG2      GLU  30  14.260  -4.279  -4.178
  239   2HG   GLU  30           HG1      GLU  30  14.932  -5.790  -3.578
  240    H    LEU  31           HN       LEU  31  10.923  -6.485  -2.894
  241    HA   LEU  31           HA       LEU  31  12.645  -8.352  -1.369
  242   1HB   LEU  31           HB2      LEU  31  11.140  -5.983  -0.197
  243   2HB   LEU  31           HB1      LEU  31  12.091  -7.158   0.709
  244    HG   LEU  31           HG       LEU  31  13.613  -5.952  -1.478
  245   1HD1  LEU  31          HD13      LEU  31  11.996  -4.227   0.260
  246   2HD1  LEU  31          HD12      LEU  31  13.720  -3.856   0.316
  247   3HD1  LEU  31          HD11      LEU  31  12.862  -3.831  -1.225
  248   1HD2  LEU  31          HD21      LEU  31  13.907  -6.384   1.493
  249   2HD2  LEU  31          HD23      LEU  31  14.814  -7.134   0.179
  250   3HD2  LEU  31          HD22      LEU  31  15.094  -5.442   0.590
  251    H    THR  32           HN       THR  32  11.354 -10.085  -1.739
  252    HA   THR  32           HA       THR  32   8.685 -10.386  -2.189
  253    HB   THR  32           HB       THR  32   8.860 -12.579  -0.890
  254    HG1  THR  32           HG1      THR  32  10.897 -13.067  -0.130
  255   1HG2  THR  32          HG21      THR  32  10.821 -11.769  -3.038
  256   2HG2  THR  32          HG23      THR  32  10.621 -13.440  -2.513
  257   3HG2  THR  32          HG22      THR  32   9.267 -12.577  -3.242
  258    H    VAL  33           HN       VAL  33   6.817 -10.939  -0.867
  259    HA   VAL  33           HA       VAL  33   6.863 -10.209   1.979
  260    HB   VAL  33           HB       VAL  33   4.966  -8.521   1.543
  261   1HG1  VAL  33          HG11      VAL  33   7.363  -7.990   2.198
  262   2HG1  VAL  33          HG13      VAL  33   7.688  -7.732   0.484
  263   3HG1  VAL  33          HG12      VAL  33   6.523  -6.709   1.325
  264   1HG2  VAL  33          HG22      VAL  33   4.714  -9.249  -0.867
  265   2HG2  VAL  33          HG21      VAL  33   4.890  -7.508  -0.651
  266   3HG2  VAL  33          HG23      VAL  33   6.262  -8.471  -1.199
  267    H    THR  34           HN       THR  34   4.639 -10.543   2.934
  268    HA   THR  34           HA       THR  34   3.527 -13.023   2.058
  269    HB   THR  34           HB       THR  34   2.874 -10.978   4.105
  270    HG1  THR  34           HG1      THR  34   3.718 -12.657   5.039
  271   1HG2  THR  34          HG23      THR  34   0.766 -12.764   2.870
  272   2HG2  THR  34          HG22      THR  34   0.631 -12.143   4.514
  273   3HG2  THR  34          HG21      THR  34   0.684 -11.026   3.152
  274    H    ASP  35           HN       ASP  35   2.317 -13.336   0.281
  275    HA   ASP  35           HA       ASP  35   1.016 -11.114  -1.107
  276   1HB   ASP  35           HB2      ASP  35   2.028 -13.447  -1.983
  277   2HB   ASP  35           HB1      ASP  35   0.352 -13.944  -1.773
  278    H    ILE  36           HN       ILE  36  -0.978 -10.376  -0.517
  279    HA   ILE  36           HA       ILE  36  -2.727 -12.209   1.045
  280    HB   ILE  36           HB       ILE  36  -3.709 -10.312   2.003
  281   1HG1  ILE  36          HG12      ILE  36  -2.870  -9.002  -0.563
  282   2HG1  ILE  36          HG11      ILE  36  -4.435  -8.960   0.248
  283   1HG2  ILE  36          HG23      ILE  36  -1.152 -10.604   2.373
  284   2HG2  ILE  36          HG22      ILE  36  -0.999  -9.158   1.376
  285   3HG2  ILE  36          HG21      ILE  36  -1.904  -9.094   2.889
  286   1HD1  ILE  36          HD12      ILE  36  -3.088  -7.687   2.127
  287   2HD1  ILE  36          HD11      ILE  36  -1.967  -7.350   0.807
  288   3HD1  ILE  36          HD13      ILE  36  -3.645  -6.820   0.699
  289    H    PHE  37           HN       PHE  37  -2.384 -12.301  -1.915
  290    HA   PHE  37           HA       PHE  37  -5.260 -11.926  -2.620
  291   1HB   PHE  37           HB2      PHE  37  -2.863 -11.231  -4.348
  292   2HB   PHE  37           HB1      PHE  37  -4.535 -11.238  -4.908
  293    HD1  PHE  37           HD2      PHE  37  -6.165  -9.956  -3.077
  294    HD2  PHE  37           HD1      PHE  37  -2.024  -9.126  -3.857
  295    HE1  PHE  37           HE2      PHE  37  -6.463  -7.653  -2.209
  296    HE2  PHE  37           HE1      PHE  37  -2.321  -6.821  -2.990
  297    HZ   PHE  37           HZ       PHE  37  -4.544  -6.085  -2.168
  298    H    ALA  38           HN       ALA  38  -3.723 -14.307  -1.773
  299    HA   ALA  38           HA       ALA  38  -3.238 -15.881  -4.185
  300   1HB   ALA  38           HB1      ALA  38  -1.985 -16.315  -2.100
  301   2HB   ALA  38           HB3      ALA  38  -3.489 -16.757  -1.293
  302   3HB   ALA  38           HB2      ALA  38  -2.877 -17.747  -2.617
  303    H    ALA  39           HN       ALA  39  -5.744 -15.838  -1.650
  304    HA   ALA  39           HA       ALA  39  -7.637 -16.989  -3.626
  305   1HB   ALA  39           HB3      ALA  39  -6.458 -18.511  -1.527
  306   2HB   ALA  39           HB2      ALA  39  -8.139 -18.219  -1.081
  307   3HB   ALA  39           HB1      ALA  39  -7.758 -18.997  -2.617
  308    H    SER  40           HN       SER  40  -9.692 -16.153  -3.379
  309    HA   SER  40           HA       SER  40 -10.243 -14.596  -0.890
  310   1HB   SER  40           HB2      SER  40 -10.876 -12.702  -2.061
  311   2HB   SER  40           HB1      SER  40  -9.608 -13.298  -3.127
  312    HG   SER  40           HG       SER  40 -11.078 -13.576  -4.591
  313    H    LYS  41           HN       LYS  41 -12.069 -15.366   0.040
  314    HA   LYS  41           HA       LYS  41 -14.119 -16.616  -1.747
  315   1HB   LYS  41           HB2      LYS  41 -12.906 -18.167  -0.146
  316   2HB   LYS  41           HB1      LYS  41 -13.652 -17.264   1.173
  317   1HG   LYS  41           HG2      LYS  41 -15.820 -17.760  -0.424
  318   2HG   LYS  41           HG1      LYS  41 -14.857 -19.215  -0.686
  319   1HD   LYS  41           HD2      LYS  41 -14.721 -18.685   2.084
  320   2HD   LYS  41           HD1      LYS  41 -16.412 -18.473   1.630
  321   1HE   LYS  41           HE2      LYS  41 -16.516 -20.736   1.838
  322   2HE   LYS  41           HE1      LYS  41 -15.773 -20.738   0.239
  323   1HZ   LYS  41           HZ1      LYS  41 -13.600 -20.523   1.647
  324   2HZ   LYS  41           HZ3      LYS  41 -14.553 -21.229   2.859
  325   3HZ   LYS  41           HZ2      LYS  41 -14.316 -22.041   1.385
  326    H    ASP  42           HN       ASP  42 -13.680 -14.875   1.345
  327    HA   ASP  42           HA       ASP  42 -16.136 -13.340   0.742
  328   1HB   ASP  42           HB2      ASP  42 -15.799 -15.230   3.052
  329   2HB   ASP  42           HB1      ASP  42 -16.764 -13.768   3.262
  330    H    THR  43           HN       THR  43 -13.737 -12.192   0.557
  331    HA   THR  43           HA       THR  43 -13.060 -10.990   3.186
  332    HB   THR  43           HB       THR  43 -11.556  -9.919   0.956
  333    HG1  THR  43           HG1      THR  43 -10.601 -12.277   0.855
  334   1HG2  THR  43          HG22      THR  43 -11.149 -10.504   3.593
  335   2HG2  THR  43          HG21      THR  43 -10.295 -11.836   2.814
  336   3HG2  THR  43          HG23      THR  43  -9.853 -10.170   2.443
  337    H    THR  44           HN       THR  44 -12.198  -8.458   2.269
  338    HA   THR  44           HA       THR  44 -14.471  -7.218   0.876
  339    HB   THR  44           HB       THR  44 -13.845  -6.026   3.538
  340    HG1  THR  44           HG1      THR  44 -15.527  -7.426   4.385
  341   1HG2  THR  44          HG21      THR  44 -16.065  -6.094   1.553
  342   2HG2  THR  44          HG23      THR  44 -16.504  -5.893   3.250
  343   3HG2  THR  44          HG22      THR  44 -15.423  -4.736   2.476
  344    H    GLU  45           HN       GLU  45 -14.084  -4.681   0.981
  345    HA   GLU  45           HA       GLU  45 -11.432  -4.256  -0.118
  346   1HB   GLU  45           HB2      GLU  45 -12.158  -1.957  -0.453
  347   2HB   GLU  45           HB1      GLU  45 -13.484  -3.033  -0.893
  348   1HG   GLU  45           HG2      GLU  45 -14.373  -2.734   1.461
  349   2HG   GLU  45           HG1      GLU  45 -13.168  -1.465   1.676
  350    H    LYS  46           HN       LYS  46 -13.087  -3.397   2.907
  351    HA   LYS  46           HA       LYS  46 -10.919  -1.839   3.983
  352   1HB   LYS  46           HB2      LYS  46 -12.089  -1.981   6.084
  353   2HB   LYS  46           HB1      LYS  46 -13.313  -1.847   4.822
  354   1HG   LYS  46           HG2      LYS  46 -13.283  -4.450   4.835
  355   2HG   LYS  46           HG1      LYS  46 -12.504  -4.276   6.407
  356   1HD   LYS  46           HD2      LYS  46 -15.130  -2.956   5.667
  357   2HD   LYS  46           HD1      LYS  46 -15.005  -4.483   6.541
  358   1HE   LYS  46           HE2      LYS  46 -13.644  -1.955   7.489
  359   2HE   LYS  46           HE1      LYS  46 -15.277  -2.399   7.989
  360   1HZ   LYS  46           HZ3      LYS  46 -13.325  -4.516   8.213
  361   2HZ   LYS  46           HZ2      LYS  46 -13.039  -3.189   9.234
  362   3HZ   LYS  46           HZ1      LYS  46 -14.518  -4.019   9.312
  363    H    GLU  47           HN       GLU  47 -11.690  -5.278   3.967
  364    HA   GLU  47           HA       GLU  47  -9.718  -6.043   5.935
  365   1HB   GLU  47           HB2      GLU  47 -11.607  -7.365   4.167
  366   2HB   GLU  47           HB1      GLU  47 -10.054  -8.202   4.169
  367   1HG   GLU  47           HG2      GLU  47 -10.860  -9.192   6.053
  368   2HG   GLU  47           HG1      GLU  47 -10.362  -7.691   6.832
  369    H    THR  48           HN       THR  48  -9.699  -5.793   2.388
  370    HA   THR  48           HA       THR  48  -6.994  -6.810   2.130
  371    HB   THR  48           HB       THR  48  -8.962  -5.463   0.318
  372    HG1  THR  48           HG1      THR  48  -7.374  -7.672  -0.301
  373   1HG2  THR  48          HG22      THR  48  -5.984  -5.695  -0.127
  374   2HG2  THR  48          HG21      THR  48  -7.126  -5.621  -1.470
  375   3HG2  THR  48          HG23      THR  48  -7.011  -4.276  -0.336
  376    H    PHE  49           HN       PHE  49  -8.338  -3.674   2.869
  377    HA   PHE  49           HA       PHE  49  -5.910  -2.230   2.100
  378   1HB   PHE  49           HB2      PHE  49  -8.405  -1.417   3.608
  379   2HB   PHE  49           HB1      PHE  49  -7.055  -0.318   3.337
  380    HD1  PHE  49           HD2      PHE  49  -6.216  -1.117   0.573
  381    HD2  PHE  49           HD1      PHE  49 -10.125  -0.540   2.266
  382    HE1  PHE  49           HE2      PHE  49  -7.115  -0.603  -1.675
  383    HE2  PHE  49           HE1      PHE  49 -11.019  -0.018   0.014
  384    HZ   PHE  49           HZ       PHE  49  -9.516  -0.051  -1.956
  385    H    CYS  50           HN       CYS  50  -7.218  -3.695   5.009
  386    HA   CYS  50           HA       CYS  50  -5.288  -2.382   6.769
  387   1HB   CYS  50           HB2      CYS  50  -7.403  -3.115   7.720
  388   2HB   CYS  50           HB1      CYS  50  -7.114  -4.771   7.180
  389    NH1  ARG  51           NH2      ARG  51  -7.815 -11.364   5.439
  390    NH2  ARG  51           NH1      ARG  51  -6.793 -12.744   6.907
  391    H    ARG  51           HN       ARG  51  -5.638  -5.638   5.336
  392    HA   ARG  51           HA       ARG  51  -3.250  -6.718   6.485
  393   1HB   ARG  51           HB2      ARG  51  -5.109  -7.442   4.299
  394   2HB   ARG  51           HB1      ARG  51  -3.467  -8.058   4.113
  395   1HG   ARG  51           HG2      ARG  51  -3.604  -9.397   5.985
  396   2HG   ARG  51           HG1      ARG  51  -4.736  -8.318   6.801
  397   1HD   ARG  51           HD2      ARG  51  -6.574  -9.095   5.499
  398   2HD   ARG  51           HD1      ARG  51  -5.511  -9.899   4.345
  399    HE   ARG  51           HE       ARG  51  -4.947 -11.138   6.763
  400   1HH1  ARG  51          HH21      ARG  51  -7.819 -10.542   4.873
  401   2HH1  ARG  51          HH22      ARG  51  -8.613 -11.967   5.442
  402   1HH2  ARG  51          HH11      ARG  51  -6.003 -12.980   7.473
  403   2HH2  ARG  51          HH12      ARG  51  -7.597 -13.338   6.899
  404    H    ALA  52           HN       ALA  52  -3.840  -5.271   3.262
  405    HA   ALA  52           HA       ALA  52  -1.090  -5.343   2.453
  406   1HB   ALA  52           HB1      ALA  52  -3.400  -3.587   1.581
  407   2HB   ALA  52           HB3      ALA  52  -1.814  -3.559   0.810
  408   3HB   ALA  52           HB2      ALA  52  -2.788  -5.028   0.768
  409    H    ALA  53           HN       ALA  53  -2.953  -3.104   4.413
  410    HA   ALA  53           HA       ALA  53  -1.079  -0.914   4.294
  411   1HB   ALA  53           HB3      ALA  53  -3.327  -1.695   6.134
  412   2HB   ALA  53           HB2      ALA  53  -2.230  -0.399   6.608
  413   3HB   ALA  53           HB1      ALA  53  -3.166  -0.260   5.121
  414    H    THR  54           HN       THR  54  -1.283  -3.863   6.201
  415    HA   THR  54           HA       THR  54   0.676  -3.089   8.181
  416    HB   THR  54           HB       THR  54  -0.165  -5.834   7.182
  417    HG1  THR  54           HG1      THR  54  -0.809  -4.548   9.612
  418   1HG2  THR  54          HG21      THR  54   1.725  -4.924   9.326
  419   2HG2  THR  54          HG23      THR  54   0.776  -6.389   9.580
  420   3HG2  THR  54          HG22      THR  54   1.877  -6.278   8.206
  421    H    VAL  55           HN       VAL  55   0.799  -4.892   5.116
  422    HA   VAL  55           HA       VAL  55   3.616  -5.369   5.096
  423    HB   VAL  55           HB       VAL  55   1.780  -4.874   2.725
  424   1HG1  VAL  55          HG12      VAL  55   4.462  -6.258   3.018
  425   2HG1  VAL  55          HG11      VAL  55   3.447  -6.376   1.580
  426   3HG1  VAL  55          HG13      VAL  55   4.110  -4.815   2.067
  427   1HG2  VAL  55          HG23      VAL  55   2.341  -7.299   4.432
  428   2HG2  VAL  55          HG22      VAL  55   0.782  -6.646   3.928
  429   3HG2  VAL  55          HG21      VAL  55   1.812  -7.471   2.759
  430    H    LEU  56           HN       LEU  56   1.669  -2.547   4.358
  431    HA   LEU  56           HA       LEU  56   3.704  -1.048   2.979
  432   1HB   LEU  56           HB2      LEU  56   1.099  -0.419   4.329
  433   2HB   LEU  56           HB1      LEU  56   2.195   0.911   3.955
  434    HG   LEU  56           HG       LEU  56   1.812  -1.034   1.762
  435   1HD1  LEU  56          HD13      LEU  56  -0.453   0.465   3.014
  436   2HD1  LEU  56          HD12      LEU  56  -0.382   0.396   1.254
  437   3HD1  LEU  56          HD11      LEU  56  -0.462  -1.095   2.192
  438   1HD2  LEU  56          HD23      LEU  56   1.851   1.971   2.096
  439   2HD2  LEU  56          HD22      LEU  56   3.077   0.951   1.343
  440   3HD2  LEU  56          HD21      LEU  56   1.521   1.193   0.549
  441    NH1  ARG  57           NH2      ARG  57   1.384   0.042  12.753
  442    NH2  ARG  57           NH1      ARG  57   1.261   2.176  12.022
  443    H    ARG  57           HN       ARG  57   2.734  -1.379   6.372
  444    HA   ARG  57           HA       ARG  57   4.362   0.647   7.495
  445   1HB   ARG  57           HB2      ARG  57   2.686  -0.661   8.787
  446   2HB   ARG  57           HB1      ARG  57   3.725  -2.081   8.668
  447   1HG   ARG  57           HG2      ARG  57   5.319  -1.208  10.114
  448   2HG   ARG  57           HG1      ARG  57   4.886   0.461   9.746
  449   1HD   ARG  57           HD2      ARG  57   2.850  -1.284  11.080
  450   2HD   ARG  57           HD1      ARG  57   4.170  -0.631  12.049
  451    HE   ARG  57           HE       ARG  57   3.206   1.566  10.658
  452   1HH1  ARG  57          HH21      ARG  57   1.815  -0.859  12.748
  453   2HH1  ARG  57          HH22      ARG  57   0.592   0.208  13.340
  454   1HH2  ARG  57          HH11      ARG  57   1.605   2.919  11.448
  455   2HH2  ARG  57          HH12      ARG  57   0.472   2.326  12.616
  456    H    GLN  58           HN       GLN  58   5.116  -2.834   7.067
  457    HA   GLN  58           HA       GLN  58   7.841  -2.661   7.842
  458   1HB   GLN  58           HB2      GLN  58   6.230  -4.702   7.059
  459   2HB   GLN  58           HB1      GLN  58   7.210  -4.507   5.605
  460   1HG   GLN  58           HG2      GLN  58   9.222  -4.446   7.275
  461   2HG   GLN  58           HG1      GLN  58   8.092  -5.208   8.394
  462   1HE2  GLN  58          HE22      GLN  58   8.405  -8.369   6.890
  463   2HE2  GLN  58          HE21      GLN  58   7.887  -7.449   8.220
  464    H    PHE  59           HN       PHE  59   6.222  -1.783   4.860
  465    HA   PHE  59           HA       PHE  59   8.423  -1.681   3.086
  466   1HB   PHE  59           HB2      PHE  59   5.860  -1.194   2.720
  467   2HB   PHE  59           HB1      PHE  59   6.323   0.471   3.067
  468    HD1  PHE  59           HD2      PHE  59   8.625   1.190   1.817
  469    HD2  PHE  59           HD1      PHE  59   5.874  -1.828   0.484
  470    HE1  PHE  59           HE2      PHE  59   9.471   1.440  -0.499
  471    HE2  PHE  59           HE1      PHE  59   6.719  -1.576  -1.833
  472    HZ   PHE  59           HZ       PHE  59   8.518   0.058  -2.325
  473    OH   TYR  60           OH       TYR  60   6.797   4.248  11.081
  474    H    TYR  60           HN       TYR  60   7.114   0.970   5.122
  475    HA   TYR  60           HA       TYR  60   9.565   2.530   4.619
  476   1HB   TYR  60           HB2      TYR  60   8.303   4.337   5.135
  477   2HB   TYR  60           HB1      TYR  60   6.935   3.232   5.032
  478    HD1  TYR  60           HD2      TYR  60   6.266   1.955   7.178
  479    HD2  TYR  60           HD1      TYR  60   8.830   5.400   7.168
  480    HE1  TYR  60           HE2      TYR  60   5.804   2.306   9.590
  481    HE2  TYR  60           HE1      TYR  60   8.366   5.753   9.579
  482    HH   TYR  60           HH       TYR  60   7.376   4.946  11.396
  483    H    SER  61           HN       SER  61   8.931   0.045   6.700
  484    HA   SER  61           HA       SER  61  10.157   1.293   9.077
  485   1HB   SER  61           HB2      SER  61   8.440  -0.935   8.613
  486   2HB   SER  61           HB1      SER  61   9.921  -1.541   9.349
  487    HG   SER  61           HG       SER  61   9.341  -0.627  11.144
  488    H    HIS  62           HN       HIS  62  10.886  -1.623   7.098
  489    HA   HIS  62           HA       HIS  62  13.674  -1.509   8.063
  490   1HB   HIS  62           HB2      HIS  62  11.963  -3.589   7.341
  491   2HB   HIS  62           HB1      HIS  62  13.120  -3.509   6.013
  492    HD1  HIS  62           HD1      HIS  62  13.139  -5.859   8.087
  493    HD2  HIS  62           HD2      HIS  62  15.556  -2.471   8.334
  494    HE1  HIS  62           HE1      HIS  62  15.129  -6.501   9.513
  495    H    HIS  63           HN       HIS  63  11.893  -1.059   5.015
  496    HA   HIS  63           HA       HIS  63  14.400  -0.667   3.530
  497   1HB   HIS  63           HB2      HIS  63  11.618  -0.043   2.533
  498   2HB   HIS  63           HB1      HIS  63  13.050  -0.455   1.588
  499    HD1  HIS  63           HD1      HIS  63  14.007  -2.911   3.227
  500    HD2  HIS  63           HD2      HIS  63  10.063  -2.311   2.016
  501    HE1  HIS  63           HE1      HIS  63  12.909  -5.193   3.204
  502    H    GLU  64           HN       GLU  64  12.995   1.282   5.732
  503    HA   GLU  64           HA       GLU  64  12.921   3.771   4.199
  504   1HB   GLU  64           HB2      GLU  64  11.545   4.073   6.002
  505   2HB   GLU  64           HB1      GLU  64  12.450   2.943   7.010
  506   1HG   GLU  64           HG2      GLU  64  14.132   4.572   7.493
  507   2HG   GLU  64           HG1      GLU  64  13.536   5.658   6.237
  508    H    LYS  65           HN       LYS  65  15.135   2.214   6.505
  509    HA   LYS  65           HA       LYS  65  17.241   4.134   5.599
  510   1HB   LYS  65           HB2      LYS  65  16.590   4.548   7.954
  511   2HB   LYS  65           HB1      LYS  65  16.954   2.866   8.341
  512   1HG   LYS  65           HG2      LYS  65  19.241   3.163   8.127
  513   2HG   LYS  65           HG1      LYS  65  19.065   4.499   6.990
  514   1HD   LYS  65           HD2      LYS  65  18.106   5.860   8.909
  515   2HD   LYS  65           HD1      LYS  65  18.621   4.557   9.982
  516   1HE   LYS  65           HE2      LYS  65  20.691   5.478   8.092
  517   2HE   LYS  65           HE1      LYS  65  20.199   6.681   9.284
  518   1HZ   LYS  65           HZ1      LYS  65  20.565   4.041  10.371
  519   2HZ   LYS  65           HZ3      LYS  65  21.982   4.703   9.717
  520   3HZ   LYS  65           HZ2      LYS  65  21.140   5.538  10.933
  521    H    ASP  66           HN       ASP  66  17.801   2.531   3.958
  522    HA   ASP  66           HA       ASP  66  19.766   0.611   4.917
  523   1HB   ASP  66           HB2      ASP  66  17.281  -0.409   5.014
  524   2HB   ASP  66           HB1      ASP  66  17.628  -0.710   3.311
  525    H    THR  67           HN       THR  67  21.261   0.250   3.301
  526    HA   THR  67           HA       THR  67  21.193   1.830   0.929
  527    HB   THR  67           HB       THR  67  23.087   0.233   0.206
  528    HG1  THR  67           HG1      THR  67  23.218  -1.497   1.356
  529   1HG2  THR  67          HG23      THR  67  23.324   2.447   1.418
  530   2HG2  THR  67          HG22      THR  67  23.389   1.529   2.923
  531   3HG2  THR  67          HG21      THR  67  24.636   1.301   1.696
  532    NH1  ARG  68           NH2      ARG  68  19.269  -6.620  -2.098
  533    NH2  ARG  68           NH1      ARG  68  17.027  -6.856  -1.928
  534    H    ARG  68           HN       ARG  68  19.741  -1.235   1.621
  535    HA   ARG  68           HA       ARG  68  19.727  -2.498  -0.887
  536   1HB   ARG  68           HB2      ARG  68  17.611  -2.341   1.270
  537   2HB   ARG  68           HB1      ARG  68  17.452  -3.377  -0.149
  538   1HG   ARG  68           HG2      ARG  68  19.937  -3.490   1.549
  539   2HG   ARG  68           HG1      ARG  68  18.493  -4.392   2.014
  540   1HD   ARG  68           HD2      ARG  68  19.965  -4.613  -0.629
  541   2HD   ARG  68           HD1      ARG  68  19.953  -5.817   0.660
  542    HE   ARG  68           HE       ARG  68  17.272  -5.449   0.064
  543   1HH1  ARG  68          HH21      ARG  68  20.135  -6.253  -1.764
  544   2HH1  ARG  68          HH22      ARG  68  19.257  -7.188  -2.921
  545   1HH2  ARG  68          HH11      ARG  68  16.167  -6.665  -1.455
  546   2HH2  ARG  68          HH12      ARG  68  17.031  -7.423  -2.751
  547    H    CYS  69           HN       CYS  69  17.518   0.040   0.322
  548    HA   CYS  69           HA       CYS  69  16.226   0.175  -2.329
  549   1HB   CYS  69           HB2      CYS  69  15.001   0.400  -0.076
  550   2HB   CYS  69           HB1      CYS  69  15.704   2.017   0.005
  551    H    LEU  70           HN       LEU  70  18.443   2.069  -0.328
  552    HA   LEU  70           HA       LEU  70  18.400   4.477  -1.831
  553   1HB   LEU  70           HB2      LEU  70  20.782   3.216  -0.436
  554   2HB   LEU  70           HB1      LEU  70  20.627   4.912  -0.896
  555    HG   LEU  70           HG       LEU  70  18.844   3.436   1.064
  556   1HD1  LEU  70          HD13      LEU  70  21.307   5.019   1.314
  557   2HD1  LEU  70          HD12      LEU  70  19.995   5.589   2.345
  558   3HD1  LEU  70          HD11      LEU  70  20.555   3.921   2.471
  559   1HD2  LEU  70          HD21      LEU  70  18.754   6.165  -0.190
  560   2HD2  LEU  70          HD23      LEU  70  17.429   5.049   0.140
  561   3HD2  LEU  70          HD22      LEU  70  18.170   5.955   1.460
  562    H    GLY  71           HN       GLY  71  21.054   2.076  -2.035
  563   1HA   GLY  71           HA2      GLY  71  21.675   1.031  -4.173
  564   2HA   GLY  71           HA1      GLY  71  20.997   2.436  -4.998
  565    H    ALA  72           HN       ALA  72  22.548   3.737  -5.816
  566    HA   ALA  72           HA       ALA  72  24.809   4.569  -4.146
  567   1HB   ALA  72           HB2      ALA  72  25.113   2.684  -6.455
  568   2HB   ALA  72           HB1      ALA  72  26.354   3.912  -6.203
  569   3HB   ALA  72           HB3      ALA  72  26.003   2.739  -4.932
  570    H    THR  73           HN       THR  73  22.970   6.286  -4.894
  571    HA   THR  73           HA       THR  73  24.329   7.950  -6.909
  572    HB   THR  73           HB       THR  73  21.773   8.271  -7.799
  573    HG1  THR  73           HG1      THR  73  21.020   6.085  -8.078
  574   1HG2  THR  73          HG22      THR  73  24.182   7.437  -8.825
  575   2HG2  THR  73          HG21      THR  73  23.155   6.032  -9.113
  576   3HG2  THR  73          HG23      THR  73  22.696   7.607  -9.760
  577    H    ALA  74           HN       ALA  74  23.859  10.162  -6.617
  578    HA   ALA  74           HA       ALA  74  22.897  10.917  -4.007
  579   1HB   ALA  74           HB1      ALA  74  24.583  12.177  -5.456
  580   2HB   ALA  74           HB3      ALA  74  23.202  12.760  -6.387
  581   3HB   ALA  74           HB2      ALA  74  23.349  13.167  -4.677
  582    H    GLN  75           HN       GLN  75  21.426  10.785  -7.210
  583    HA   GLN  75           HA       GLN  75  19.070  12.304  -6.537
  584   1HB   GLN  75           HB2      GLN  75  19.669  10.260  -8.685
  585   2HB   GLN  75           HB1      GLN  75  18.100  11.054  -8.548
  586   1HG   GLN  75           HG2      GLN  75  20.735  12.534  -8.780
  587   2HG   GLN  75           HG1      GLN  75  19.662  12.205 -10.141
  588   1HE2  GLN  75          HE22      GLN  75  18.947  15.511  -8.179
  589   2HE2  GLN  75          HE21      GLN  75  20.453  14.764  -8.411
  590    H    GLN  76           HN       GLN  76  20.004   8.946  -6.111
  591    HA   GLN  76           HA       GLN  76  17.328   7.985  -5.534
  592   1HB   GLN  76           HB2      GLN  76  20.091   6.866  -5.029
  593   2HB   GLN  76           HB1      GLN  76  18.625   6.024  -4.527
  594   1HG   GLN  76           HG2      GLN  76  19.217   6.916  -7.364
  595   2HG   GLN  76           HG1      GLN  76  19.428   5.272  -6.763
  596   1HE2  GLN  76          HE22      GLN  76  15.857   4.714  -6.447
  597   2HE2  GLN  76          HE21      GLN  76  17.320   4.348  -5.669
  598    H    PHE  77           HN       PHE  77  19.758   9.657  -3.683
  599    HA   PHE  77           HA       PHE  77  18.799   8.771  -1.084
  600   1HB   PHE  77           HB2      PHE  77  20.766  10.755  -2.108
  601   2HB   PHE  77           HB1      PHE  77  20.092  11.066  -0.508
  602    HD1  PHE  77           HD2      PHE  77  20.281   9.322   1.288
  603    HD2  PHE  77           HD1      PHE  77  22.310   8.963  -2.481
  604    HE1  PHE  77           HE2      PHE  77  21.775   7.596   2.257
  605    HE2  PHE  77           HE1      PHE  77  23.804   7.237  -1.512
  606    HZ   PHE  77           HZ       PHE  77  23.536   6.554   0.858
  607    H    HIS  78           HN       HIS  78  18.350  11.726  -3.047
  608    HA   HIS  78           HA       HIS  78  16.553  12.923  -1.103
  609   1HB   HIS  78           HB2      HIS  78  17.912  14.226  -2.772
  610   2HB   HIS  78           HB1      HIS  78  16.851  13.610  -4.039
  611    HD1  HIS  78           HD1      HIS  78  14.215  14.195  -3.695
  612    HD2  HIS  78           HD2      HIS  78  16.906  16.451  -1.447
  613    HE1  HIS  78           HE1      HIS  78  12.946  16.234  -2.892
  614    NH1  ARG  79           NH2      ARG  79  13.331  10.371 -10.245
  615    NH2  ARG  79           NH1      ARG  79  14.840   8.690 -10.248
  616    H    ARG  79           HN       ARG  79  16.166  10.823  -3.891
  617    HA   ARG  79           HA       ARG  79  13.280  11.248  -4.059
  618   1HB   ARG  79           HB2      ARG  79  14.949  10.423  -5.913
  619   2HB   ARG  79           HB1      ARG  79  14.665   8.837  -5.196
  620   1HG   ARG  79           HG2      ARG  79  12.616   8.694  -6.127
  621   2HG   ARG  79           HG1      ARG  79  12.175  10.300  -5.546
  622   1HD   ARG  79           HD2      ARG  79  12.113  10.337  -7.967
  623   2HD   ARG  79           HD1      ARG  79  13.511  11.276  -7.442
  624    HE   ARG  79           HE       ARG  79  14.523   8.724  -7.816
  625   1HH1  ARG  79          HH21      ARG  79  12.717  10.991  -9.760
  626   2HH1  ARG  79          HH22      ARG  79  13.401  10.423 -11.241
  627   1HH2  ARG  79          HH11      ARG  79  15.390   8.014  -9.756
  628   2HH2  ARG  79          HH12      ARG  79  14.899   8.753 -11.244
  629    H    HIS  80           HN       HIS  80  15.441   9.047  -2.391
  630    HA   HIS  80           HA       HIS  80  13.402   7.100  -1.712
  631   1HB   HIS  80           HB2      HIS  80  15.792   6.516  -1.677
  632   2HB   HIS  80           HB1      HIS  80  16.072   7.701  -0.401
  633    HD1  HIS  80           HD1      HIS  80  13.655   4.780  -0.920
  634    HD2  HIS  80           HD2      HIS  80  16.019   6.484   2.061
  635    HE1  HIS  80           HE1      HIS  80  13.336   3.353   1.149
  636    H    LYS  81           HN       LYS  81  14.914   9.816   0.050
  637    HA   LYS  81           HA       LYS  81  13.531   9.529   2.491
  638   1HB   LYS  81           HB2      LYS  81  15.130  11.533   1.213
  639   2HB   LYS  81           HB1      LYS  81  13.707  12.315   1.903
  640   1HG   LYS  81           HG2      LYS  81  14.357  11.892   4.043
  641   2HG   LYS  81           HG1      LYS  81  14.962  10.284   3.644
  642   1HD   LYS  81           HD2      LYS  81  16.864  11.566   2.403
  643   2HD   LYS  81           HD1      LYS  81  16.360  12.937   3.393
  644   1HE   LYS  81           HE2      LYS  81  16.979  11.902   5.387
  645   2HE   LYS  81           HE1      LYS  81  16.831  10.280   4.707
  646   1HZ   LYS  81           HZ2      LYS  81  18.745  11.288   3.166
  647   2HZ   LYS  81           HZ1      LYS  81  19.056  12.142   4.601
  648   3HZ   LYS  81           HZ3      LYS  81  19.060  10.446   4.607
  649    H    GLN  82           HN       GLN  82  12.403  10.736  -0.601
  650    HA   GLN  82           HA       GLN  82   9.975  11.932   0.495
  651   1HB   GLN  82           HB2      GLN  82  11.035  12.670  -1.657
  652   2HB   GLN  82           HB1      GLN  82  10.576  11.122  -2.365
  653   1HG   GLN  82           HG2      GLN  82   8.210  11.967  -1.233
  654   2HG   GLN  82           HG1      GLN  82   8.919  13.481  -1.797
  655   1HE2  GLN  82          HE22      GLN  82   7.418  10.867  -4.488
  656   2HE2  GLN  82          HE21      GLN  82   7.288  10.608  -2.816
  657    H    LEU  83           HN       LEU  83  10.889   8.843  -0.967
  658    HA   LEU  83           HA       LEU  83   8.263   7.774  -1.285
  659   1HB   LEU  83           HB2      LEU  83  10.343   6.761  -2.234
  660   2HB   LEU  83           HB1      LEU  83  10.804   6.262  -0.606
  661    HG   LEU  83           HG       LEU  83   8.058   5.511  -1.369
  662   1HD1  LEU  83          HD12      LEU  83  10.436   4.707  -2.992
  663   2HD1  LEU  83          HD11      LEU  83   9.237   3.469  -2.619
  664   3HD1  LEU  83          HD13      LEU  83   8.759   4.924  -3.491
  665   1HD2  LEU  83          HD21      LEU  83  10.458   4.068  -0.199
  666   2HD2  LEU  83          HD23      LEU  83   9.085   4.721   0.693
  667   3HD2  LEU  83          HD22      LEU  83   8.861   3.344  -0.387
  668    H    ILE  84           HN       ILE  84  10.375   8.036   1.522
  669    HA   ILE  84           HA       ILE  84   8.893   6.217   3.203
  670    HB   ILE  84           HB       ILE  84  10.538   8.591   4.112
  671   1HG1  ILE  84          HG12      ILE  84  11.999   7.471   2.629
  672   2HG1  ILE  84          HG11      ILE  84  12.378   6.763   4.199
  673   1HG2  ILE  84          HG22      ILE  84   9.080   6.649   5.504
  674   2HG2  ILE  84          HG21      ILE  84  10.751   6.092   5.590
  675   3HG2  ILE  84          HG23      ILE  84  10.328   7.701   6.174
  676   1HD1  ILE  84          HD11      ILE  84  10.633   4.965   3.622
  677   2HD1  ILE  84          HD13      ILE  84  10.719   5.578   1.972
  678   3HD1  ILE  84          HD12      ILE  84  12.157   4.905   2.738
  679    NH1  ARG  85           NH2      ARG  85  10.678  15.204   3.073
  680    NH2  ARG  85           NH1      ARG  85  12.123  14.187   4.478
  681    H    ARG  85           HN       ARG  85   8.766   9.751   2.744
  682    HA   ARG  85           HA       ARG  85   6.784  10.237   4.751
  683   1HB   ARG  85           HB2      ARG  85   7.973  11.714   2.494
  684   2HB   ARG  85           HB1      ARG  85   6.321  12.192   2.882
  685   1HG   ARG  85           HG2      ARG  85   6.883  12.852   5.059
  686   2HG   ARG  85           HG1      ARG  85   8.344  11.864   5.084
  687   1HD   ARG  85           HD2      ARG  85   8.554  13.731   2.922
  688   2HD   ARG  85           HD1      ARG  85   8.104  14.616   4.379
  689    HE   ARG  85           HE       ARG  85  10.147  12.931   5.213
  690   1HH1  ARG  85          HH21      ARG  85   9.756  15.327   2.706
  691   2HH1  ARG  85          HH22      ARG  85  11.429  15.758   2.717
  692   1HH2  ARG  85          HH11      ARG  85  12.311  13.520   5.199
  693   2HH2  ARG  85          HH12      ARG  85  12.864  14.748   4.111
  694    H    PHE  86           HN       PHE  86   6.543   9.305   1.352
  695    HA   PHE  86           HA       PHE  86   3.682   9.677   1.164
  696   1HB   PHE  86           HB2      PHE  86   5.819   8.867  -0.559
  697   2HB   PHE  86           HB1      PHE  86   4.553   7.643  -0.639
  698    HD1  PHE  86           HD1      PHE  86   4.640  11.386  -0.305
  699    HD2  PHE  86           HD2      PHE  86   3.058   7.976  -2.383
  700    HE1  PHE  86           HE1      PHE  86   3.277  12.887  -1.732
  701    HE2  PHE  86           HE2      PHE  86   1.695   9.478  -3.810
  702    HZ   PHE  86           HZ       PHE  86   1.807  11.934  -3.484
  703    H    LEU  87           HN       LEU  87   5.754   7.046   2.232
  704    HA   LEU  87           HA       LEU  87   3.700   5.004   2.176
  705   1HB   LEU  87           HB2      LEU  87   6.448   5.059   2.619
  706   2HB   LEU  87           HB1      LEU  87   5.780   4.614   4.189
  707    HG   LEU  87           HG       LEU  87   6.178   2.598   2.861
  708   1HD1  LEU  87          HD13      LEU  87   4.174   2.732   4.359
  709   2HD1  LEU  87          HD12      LEU  87   3.213   3.228   2.966
  710   3HD1  LEU  87          HD11      LEU  87   3.951   1.627   3.004
  711   1HD2  LEU  87          HD21      LEU  87   5.325   4.255   0.735
  712   2HD2  LEU  87          HD23      LEU  87   5.821   2.565   0.635
  713   3HD2  LEU  87          HD22      LEU  87   4.120   2.972   0.864
  714    H    LYS  88           HN       LYS  88   4.916   7.216   4.688
  715    HA   LYS  88           HA       LYS  88   3.349   6.103   6.825
  716   1HB   LYS  88           HB2      LYS  88   4.387   8.936   6.496
  717   2HB   LYS  88           HB1      LYS  88   3.860   8.194   8.007
  718   1HG   LYS  88           HG2      LYS  88   5.626   6.372   7.503
  719   2HG   LYS  88           HG1      LYS  88   6.280   7.521   6.336
  720   1HD   LYS  88           HD2      LYS  88   5.784   8.198   9.246
  721   2HD   LYS  88           HD1      LYS  88   7.340   7.649   8.626
  722   1HE   LYS  88           HE2      LYS  88   7.821   9.690   7.801
  723   2HE   LYS  88           HE1      LYS  88   6.257   9.795   6.990
  724   1HZ   LYS  88           HZ1      LYS  88   5.405  10.207   9.390
  725   2HZ   LYS  88           HZ3      LYS  88   7.010  10.657   9.696
  726   3HZ   LYS  88           HZ2      LYS  88   6.109  11.481   8.515
  727    NH1  ARG  89           NH2      ARG  89  -0.819  13.768   0.551
  728    NH2  ARG  89           NH1      ARG  89  -3.055  13.458   0.645
  729    H    ARG  89           HN       ARG  89   2.779   8.826   4.600
  730    HA   ARG  89           HA       ARG  89   0.318   9.721   5.658
  731   1HB   ARG  89           HB2      ARG  89   1.029  11.142   4.001
  732   2HB   ARG  89           HB1      ARG  89   1.682   9.833   3.018
  733   1HG   ARG  89           HG2      ARG  89  -0.502   9.239   2.212
  734   2HG   ARG  89           HG1      ARG  89  -1.288  10.304   3.378
  735   1HD   ARG  89           HD2      ARG  89   0.283  12.118   2.189
  736   2HD   ARG  89           HD1      ARG  89   0.134  10.986   0.845
  737    HE   ARG  89           HE       ARG  89  -2.472  11.327   1.713
  738   1HH1  ARG  89          HH21      ARG  89   0.114  13.456   0.729
  739   2HH1  ARG  89          HH22      ARG  89  -0.970  14.653   0.114
  740   1HH2  ARG  89          HH11      ARG  89  -3.845  12.902   0.899
  741   2HH2  ARG  89          HH12      ARG  89  -3.187  14.346   0.204
  742    H    LEU  90           HN       LEU  90   0.810   7.409   2.984
  743    HA   LEU  90           HA       LEU  90  -1.968   6.639   2.866
  744   1HB   LEU  90           HB2      LEU  90  -0.223   6.391   1.027
  745   2HB   LEU  90           HB1      LEU  90   0.394   5.001   1.921
  746    HG   LEU  90           HG       LEU  90  -2.295   4.465   1.868
  747   1HD1  LEU  90          HD11      LEU  90  -2.084   6.543   0.093
  748   2HD1  LEU  90          HD13      LEU  90  -1.873   5.154  -0.973
  749   3HD1  LEU  90          HD12      LEU  90  -3.329   5.295   0.016
  750   1HD2  LEU  90          HD22      LEU  90  -0.017   3.241   1.068
  751   2HD2  LEU  90          HD21      LEU  90  -1.620   2.620   0.676
  752   3HD2  LEU  90          HD23      LEU  90  -0.733   3.581  -0.506
  753    H    ASP  91           HN       ASP  91   0.580   5.753   5.023
  754    HA   ASP  91           HA       ASP  91  -0.227   3.063   5.594
  755   1HB   ASP  91           HB2      ASP  91   1.721   4.914   6.551
  756   2HB   ASP  91           HB1      ASP  91   0.832   4.300   7.945
  757    NH1  ARG  92           NH2      ARG  92  -6.431   7.479  12.096
  758    NH2  ARG  92           NH1      ARG  92  -5.452   9.266  13.072
  759    H    ARG  92           HN       ARG  92  -1.176   6.184   7.045
  760    HA   ARG  92           HA       ARG  92  -3.008   4.781   8.885
  761   1HB   ARG  92           HB2      ARG  92  -1.678   7.318   8.842
  762   2HB   ARG  92           HB1      ARG  92  -3.416   7.595   8.966
  763   1HG   ARG  92           HG2      ARG  92  -2.196   5.462  10.676
  764   2HG   ARG  92           HG1      ARG  92  -1.951   7.146  11.139
  765   1HD   ARG  92           HD2      ARG  92  -4.723   6.509  10.375
  766   2HD   ARG  92           HD1      ARG  92  -4.159   5.651  11.808
  767    HE   ARG  92           HE       ARG  92  -3.371   8.291  12.213
  768   1HH1  ARG  92          HH21      ARG  92  -6.375   6.634  11.569
  769   2HH1  ARG  92          HH22      ARG  92  -7.321   7.806  12.414
  770   1HH2  ARG  92          HH11      ARG  92  -4.633   9.794  13.295
  771   2HH2  ARG  92          HH12      ARG  92  -6.349   9.580  13.380
  772    H    ASN  93           HN       ASN  93  -3.172   6.597   5.876
  773    HA   ASN  93           HA       ASN  93  -6.054   7.026   6.073
  774   1HB   ASN  93           HB2      ASN  93  -3.997   7.411   3.915
  775   2HB   ASN  93           HB1      ASN  93  -5.717   7.555   3.551
  776   1HD2  ASN  93          HD22      ASN  93  -6.033  10.348   5.970
  777   2HD2  ASN  93          HD21      ASN  93  -6.781   8.846   5.723
  778    H    LEU  94           HN       LEU  94  -4.046   4.429   4.888
  779    HA   LEU  94           HA       LEU  94  -6.072   3.322   3.131
  780   1HB   LEU  94           HB2      LEU  94  -3.450   2.882   3.308
  781   2HB   LEU  94           HB1      LEU  94  -3.988   1.566   4.350
  782    HG   LEU  94           HG       LEU  94  -5.608   0.932   2.482
  783   1HD1  LEU  94          HD13      LEU  94  -4.184   3.235   1.285
  784   2HD1  LEU  94          HD12      LEU  94  -4.344   1.828   0.234
  785   3HD1  LEU  94          HD11      LEU  94  -5.782   2.587   0.918
  786   1HD2  LEU  94          HD23      LEU  94  -2.681   0.618   2.603
  787   2HD2  LEU  94          HD22      LEU  94  -3.935  -0.608   2.420
  788   3HD2  LEU  94          HD21      LEU  94  -3.369   0.292   1.013
  789    CH2  TRP  95           CH2      TRP  95  -5.926  -0.746  13.114
  790    H    TRP  95           HN       TRP  95  -4.810   2.043   6.243
  791    HA   TRP  95           HA       TRP  95  -7.298   0.471   6.526
  792   1HB   TRP  95           HB2      TRP  95  -6.082  -0.931   7.807
  793   2HB   TRP  95           HB1      TRP  95  -4.693  -0.073   7.145
  794    HD1  TRP  95           HD1      TRP  95  -4.086   2.260   8.633
  795    HE1  TRP  95           HE1      TRP  95  -3.892   2.448  11.202
  796    HE3  TRP  95           HE3      TRP  95  -6.752  -1.856   9.998
  797    HZ2  TRP  95           HZ2      TRP  95  -4.759   1.017  13.530
  798    HZ3  TRP  95           HZ3      TRP  95  -7.051  -2.431  12.388
  799    HH2  TRP  95           HH2      TRP  95  -6.060  -1.002  14.155
  800    H    GLY  96           HN       GLY  96  -5.899   3.373   7.817
  801   1HA   GLY  96           HA2      GLY  96  -7.140   3.540  10.339
  802   2HA   GLY  96           HA1      GLY  96  -6.808   4.944   9.328
  803    H    LEU  97           HN       LEU  97  -8.525   3.900   7.132
  804    HA   LEU  97           HA       LEU  97 -11.093   4.853   8.236
  805   1HB   LEU  97           HB2      LEU  97 -11.794   5.122   5.966
  806   2HB   LEU  97           HB1      LEU  97 -10.112   5.649   6.016
  807    HG   LEU  97           HG       LEU  97  -9.785   2.993   5.501
  808   1HD1  LEU  97          HD11      LEU  97 -12.436   3.872   4.356
  809   2HD1  LEU  97          HD13      LEU  97 -11.472   2.618   3.576
  810   3HD1  LEU  97          HD12      LEU  97 -12.055   2.385   5.223
  811   1HD2  LEU  97          HD21      LEU  97  -9.523   5.476   4.128
  812   2HD2  LEU  97          HD23      LEU  97  -8.692   3.958   3.787
  813   3HD2  LEU  97          HD22      LEU  97 -10.224   4.321   2.995
  814    H    ALA  98           HN       ALA  98  -9.597   1.890   7.148
  815    HA   ALA  98           HA       ALA  98 -11.808   0.278   6.547
  816   1HB   ALA  98           HB1      ALA  98  -9.188  -0.330   7.924
  817   2HB   ALA  98           HB3      ALA  98 -10.360  -1.593   7.554
  818   3HB   ALA  98           HB2      ALA  98  -9.636  -0.654   6.249
  819    H    GLY  99           HN       GLY  99 -10.259   0.616   9.751
  820   1HA   GLY  99           HA2      GLY  99 -11.479   0.902  11.817
  821   2HA   GLY  99           HA1      GLY  99 -12.937   0.340  11.002
  822    H    LEU 100           HN       LEU 100  -9.814  -0.753  12.296
  823    HA   LEU 100           HA       LEU 100 -11.071  -3.250  13.176
  824   1HB   LEU 100           HB2      LEU 100  -9.804  -3.204  10.653
  825   2HB   LEU 100           HB1      LEU 100  -8.677  -4.007  11.748
  826    HG   LEU 100           HG       LEU 100 -11.029  -5.144  12.522
  827   1HD1  LEU 100          HD11      LEU 100 -11.305  -4.195   9.704
  828   2HD1  LEU 100          HD13      LEU 100 -11.900  -5.813  10.081
  829   3HD1  LEU 100          HD12      LEU 100 -12.542  -4.414  10.941
  830   1HD2  LEU 100          HD22      LEU 100  -8.714  -5.854  10.899
  831   2HD2  LEU 100          HD21      LEU 100  -9.581  -6.824  12.089
  832   3HD2  LEU 100          HD23      LEU 100 -10.145  -6.767  10.420
  833    H    ASN 101           HN       ASN 101  -9.032  -4.716  14.021
  834    HA   ASN 101           HA       ASN 101  -7.287  -2.818  15.542
  835   1HB   ASN 101           HB2      ASN 101  -8.652  -5.370  16.413
  836   2HB   ASN 101           HB1      ASN 101  -7.294  -4.685  17.306
  837   1HD2  ASN 101          HD22      ASN 101 -10.854  -3.257  18.166
  838   2HD2  ASN 101          HD21      ASN 101 -10.513  -4.810  17.573
  839    H    SER 102           HN       SER 102  -7.276  -6.373  15.221
  840    HA   SER 102           HA       SER 102  -4.381  -6.284  14.699
  841   1HB   SER 102           HB2      SER 102  -6.350  -8.299  15.555
  842   2HB   SER 102           HB1      SER 102  -5.114  -8.920  14.466
  843    HG   SER 102           HG       SER 102  -4.867  -7.755  17.011
  844    H    CYS 103           HN       CYS 103  -3.563  -7.826  12.918
  845    HA   CYS 103           HA       CYS 103  -5.271  -8.267  10.613
  846   1HB   CYS 103           HB2      CYS 103  -4.026  -5.706  10.863
  847   2HB   CYS 103           HB1      CYS 103  -3.219  -6.575   9.560
  848    HA   PRO 104           HA       PRO 104  -1.615 -11.029  11.278
  849   1HB   PRO 104           HB2      PRO 104  -3.255 -13.016   9.945
  850   2HB   PRO 104           HB1      PRO 104  -2.668 -13.009  11.615
  851   1HG   PRO 104           HG2      PRO 104  -5.350 -12.515  10.713
  852   2HG   PRO 104           HG1      PRO 104  -4.742 -12.438  12.372
  853   1HD   PRO 104           HD2      PRO 104  -5.537 -10.243  10.689
  854   2HD   PRO 104           HD1      PRO 104  -4.894 -10.167  12.343
  855    H    VAL 105           HN       VAL 105  -0.333 -10.027   9.679
  856    HA   VAL 105           HA       VAL 105  -1.066 -10.350   6.835
  857    HB   VAL 105           HB       VAL 105  -0.088  -8.212   7.569
  858   1HG1  VAL 105          HG11      VAL 105   1.630  -9.950   9.040
  859   2HG1  VAL 105          HG13      VAL 105   2.637  -9.012   7.935
  860   3HG1  VAL 105          HG12      VAL 105   1.577  -8.188   9.079
  861   1HG2  VAL 105          HG21      VAL 105   0.924  -9.888   5.456
  862   2HG2  VAL 105          HG23      VAL 105   0.749  -8.134   5.479
  863   3HG2  VAL 105          HG22      VAL 105   2.232  -8.881   6.073
  864    H    LYS 106           HN       LYS 106  -0.856 -12.842   7.480
  865    HA   LYS 106           HA       LYS 106   1.723 -13.706   6.350
  866   1HB   LYS 106           HB2      LYS 106   0.911 -14.171   9.189
  867   2HB   LYS 106           HB1      LYS 106   1.717 -15.489   8.335
  868   1HG   LYS 106           HG2      LYS 106   3.217 -13.255   7.635
  869   2HG   LYS 106           HG1      LYS 106   2.828 -12.974   9.332
  870   1HD   LYS 106           HD2      LYS 106   3.715 -15.717   8.550
  871   2HD   LYS 106           HD1      LYS 106   4.937 -14.446   8.617
  872   1HE   LYS 106           HE2      LYS 106   3.172 -14.309  10.919
  873   2HE   LYS 106           HE1      LYS 106   3.921 -15.901  10.790
  874   1HZ   LYS 106           HZ2      LYS 106   6.054 -14.565  10.363
  875   2HZ   LYS 106           HZ1      LYS 106   5.211 -13.267  11.063
  876   3HZ   LYS 106           HZ3      LYS 106   5.476 -14.684  11.957
  877    H    GLU 107           HN       GLU 107   0.114 -14.268   4.661
  878    HA   GLU 107           HA       GLU 107  -1.285 -16.833   5.302
  879   1HB   GLU 107           HB2      GLU 107  -2.209 -14.400   3.883
  880   2HB   GLU 107           HB1      GLU 107  -2.617 -15.932   3.107
  881   1HG   GLU 107           HG2      GLU 107  -4.109 -16.488   4.722
  882   2HG   GLU 107           HG1      GLU 107  -3.053 -15.922   6.017
  883    H    ALA 108           HN       ALA 108  -0.314 -15.032   2.371
  884    HA   ALA 108           HA       ALA 108   0.339 -17.526   1.038
  885   1HB   ALA 108           HB1      ALA 108   0.875 -14.639   0.311
  886   2HB   ALA 108           HB3      ALA 108   1.282 -15.998  -0.731
  887   3HB   ALA 108           HB2      ALA 108  -0.403 -15.670  -0.325
  888    H    ASP 109           HN       ASP 109   2.480 -18.103   0.351
  889    HA   ASP 109           HA       ASP 109   4.427 -18.190   2.367
  890   1HB   ASP 109           HB2      ASP 109   4.772 -18.369  -0.642
  891   2HB   ASP 109           HB1      ASP 109   6.019 -18.808   0.525
  892    H    GLN 110           HN       GLN 110   4.943 -16.357  -0.655
  893    HA   GLN 110           HA       GLN 110   5.399 -13.841   0.584
  894   1HB   GLN 110           HB2      GLN 110   7.948 -13.839   0.256
  895   2HB   GLN 110           HB1      GLN 110   7.326 -14.672   1.674
  896   1HG   GLN 110           HG2      GLN 110   7.372 -16.506  -0.534
  897   2HG   GLN 110           HG1      GLN 110   8.950 -15.739  -0.388
  898   1HE2  GLN 110          HE22      GLN 110   9.644 -17.161   2.824
  899   2HE2  GLN 110          HE21      GLN 110  10.021 -15.867   1.791
  900    H    SER 111           HN       SER 111   4.179 -13.445  -1.391
  901    HA   SER 111           HA       SER 111   5.487 -13.925  -3.974
  902   1HB   SER 111           HB2      SER 111   2.980 -13.898  -3.654
  903   2HB   SER 111           HB1      SER 111   3.096 -12.158  -3.406
  904    HG   SER 111           HG       SER 111   3.290 -13.649  -5.708
  905    H    THR 112           HN       THR 112   6.593 -12.419  -5.193
  906    HA   THR 112           HA       THR 112   8.047 -10.372  -3.995
  907    HB   THR 112           HB       THR 112   8.519  -9.563  -6.247
  908    HG1  THR 112           HG1      THR 112   6.064 -10.716  -6.691
  909   1HG2  THR 112          HG22      THR 112   9.231 -11.906  -5.287
  910   2HG2  THR 112          HG21      THR 112   8.163 -12.527  -6.546
  911   3HG2  THR 112          HG23      THR 112   9.546 -11.523  -6.980
  912    H    LEU 113           HN       LEU 113   7.679  -8.304  -3.420
  913    HA   LEU 113           HA       LEU 113   5.095  -7.271  -3.039
  914   1HB   LEU 113           HB2      LEU 113   7.236  -6.464  -1.963
  915   2HB   LEU 113           HB1      LEU 113   7.576  -5.588  -3.456
  916    HG   LEU 113           HG       LEU 113   4.854  -5.134  -2.480
  917   1HD1  LEU 113          HD11      LEU 113   7.233  -4.554  -0.715
  918   2HD1  LEU 113          HD13      LEU 113   5.785  -3.549  -0.653
  919   3HD1  LEU 113          HD12      LEU 113   5.683  -5.267  -0.269
  920   1HD2  LEU 113          HD22      LEU 113   6.166  -3.866  -4.255
  921   2HD2  LEU 113          HD21      LEU 113   5.406  -2.857  -3.023
  922   3HD2  LEU 113          HD23      LEU 113   7.135  -3.195  -2.943
  923    H    GLU 114           HN       GLU 114   7.026  -7.249  -5.947
  924    HA   GLU 114           HA       GLU 114   5.933  -4.991  -7.257
  925   1HB   GLU 114           HB2      GLU 114   7.743  -6.895  -7.941
  926   2HB   GLU 114           HB1      GLU 114   6.370  -7.394  -8.929
  927   1HG   GLU 114           HG2      GLU 114   6.658  -4.526  -9.051
  928   2HG   GLU 114           HG1      GLU 114   8.192  -5.294  -9.461
  929    H    ASN 115           HN       ASN 115   4.870  -8.387  -7.649
  930    HA   ASN 115           HA       ASN 115   2.507  -7.745  -9.113
  931   1HB   ASN 115           HB2      ASN 115   3.396 -10.134  -7.518
  932   2HB   ASN 115           HB1      ASN 115   1.757 -10.066  -8.167
  933   1HD2  ASN 115          HD22      ASN 115   2.775 -10.770 -11.465
  934   2HD2  ASN 115          HD21      ASN 115   1.489 -10.535 -10.381
  935    H    PHE 116           HN       PHE 116   3.177  -7.635  -5.687
  936    HA   PHE 116           HA       PHE 116   0.463  -7.805  -4.752
  937   1HB   PHE 116           HB2      PHE 116   1.930  -8.051  -2.993
  938   2HB   PHE 116           HB1      PHE 116   3.074  -6.878  -3.645
  939    HD1  PHE 116           HD1      PHE 116  -0.045  -7.317  -1.717
  940    HD2  PHE 116           HD2      PHE 116   2.827  -4.500  -3.224
  941    HE1  PHE 116           HE1      PHE 116  -0.986  -5.562  -0.237
  942    HE2  PHE 116           HE2      PHE 116   1.885  -2.746  -1.746
  943    HZ   PHE 116           HZ       PHE 116  -0.021  -3.277  -0.252
  944    H    LEU 117           HN       LEU 117   2.545  -4.958  -5.384
  945    HA   LEU 117           HA       LEU 117   0.509  -3.026  -4.866
  946   1HB   LEU 117           HB2      LEU 117   3.157  -3.023  -6.246
  947   2HB   LEU 117           HB1      LEU 117   2.068  -1.673  -6.568
  948    HG   LEU 117           HG       LEU 117   2.595  -2.578  -3.744
  949   1HD1  LEU 117          HD12      LEU 117   4.792  -2.145  -4.800
  950   2HD1  LEU 117          HD11      LEU 117   4.218  -0.562  -5.324
  951   3HD1  LEU 117          HD13      LEU 117   4.396  -0.911  -3.605
  952   1HD2  LEU 117          HD21      LEU 117   1.058  -0.537  -5.049
  953   2HD2  LEU 117          HD23      LEU 117   1.186  -0.873  -3.322
  954   3HD2  LEU 117          HD22      LEU 117   2.320   0.238  -4.090
  955    H    GLU 118           HN       GLU 118   1.329  -4.916  -7.716
  956    HA   GLU 118           HA       GLU 118  -0.175  -3.418  -9.632
  957   1HB   GLU 118           HB2      GLU 118   0.946  -4.989 -10.832
  958   2HB   GLU 118           HB1      GLU 118   1.042  -6.087  -9.456
  959   1HG   GLU 118           HG2      GLU 118  -1.183  -6.912  -9.856
  960   2HG   GLU 118           HG1      GLU 118  -1.490  -5.662 -11.063
  961    NH1  ARG 119           NH2      ARG 119  -3.723 -12.437  -7.325
  962    NH2  ARG 119           NH1      ARG 119  -1.860 -12.993  -8.475
  963    H    ARG 119           HN       ARG 119  -1.075  -6.151  -7.540
  964    HA   ARG 119           HA       ARG 119  -3.830  -6.224  -8.404
  965   1HB   ARG 119           HB2      ARG 119  -2.691  -7.176  -5.758
  966   2HB   ARG 119           HB1      ARG 119  -4.175  -7.728  -6.538
  967   1HG   ARG 119           HG2      ARG 119  -2.210  -8.075  -8.491
  968   2HG   ARG 119           HG1      ARG 119  -1.427  -8.584  -6.994
  969   1HD   ARG 119           HD2      ARG 119  -3.452 -10.003  -6.506
  970   2HD   ARG 119           HD1      ARG 119  -4.047  -9.609  -8.119
  971    HE   ARG 119           HE       ARG 119  -1.491 -10.570  -8.576
  972   1HH1  ARG 119          HH21      ARG 119  -4.330 -11.752  -6.925
  973   2HH1  ARG 119          HH22      ARG 119  -3.947 -13.407  -7.239
  974   1HH2  ARG 119          HH11      ARG 119  -1.027 -12.728  -8.962
  975   2HH2  ARG 119          HH12      ARG 119  -2.098 -13.959  -8.381
  976    H    LEU 120           HN       LEU 120  -2.080  -4.151  -6.229
  977    HA   LEU 120           HA       LEU 120  -4.393  -3.378  -4.636
  978   1HB   LEU 120           HB2      LEU 120  -1.568  -2.822  -4.677
  979   2HB   LEU 120           HB1      LEU 120  -2.458  -1.298  -4.635
  980    HG   LEU 120           HG       LEU 120  -3.891  -2.566  -2.799
  981   1HD1  LEU 120          HD13      LEU 120  -1.223  -4.003  -2.808
  982   2HD1  LEU 120          HD12      LEU 120  -2.323  -4.006  -1.429
  983   3HD1  LEU 120          HD11      LEU 120  -2.827  -4.722  -2.959
  984   1HD2  LEU 120          HD21      LEU 120  -2.152  -0.550  -2.710
  985   2HD2  LEU 120          HD23      LEU 120  -2.750  -1.296  -1.228
  986   3HD2  LEU 120          HD22      LEU 120  -1.167  -1.742  -1.863
  987    H    LYS 121           HN       LYS 121  -2.778  -2.180  -7.539
  988    HA   LYS 121           HA       LYS 121  -4.335   0.249  -7.791
  989   1HB   LYS 121           HB2      LYS 121  -2.096  -0.711  -9.013
  990   2HB   LYS 121           HB1      LYS 121  -3.309  -1.052 -10.245
  991   1HG   LYS 121           HG2      LYS 121  -4.069   1.438  -9.683
  992   2HG   LYS 121           HG1      LYS 121  -2.384   1.585  -9.178
  993   1HD   LYS 121           HD2      LYS 121  -2.363   2.169 -11.478
  994   2HD   LYS 121           HD1      LYS 121  -1.800   0.498 -11.440
  995   1HE   LYS 121           HE2      LYS 121  -4.228  -0.194 -11.811
  996   2HE   LYS 121           HE1      LYS 121  -4.560   1.502 -12.164
  997   1HZ   LYS 121           HZ2      LYS 121  -2.267   0.405 -13.537
  998   2HZ   LYS 121           HZ1      LYS 121  -3.750  -0.295 -13.981
  999   3HZ   LYS 121           HZ3      LYS 121  -3.526   1.380 -14.130
 1000    H    THR 122           HN       THR 122  -4.697  -3.068  -8.828
 1001    HA   THR 122           HA       THR 122  -6.881  -2.531 -10.664
 1002    HB   THR 122           HB       THR 122  -6.849  -5.247  -9.661
 1003    HG1  THR 122           HG1      THR 122  -4.648  -5.566 -10.563
 1004   1HG2  THR 122          HG23      THR 122  -6.272  -3.815 -12.248
 1005   2HG2  THR 122          HG22      THR 122  -6.088  -5.564 -12.108
 1006   3HG2  THR 122          HG21      THR 122  -7.664  -4.818 -11.838
 1007    H    ILE 123           HN       ILE 123  -6.633  -3.591  -7.314
 1008    HA   ILE 123           HA       ILE 123  -9.440  -4.132  -6.963
 1009    HB   ILE 123           HB       ILE 123  -7.241  -3.517  -4.979
 1010   1HG1  ILE 123          HG12      ILE 123  -7.265  -5.652  -6.479
 1011   2HG1  ILE 123          HG11      ILE 123  -7.029  -5.854  -4.743
 1012   1HG2  ILE 123          HG21      ILE 123 -10.162  -4.052  -4.657
 1013   2HG2  ILE 123          HG23      ILE 123  -9.062  -4.810  -3.506
 1014   3HG2  ILE 123          HG22      ILE 123  -9.089  -3.055  -3.675
 1015   1HD1  ILE 123          HD13      ILE 123  -9.778  -5.953  -5.993
 1016   2HD1  ILE 123          HD12      ILE 123  -8.764  -7.391  -5.862
 1017   3HD1  ILE 123          HD11      ILE 123  -9.278  -6.538  -4.406
 1018    H    MET 124           HN       MET 124  -7.470  -1.222  -6.549
 1019    HA   MET 124           HA       MET 124  -9.664   0.219  -5.253
 1020   1HB   MET 124           HB2      MET 124  -6.853   0.718  -5.844
 1021   2HB   MET 124           HB1      MET 124  -7.871   2.135  -6.114
 1022   1HG   MET 124           HG2      MET 124  -8.330   2.377  -3.908
 1023   2HG   MET 124           HG1      MET 124  -8.541   0.643  -3.672
 1024   1HE   MET 124           HE2      MET 124  -6.875   3.615  -3.200
 1025   2HE   MET 124           HE1      MET 124  -5.246   3.334  -2.589
 1026   3HE   MET 124           HE3      MET 124  -5.552   3.363  -4.331
 1027    NH1  ARG 125           NH2      ARG 125 -11.257   1.381 -14.602
 1028    NH2  ARG 125           NH1      ARG 125 -10.154   0.268 -16.226
 1029    H    ARG 125           HN       ARG 125  -8.382  -0.054  -8.528
 1030    HA   ARG 125           HA       ARG 125  -9.893   2.169  -9.575
 1031   1HB   ARG 125           HB2      ARG 125  -8.052   1.480 -10.887
 1032   2HB   ARG 125           HB1      ARG 125  -8.540  -0.215 -10.833
 1033   1HG   ARG 125           HG2      ARG 125 -10.503   1.686 -12.008
 1034   2HG   ARG 125           HG1      ARG 125  -9.046   1.380 -12.955
 1035   1HD   ARG 125           HD2      ARG 125  -9.731  -1.149 -12.143
 1036   2HD   ARG 125           HD1      ARG 125 -11.315  -0.412 -12.358
 1037    HE   ARG 125           HE       ARG 125  -9.595  -1.304 -14.445
 1038   1HH1  ARG 125          HH21      ARG 125 -11.571   1.458 -13.659
 1039   2HH1  ARG 125          HH22      ARG 125 -11.537   2.067 -15.274
 1040   1HH2  ARG 125          HH11      ARG 125  -9.608  -0.514 -16.527
 1041   2HH2  ARG 125          HH12      ARG 125 -10.451   0.955 -16.890
 1042    H    GLU 126           HN       GLU 126 -10.513  -1.347  -9.559
 1043    HA   GLU 126           HA       GLU 126 -13.144  -0.890 -10.805
 1044   1HB   GLU 126           HB2      GLU 126 -11.293  -2.950 -10.895
 1045   2HB   GLU 126           HB1      GLU 126 -12.593  -3.607  -9.900
 1046   1HG   GLU 126           HG2      GLU 126 -14.093  -3.611 -11.626
 1047   2HG   GLU 126           HG1      GLU 126 -13.447  -2.127 -12.327
 1048    H    LYS 127           HN       LYS 127 -11.919  -1.831  -7.604
 1049    HA   LYS 127           HA       LYS 127 -14.655  -2.470  -6.730
 1050   1HB   LYS 127           HB2      LYS 127 -12.116  -3.310  -5.943
 1051   2HB   LYS 127           HB1      LYS 127 -12.718  -2.364  -4.580
 1052   1HG   LYS 127           HG2      LYS 127 -13.458  -4.650  -4.287
 1053   2HG   LYS 127           HG1      LYS 127 -14.864  -3.680  -4.730
 1054   1HD   LYS 127           HD2      LYS 127 -15.121  -4.740  -6.724
 1055   2HD   LYS 127           HD1      LYS 127 -13.384  -4.783  -7.027
 1056   1HE   LYS 127           HE2      LYS 127 -13.087  -6.750  -5.774
 1057   2HE   LYS 127           HE1      LYS 127 -14.614  -6.546  -4.918
 1058   1HZ   LYS 127           HZ3      LYS 127 -15.616  -6.748  -7.275
 1059   2HZ   LYS 127           HZ2      LYS 127 -14.135  -7.485  -7.665
 1060   3HZ   LYS 127           HZ1      LYS 127 -15.129  -8.152  -6.458
 1061    OH   TYR 128           OH       TYR 128 -13.104   7.711  -6.599
 1062    H    TYR 128           HN       TYR 128 -12.328   0.198  -6.135
 1063    HA   TYR 128           HA       TYR 128 -14.007   1.303  -4.031
 1064   1HB   TYR 128           HB2      TYR 128 -12.099   2.421  -3.669
 1065   2HB   TYR 128           HB1      TYR 128 -11.467   1.952  -5.241
 1066    HD1  TYR 128           HD2      TYR 128 -11.964   3.349  -7.261
 1067    HD2  TYR 128           HD1      TYR 128 -13.103   4.562  -3.302
 1068    HE1  TYR 128           HE2      TYR 128 -12.316   5.664  -8.073
 1069    HE2  TYR 128           HE1      TYR 128 -13.456   6.880  -4.115
 1070    HH   TYR 128           HH       TYR 128 -12.798   7.755  -7.507
 1071    H    SER 129           HN       SER 129 -14.277   1.315  -7.454
 1072    HA   SER 129           HA       SER 129 -15.716   3.864  -7.586
 1073   1HB   SER 129           HB2      SER 129 -14.535   2.045  -9.458
 1074   2HB   SER 129           HB1      SER 129 -16.227   2.276  -9.891
 1075    HG   SER 129           HG       SER 129 -14.455   3.860 -10.598
 1076    H    LYS 130           HN       LYS 130 -16.604   0.979  -6.257
 1077    HA   LYS 130           HA       LYS 130 -19.443   1.363  -7.116
 1078   1HB   LYS 130           HB2      LYS 130 -19.790  -1.047  -6.814
 1079   2HB   LYS 130           HB1      LYS 130 -18.509  -0.759  -7.991
 1080   1HG   LYS 130           HG2      LYS 130 -17.018  -1.870  -6.726
 1081   2HG   LYS 130           HG1      LYS 130 -17.397  -0.875  -5.321
 1082   1HD   LYS 130           HD2      LYS 130 -17.997  -3.048  -4.626
 1083   2HD   LYS 130           HD1      LYS 130 -19.533  -2.343  -5.131
 1084   1HE   LYS 130           HE2      LYS 130 -19.321  -3.411  -7.334
 1085   2HE   LYS 130           HE1      LYS 130 -17.764  -4.093  -6.865
 1086   1HZ   LYS 130           HZ2      LYS 130 -18.863  -5.299  -5.086
 1087   2HZ   LYS 130           HZ1      LYS 130 -20.364  -4.644  -5.541
 1088   3HZ   LYS 130           HZ3      LYS 130 -19.547  -5.696  -6.590
 1089    H    CYS 131           HN       CYS 131 -18.471   2.810  -4.989
 1090    HA   CYS 131           HA       CYS 131 -18.501   1.657  -2.430
 1091   1HB   CYS 131           HB2      CYS 131 -19.243   4.355  -3.493
 1092   2HB   CYS 131           HB1      CYS 131 -19.636   3.975  -1.817
 1093    H    SER 132           HN       SER 132 -21.257   2.514  -4.499
 1094    HA   SER 132           HA       SER 132 -22.976   0.618  -3.222
 1095   1HB   SER 132           HB2      SER 132 -24.509   2.754  -2.451
 1096   2HB   SER 132           HB1      SER 132 -23.491   1.815  -1.363
 1097    HG   SER 132           HG       SER 132 -22.860   3.900  -1.108
 1098    H    SER 133           HN       SER 133 -24.306   0.079  -4.870
 1099    HA   SER 133           HA       SER 133 -25.661   2.194  -6.413
 1100   1HB   SER 133           HB2      SER 133 -24.930   0.764  -8.539
 1101   2HB   SER 133           HB1      SER 133 -23.925   2.077  -7.936
 1102    HG   SER 133           HG       SER 133 -22.471   0.564  -7.773
   
  Start of MODEL          12
 Raw file had 1102 H/Q atoms
  Start of MODEL   12
    1   1H    GLU   1           HT3      GLU   1 -16.645  15.225   7.989
    2   2H    GLU   1           HT2      GLU   1 -15.190  14.696   7.290
    3   3H    GLU   1           HT1      GLU   1 -15.447  16.350   7.573
    4    HA   GLU   1           HA       GLU   1 -17.182  16.432   5.935
    5   1HB   GLU   1           HB2      GLU   1 -14.588  15.123   5.089
    6   2HB   GLU   1           HB1      GLU   1 -15.784  15.686   3.922
    7   1HG   GLU   1           HG2      GLU   1 -15.116  17.643   6.028
    8   2HG   GLU   1           HG1      GLU   1 -13.782  17.251   4.942
    9    H    ALA   2           HN       ALA   2 -18.970  15.049   6.289
   10    HA   ALA   2           HA       ALA   2 -18.801  12.466   4.821
   11   1HB   ALA   2           HB1      ALA   2 -18.933  12.657   7.630
   12   2HB   ALA   2           HB3      ALA   2 -20.560  12.223   7.106
   13   3HB   ALA   2           HB2      ALA   2 -19.188  11.213   6.651
   14    H    GLU   3           HN       GLU   3 -20.218  12.843   3.181
   15    HA   GLU   3           HA       GLU   3 -22.667  14.423   3.692
   16   1HB   GLU   3           HB2      GLU   3 -21.037  13.757   1.369
   17   2HB   GLU   3           HB1      GLU   3 -22.749  13.460   1.067
   18   1HG   GLU   3           HG2      GLU   3 -22.120  15.986   2.482
   19   2HG   GLU   3           HG1      GLU   3 -21.596  15.903   0.799
   20    H    ALA   4           HN       ALA   4 -22.216  11.483   1.730
   21    HA   ALA   4           HA       ALA   4 -24.352  10.175   3.346
   22   1HB   ALA   4           HB3      ALA   4 -25.131  11.263   1.104
   23   2HB   ALA   4           HB2      ALA   4 -24.309   9.896   0.350
   24   3HB   ALA   4           HB1      ALA   4 -25.642   9.616   1.470
   25    H    HIS   5           HN       HIS   5 -21.225   9.932   2.465
   26    HA   HIS   5           HA       HIS   5 -21.050   7.142   3.019
   27   1HB   HIS   5           HB2      HIS   5 -21.779   7.711   0.342
   28   2HB   HIS   5           HB1      HIS   5 -20.084   7.220   0.307
   29    HD1  HIS   5           HD1      HIS   5 -19.566   4.916   1.700
   30    HD2  HIS   5           HD2      HIS   5 -23.532   5.580   0.601
   31    HE1  HIS   5           HE1      HIS   5 -20.745   2.683   1.886
   32    H    LYS   6           HN       LYS   6 -19.026   6.848   3.785
   33    HA   LYS   6           HA       LYS   6 -16.966   8.884   3.113
   34   1HB   LYS   6           HB2      LYS   6 -17.748   7.907   5.532
   35   2HB   LYS   6           HB1      LYS   6 -16.400   6.830   5.170
   36   1HG   LYS   6           HG2      LYS   6 -14.844   8.525   5.241
   37   2HG   LYS   6           HG1      LYS   6 -15.990   9.744   4.681
   38   1HD   LYS   6           HD2      LYS   6 -15.831  10.370   6.898
   39   2HD   LYS   6           HD1      LYS   6 -17.149   9.203   7.022
   40   1HE   LYS   6           HE2      LYS   6 -15.579   7.445   7.669
   41   2HE   LYS   6           HE1      LYS   6 -14.218   8.547   7.449
   42   1HZ   LYS   6           HZ3      LYS   6 -15.577   9.995   9.119
   43   2HZ   LYS   6           HZ2      LYS   6 -16.254   8.501   9.560
   44   3HZ   LYS   6           HZ1      LYS   6 -14.578   8.745   9.681
   45    H    CYS   7           HN       CYS   7 -17.339   7.145   1.027
   46    HA   CYS   7           HA       CYS   7 -14.999   5.292   1.270
   47   1HB   CYS   7           HB2      CYS   7 -16.105   3.892  -0.464
   48   2HB   CYS   7           HB1      CYS   7 -17.070   4.024   1.005
   49    H    ASP   8           HN       ASP   8 -16.619   7.720  -0.707
   50    HA   ASP   8           HA       ASP   8 -14.608   7.415  -2.847
   51   1HB   ASP   8           HB2      ASP   8 -17.248   8.226  -2.838
   52   2HB   ASP   8           HB1      ASP   8 -16.374   9.752  -2.985
   53    H    ILE   9           HN       ILE   9 -14.658   8.992   0.124
   54    HA   ILE   9           HA       ILE   9 -13.212  11.369  -0.866
   55    HB   ILE   9           HB       ILE   9 -14.046  10.566   1.936
   56   1HG1  ILE   9          HG12      ILE   9 -15.106  12.758   0.138
   57   2HG1  ILE   9          HG11      ILE   9 -15.845  11.161   0.242
   58   1HG2  ILE   9          HG21      ILE   9 -12.237  12.619   0.904
   59   2HG2  ILE   9          HG23      ILE   9 -13.569  13.304   1.833
   60   3HG2  ILE   9          HG22      ILE   9 -12.509  12.102   2.569
   61   1HD1  ILE   9          HD12      ILE   9 -15.312  12.761   2.737
   62   2HD1  ILE   9          HD11      ILE   9 -16.764  13.053   1.778
   63   3HD1  ILE   9          HD13      ILE   9 -16.479  11.461   2.485
   64    H    THR  10           HN       THR  10 -12.515   9.336   1.973
   65    HA   THR  10           HA       THR  10  -9.694   9.809   1.783
   66    HB   THR  10           HB       THR  10 -11.021   7.530   3.260
   67    HG1  THR  10           HG1      THR  10 -10.953  10.289   3.734
   68   1HG2  THR  10          HG21      THR  10  -8.426   7.894   3.003
   69   2HG2  THR  10          HG23      THR  10  -8.685   9.162   4.200
   70   3HG2  THR  10          HG22      THR  10  -9.104   7.492   4.581
   71    H    LEU  11           HN       LEU  11 -11.723   7.105   0.672
   72    HA   LEU  11           HA       LEU  11  -9.462   5.425   0.041
   73   1HB   LEU  11           HB2      LEU  11 -12.300   5.192  -0.044
   74   2HB   LEU  11           HB1      LEU  11 -11.671   4.749  -1.633
   75    HG   LEU  11           HG       LEU  11  -9.871   3.478  -0.080
   76   1HD1  LEU  11          HD12      LEU  11 -11.499   4.394   1.857
   77   2HD1  LEU  11          HD11      LEU  11 -12.330   2.884   1.488
   78   3HD1  LEU  11          HD13      LEU  11 -10.640   2.859   1.991
   79   1HD2  LEU  11          HD21      LEU  11 -12.517   2.677  -1.221
   80   2HD2  LEU  11          HD23      LEU  11 -10.896   2.129  -1.649
   81   3HD2  LEU  11          HD22      LEU  11 -11.676   1.515  -0.194
   82    H    GLN  12           HN       GLN  12 -11.539   7.512  -2.018
   83    HA   GLN  12           HA       GLN  12 -10.212   6.955  -4.458
   84   1HB   GLN  12           HB2      GLN  12 -11.586   8.541  -5.315
   85   2HB   GLN  12           HB1      GLN  12 -12.285   8.597  -3.701
   86   1HG   GLN  12           HG2      GLN  12 -10.651  10.392  -3.101
   87   2HG   GLN  12           HG1      GLN  12 -10.073  10.379  -4.769
   88   1HE2  GLN  12          HE22      GLN  12 -13.260  11.702  -6.010
   89   2HE2  GLN  12          HE21      GLN  12 -12.168  10.460  -6.389
   90    H    GLU  13           HN       GLU  13  -9.421   9.317  -1.925
   91    HA   GLU  13           HA       GLU  13  -7.198  10.486  -3.341
   92   1HB   GLU  13           HB2      GLU  13  -8.492  10.870  -0.851
   93   2HB   GLU  13           HB1      GLU  13  -6.812  10.496  -0.471
   94   1HG   GLU  13           HG2      GLU  13  -6.809  12.293  -2.691
   95   2HG   GLU  13           HG1      GLU  13  -7.898  12.951  -1.469
   96    H    ILE  14           HN       ILE  14  -7.601   7.673  -1.278
   97    HA   ILE  14           HA       ILE  14  -4.770   7.122  -0.984
   98    HB   ILE  14           HB       ILE  14  -7.265   6.005  -0.061
   99   1HG1  ILE  14          HG12      ILE  14  -5.095   4.716   1.192
  100   2HG1  ILE  14          HG11      ILE  14  -4.501   6.319   0.771
  101   1HG2  ILE  14          HG23      ILE  14  -5.272   4.004  -1.165
  102   2HG2  ILE  14          HG22      ILE  14  -6.654   3.605  -0.151
  103   3HG2  ILE  14          HG21      ILE  14  -6.912   4.256  -1.768
  104   1HD1  ILE  14          HD12      ILE  14  -7.232   6.216   1.926
  105   2HD1  ILE  14          HD11      ILE  14  -5.910   5.822   3.025
  106   3HD1  ILE  14          HD13      ILE  14  -5.935   7.379   2.199
  107    H    ILE  15           HN       ILE  15  -7.083   6.628  -3.507
  108    HA   ILE  15           HA       ILE  15  -5.747   4.368  -4.750
  109    HB   ILE  15           HB       ILE  15  -7.835   6.337  -5.724
  110   1HG1  ILE  15          HG12      ILE  15  -8.095   3.390  -5.104
  111   2HG1  ILE  15          HG11      ILE  15  -8.339   4.631  -3.883
  112   1HG2  ILE  15          HG23      ILE  15  -6.341   4.180  -7.133
  113   2HG2  ILE  15          HG22      ILE  15  -8.081   4.254  -7.411
  114   3HG2  ILE  15          HG21      ILE  15  -7.070   5.651  -7.778
  115   1HD1  ILE  15          HD11      ILE  15  -9.885   5.622  -5.871
  116   2HD1  ILE  15          HD13      ILE  15 -10.033   3.897  -6.196
  117   3HD1  ILE  15          HD12      ILE  15 -10.495   4.537  -4.620
  118    H    LYS  16           HN       LYS  16  -5.882   7.886  -5.370
  119    HA   LYS  16           HA       LYS  16  -4.064   7.805  -7.600
  120   1HB   LYS  16           HB2      LYS  16  -5.461   9.808  -6.082
  121   2HB   LYS  16           HB1      LYS  16  -3.771  10.288  -6.248
  122   1HG   LYS  16           HG2      LYS  16  -3.951  10.599  -8.493
  123   2HG   LYS  16           HG1      LYS  16  -4.983   9.183  -8.701
  124   1HD   LYS  16           HD2      LYS  16  -5.985  11.719  -7.401
  125   2HD   LYS  16           HD1      LYS  16  -6.080  11.456  -9.142
  126   1HE   LYS  16           HE2      LYS  16  -7.081   9.275  -7.366
  127   2HE   LYS  16           HE1      LYS  16  -8.068  10.730  -7.508
  128   1HZ   LYS  16           HZ1      LYS  16  -7.120   9.931 -10.049
  129   2HZ   LYS  16           HZ3      LYS  16  -7.911   8.631  -9.299
  130   3HZ   LYS  16           HZ2      LYS  16  -8.723  10.108  -9.514
  131    H    THR  17           HN       THR  17  -3.601   8.427  -4.136
  132    HA   THR  17           HA       THR  17  -0.795   8.891  -4.195
  133    HB   THR  17           HB       THR  17  -2.206   7.449  -1.952
  134    HG1  THR  17           HG1      THR  17  -3.048   9.403  -1.323
  135   1HG2  THR  17          HG23      THR  17   0.332   8.185  -2.073
  136   2HG2  THR  17          HG22      THR  17  -0.332   9.770  -1.678
  137   3HG2  THR  17          HG21      THR  17  -0.590   8.410  -0.586
  138    H    LEU  18           HN       LEU  18  -2.680   5.904  -4.038
  139    HA   LEU  18           HA       LEU  18  -0.555   4.091  -3.530
  140   1HB   LEU  18           HB2      LEU  18  -2.948   3.463  -3.448
  141   2HB   LEU  18           HB1      LEU  18  -3.077   3.705  -5.185
  142    HG   LEU  18           HG       LEU  18  -2.759   1.287  -4.263
  143   1HD1  LEU  18          HD13      LEU  18  -2.443   2.325  -6.679
  144   2HD1  LEU  18          HD12      LEU  18  -0.749   1.937  -6.379
  145   3HD1  LEU  18          HD11      LEU  18  -1.966   0.661  -6.337
  146   1HD2  LEU  18          HD21      LEU  18  -0.726   2.106  -2.883
  147   2HD2  LEU  18          HD23      LEU  18  -0.572   0.578  -3.750
  148   3HD2  LEU  18          HD22      LEU  18   0.156   2.042  -4.407
  149    H    ASN  19           HN       ASN  19  -1.811   5.463  -6.560
  150    HA   ASN  19           HA       ASN  19  -0.061   3.988  -8.303
  151   1HB   ASN  19           HB2      ASN  19  -1.890   4.978  -9.396
  152   2HB   ASN  19           HB1      ASN  19  -1.662   6.524  -8.579
  153   1HD2  ASN  19          HD22      ASN  19   0.509   7.776 -11.058
  154   2HD2  ASN  19          HD21      ASN  19  -0.401   8.084  -9.659
  155    H    SER  20           HN       SER  20   0.340   6.900  -6.393
  156    HA   SER  20           HA       SER  20   2.655   7.935  -7.738
  157   1HB   SER  20           HB2      SER  20   1.326   9.253  -6.114
  158   2HB   SER  20           HB1      SER  20   1.870   8.190  -4.818
  159    HG   SER  20           HG       SER  20   3.753   9.400  -6.509
  160    H    LEU  21           HN       LEU  21   2.247   5.454  -5.242
  161    HA   LEU  21           HA       LEU  21   5.063   5.287  -4.597
  162   1HB   LEU  21           HB2      LEU  21   2.804   3.288  -4.280
  163   2HB   LEU  21           HB1      LEU  21   4.444   3.005  -3.693
  164    HG   LEU  21           HG       LEU  21   3.403   5.629  -2.919
  165   1HD1  LEU  21          HD13      LEU  21   1.398   3.870  -2.928
  166   2HD1  LEU  21          HD12      LEU  21   2.157   3.360  -1.420
  167   3HD1  LEU  21          HD11      LEU  21   1.597   5.022  -1.609
  168   1HD2  LEU  21          HD23      LEU  21   5.405   4.020  -2.113
  169   2HD2  LEU  21          HD22      LEU  21   4.650   5.192  -1.034
  170   3HD2  LEU  21          HD21      LEU  21   4.161   3.499  -0.974
  171    H    THR  22           HN       THR  22   3.182   4.156  -7.288
  172    HA   THR  22           HA       THR  22   4.814   1.945  -8.096
  173    HB   THR  22           HB       THR  22   3.431   3.771 -10.052
  174    HG1  THR  22           HG1      THR  22   2.033   1.756  -8.711
  175   1HG2  THR  22          HG22      THR  22   4.543   1.107 -10.034
  176   2HG2  THR  22          HG21      THR  22   2.825   1.041 -10.426
  177   3HG2  THR  22          HG23      THR  22   3.914   2.035 -11.394
  178    H    GLU  23           HN       GLU  23   5.484   5.324  -8.063
  179    HA   GLU  23           HA       GLU  23   7.095   5.683 -10.334
  180   1HB   GLU  23           HB2      GLU  23   6.466   7.492  -8.763
  181   2HB   GLU  23           HB1      GLU  23   7.542   6.803  -7.550
  182   1HG   GLU  23           HG2      GLU  23   9.045   8.276  -8.451
  183   2HG   GLU  23           HG1      GLU  23   9.260   7.003  -9.650
  184    H    GLN  24           HN       GLN  24   8.048   4.416  -7.130
  185    HA   GLN  24           HA       GLN  24  10.478   3.277  -8.463
  186   1HB   GLN  24           HB2      GLN  24  10.538   5.180  -6.504
  187   2HB   GLN  24           HB1      GLN  24  10.607   3.706  -5.541
  188   1HG   GLN  24           HG2      GLN  24  12.518   2.904  -6.854
  189   2HG   GLN  24           HG1      GLN  24  12.435   4.337  -7.879
  190   1HE2  GLN  24          HE22      GLN  24  13.489   5.045  -3.960
  191   2HE2  GLN  24          HE21      GLN  24  12.235   3.952  -4.293
  192    H    LYS  25           HN       LYS  25   8.666   1.571  -8.755
  193    HA   LYS  25           HA       LYS  25   8.605  -0.207  -6.352
  194   1HB   LYS  25           HB2      LYS  25   6.506   0.723  -8.046
  195   2HB   LYS  25           HB1      LYS  25   6.678  -1.007  -8.325
  196   1HG   LYS  25           HG2      LYS  25   5.134  -0.697  -6.491
  197   2HG   LYS  25           HG1      LYS  25   6.637  -1.345  -5.834
  198   1HD   LYS  25           HD2      LYS  25   7.005   1.427  -5.809
  199   2HD   LYS  25           HD1      LYS  25   5.336   1.199  -5.282
  200   1HE   LYS  25           HE2      LYS  25   5.973  -0.153  -3.454
  201   2HE   LYS  25           HE1      LYS  25   7.575  -0.459  -4.126
  202   1HZ   LYS  25           HZ2      LYS  25   7.304   2.290  -3.890
  203   2HZ   LYS  25           HZ1      LYS  25   6.746   1.630  -2.427
  204   3HZ   LYS  25           HZ3      LYS  25   8.308   1.266  -2.978
  205    H    THR  26           HN       THR  26  10.906  -0.429  -7.659
  206    HA   THR  26           HA       THR  26  10.620  -3.007  -9.108
  207    HB   THR  26           HB       THR  26  12.429  -0.801 -10.119
  208    HG1  THR  26           HG1      THR  26  10.683   0.016 -10.914
  209   1HG2  THR  26          HG22      THR  26  13.000  -3.175 -10.662
  210   2HG2  THR  26          HG21      THR  26  11.416  -3.341 -11.422
  211   3HG2  THR  26          HG23      THR  26  12.598  -2.217 -12.088
  212    H    LEU  27           HN       LEU  27  12.996  -0.628  -7.876
  213    HA   LEU  27           HA       LEU  27  14.977  -2.695  -7.369
  214   1HB   LEU  27           HB2      LEU  27  14.895   0.163  -7.380
  215   2HB   LEU  27           HB1      LEU  27  15.500  -0.357  -5.806
  216    HG   LEU  27           HG       LEU  27  17.128  -1.857  -6.978
  217   1HD1  LEU  27          HD12      LEU  27  15.759  -2.024  -9.083
  218   2HD1  LEU  27          HD11      LEU  27  16.233  -0.368  -9.464
  219   3HD1  LEU  27          HD13      LEU  27  17.455  -1.637  -9.370
  220   1HD2  LEU  27          HD21      LEU  27  17.137   1.119  -7.505
  221   2HD2  LEU  27          HD23      LEU  27  18.036   0.223  -6.281
  222   3HD2  LEU  27          HD22      LEU  27  18.493   0.096  -7.981
  223    H    CYS  28           HN       CYS  28  12.809  -0.754  -5.307
  224    HA   CYS  28           HA       CYS  28  13.587  -2.138  -2.876
  225   1HB   CYS  28           HB2      CYS  28  11.213  -0.383  -3.558
  226   2HB   CYS  28           HB1      CYS  28  11.515  -1.031  -1.944
  227    H    THR  29           HN       THR  29  11.266  -2.728  -5.419
  228    HA   THR  29           HA       THR  29   9.623  -4.564  -3.892
  229    HB   THR  29           HB       THR  29   8.718  -5.199  -6.128
  230    HG1  THR  29           HG1      THR  29  10.413  -5.068  -7.471
  231   1HG2  THR  29          HG22      THR  29   8.070  -3.077  -4.841
  232   2HG2  THR  29          HG21      THR  29   9.102  -2.204  -5.969
  233   3HG2  THR  29          HG23      THR  29   7.697  -3.089  -6.565
  234    H    GLU  30           HN       GLU  30  12.761  -4.794  -5.270
  235    HA   GLU  30           HA       GLU  30  12.859  -7.502  -6.093
  236   1HB   GLU  30           HB2      GLU  30  14.840  -5.510  -5.077
  237   2HB   GLU  30           HB1      GLU  30  15.327  -7.205  -5.077
  238   1HG   GLU  30           HG2      GLU  30  14.671  -7.351  -7.484
  239   2HG   GLU  30           HG1      GLU  30  14.322  -5.623  -7.460
  240    H    LEU  31           HN       LEU  31  12.507  -6.171  -2.883
  241    HA   LEU  31           HA       LEU  31  13.542  -8.498  -1.519
  242   1HB   LEU  31           HB2      LEU  31  11.761  -6.194  -0.663
  243   2HB   LEU  31           HB1      LEU  31  12.173  -7.513   0.429
  244    HG   LEU  31           HG       LEU  31  13.709  -5.647   0.771
  245   1HD1  LEU  31          HD11      LEU  31  14.421  -8.268   0.410
  246   2HD1  LEU  31          HD13      LEU  31  15.532  -7.447  -0.686
  247   3HD1  LEU  31          HD12      LEU  31  15.501  -7.016   1.024
  248   1HD2  LEU  31          HD21      LEU  31  13.436  -4.867  -1.680
  249   2HD2  LEU  31          HD23      LEU  31  15.023  -4.683  -0.936
  250   3HD2  LEU  31          HD22      LEU  31  14.718  -6.018  -2.046
  251    H    THR  32           HN       THR  32  10.454  -8.084  -0.229
  252    HA   THR  32           HA       THR  32   8.862  -9.515  -2.117
  253    HB   THR  32           HB       THR  32   8.978 -11.528  -0.158
  254    HG1  THR  32           HG1      THR  32  10.980 -10.858   0.508
  255   1HG2  THR  32          HG22      THR  32  10.140 -11.390  -2.955
  256   2HG2  THR  32          HG21      THR  32   9.863 -12.876  -2.053
  257   3HG2  THR  32          HG23      THR  32   8.499 -11.865  -2.529
  258    H    VAL  33           HN       VAL  33   6.831 -10.429  -0.964
  259    HA   VAL  33           HA       VAL  33   6.283  -9.312   1.690
  260    HB   VAL  33           HB       VAL  33   4.286  -8.011   0.851
  261   1HG1  VAL  33          HG12      VAL  33   6.574  -7.020   1.395
  262   2HG1  VAL  33          HG11      VAL  33   6.873  -7.007  -0.342
  263   3HG1  VAL  33          HG13      VAL  33   5.550  -6.056   0.331
  264   1HG2  VAL  33          HG22      VAL  33   5.201  -9.181  -1.639
  265   2HG2  VAL  33          HG21      VAL  33   3.694  -8.334  -1.298
  266   3HG2  VAL  33          HG23      VAL  33   5.132  -7.424  -1.762
  267    H    THR  34           HN       THR  34   3.494  -9.580   1.685
  268    HA   THR  34           HA       THR  34   3.241 -12.494   1.106
  269    HB   THR  34           HB       THR  34   2.468 -10.799   3.322
  270    HG1  THR  34           HG1      THR  34   1.883 -13.180   3.924
  271   1HG2  THR  34          HG23      THR  34   0.270 -12.464   2.053
  272   2HG2  THR  34          HG22      THR  34   0.209 -11.791   3.680
  273   3HG2  THR  34          HG21      THR  34   0.258 -10.714   2.287
  274    H    ASP  35           HN       ASP  35   1.750 -13.203  -0.367
  275    HA   ASP  35           HA       ASP  35   0.279 -11.244  -1.957
  276   1HB   ASP  35           HB2      ASP  35   1.128 -13.201  -3.098
  277   2HB   ASP  35           HB1      ASP  35   0.317 -14.277  -1.959
  278    H    ILE  36           HN       ILE  36  -1.948 -10.825  -1.846
  279    HA   ILE  36           HA       ILE  36  -3.482 -12.375   0.187
  280    HB   ILE  36           HB       ILE  36  -4.289 -10.441   1.250
  281   1HG1  ILE  36          HG12      ILE  36  -3.202  -8.881  -1.118
  282   2HG1  ILE  36          HG11      ILE  36  -4.904  -9.148  -0.740
  283   1HG2  ILE  36          HG21      ILE  36  -1.823 -10.934   1.596
  284   2HG2  ILE  36          HG23      ILE  36  -1.487  -9.624   0.464
  285   3HG2  ILE  36          HG22      ILE  36  -2.322  -9.287   1.981
  286   1HD1  ILE  36          HD11      ILE  36  -3.855  -8.099   1.617
  287   2HD1  ILE  36          HD13      ILE  36  -3.066  -7.164   0.347
  288   3HD1  ILE  36          HD12      ILE  36  -4.826  -7.225   0.433
  289    H    PHE  37           HN       PHE  37  -3.358 -11.924  -2.955
  290    HA   PHE  37           HA       PHE  37  -6.294 -11.449  -3.261
  291   1HB   PHE  37           HB2      PHE  37  -4.085 -11.180  -5.324
  292   2HB   PHE  37           HB1      PHE  37  -5.794 -10.851  -5.600
  293    HD1  PHE  37           HD2      PHE  37  -6.473  -9.499  -2.997
  294    HD2  PHE  37           HD1      PHE  37  -3.104  -9.052  -5.626
  295    HE1  PHE  37           HE2      PHE  37  -6.154  -7.178  -2.197
  296    HE2  PHE  37           HE1      PHE  37  -2.787  -6.726  -4.824
  297    HZ   PHE  37           HZ       PHE  37  -4.318  -5.791  -3.112
  298    H    ALA  38           HN       ALA  38  -4.716 -14.010  -2.621
  299    HA   ALA  38           HA       ALA  38  -5.584 -15.570  -5.017
  300   1HB   ALA  38           HB3      ALA  38  -3.190 -15.670  -3.330
  301   2HB   ALA  38           HB2      ALA  38  -3.945 -17.248  -3.555
  302   3HB   ALA  38           HB1      ALA  38  -3.444 -16.302  -4.956
  303    H    ALA  39           HN       ALA  39  -5.445 -15.650  -1.449
  304    HA   ALA  39           HA       ALA  39  -7.684 -17.635  -1.554
  305   1HB   ALA  39           HB1      ALA  39  -5.299 -17.385   0.211
  306   2HB   ALA  39           HB3      ALA  39  -6.799 -17.927   0.964
  307   3HB   ALA  39           HB2      ALA  39  -6.111 -18.832  -0.385
  308    H    SER  40           HN       SER  40  -9.272 -15.937  -1.648
  309    HA   SER  40           HA       SER  40  -9.886 -14.825   1.018
  310   1HB   SER  40           HB2      SER  40  -8.738 -13.232  -1.085
  311   2HB   SER  40           HB1      SER  40 -10.393 -12.703  -0.799
  312    HG   SER  40           HG       SER  40  -8.287 -12.134   0.631
  313    H    LYS  41           HN       LYS  41 -12.042 -15.122   1.354
  314    HA   LYS  41           HA       LYS  41 -13.779 -15.390  -1.069
  315   1HB   LYS  41           HB2      LYS  41 -13.328 -17.187   1.119
  316   2HB   LYS  41           HB1      LYS  41 -15.007 -16.645   1.167
  317   1HG   LYS  41           HG2      LYS  41 -15.507 -17.548  -0.909
  318   2HG   LYS  41           HG1      LYS  41 -13.839 -17.436  -1.474
  319   1HD   LYS  41           HD2      LYS  41 -14.575 -19.283   0.789
  320   2HD   LYS  41           HD1      LYS  41 -14.774 -19.788  -0.888
  321   1HE   LYS  41           HE2      LYS  41 -12.211 -18.609  -0.732
  322   2HE   LYS  41           HE1      LYS  41 -12.355 -19.656   0.681
  323   1HZ   LYS  41           HZ1      LYS  41 -13.354 -21.284  -1.080
  324   2HZ   LYS  41           HZ3      LYS  41 -12.448 -20.349  -2.165
  325   3HZ   LYS  41           HZ2      LYS  41 -11.673 -21.148  -0.882
  326    H    ASP  42           HN       ASP  42 -13.358 -13.807   2.015
  327    HA   ASP  42           HA       ASP  42 -15.836 -12.265   1.450
  328   1HB   ASP  42           HB2      ASP  42 -16.105 -12.355   4.091
  329   2HB   ASP  42           HB1      ASP  42 -16.782 -13.624   3.070
  330    H    THR  43           HN       THR  43 -13.208 -11.383   0.980
  331    HA   THR  43           HA       THR  43 -12.598  -9.624   3.305
  332    HB   THR  43           HB       THR  43 -10.562  -9.056   1.776
  333    HG1  THR  43           HG1      THR  43 -11.053  -9.980  -0.106
  334   1HG2  THR  43          HG22      THR  43 -10.531 -10.435   3.869
  335   2HG2  THR  43          HG21      THR  43 -10.828 -11.864   2.878
  336   3HG2  THR  43          HG23      THR  43  -9.336 -10.944   2.674
  337    H    THR  44           HN       THR  44 -13.427  -7.601   3.242
  338    HA   THR  44           HA       THR  44 -14.251  -6.489   0.605
  339    HB   THR  44           HB       THR  44 -14.920  -4.933   3.003
  340    HG1  THR  44           HG1      THR  44 -16.575  -6.579   3.516
  341   1HG2  THR  44          HG22      THR  44 -16.458  -6.154   0.697
  342   2HG2  THR  44          HG21      THR  44 -17.201  -5.149   1.942
  343   3HG2  THR  44          HG23      THR  44 -15.968  -4.471   0.878
  344    H    GLU  45           HN       GLU  45 -14.181  -3.741   1.392
  345    HA   GLU  45           HA       GLU  45 -11.358  -3.207   0.941
  346   1HB   GLU  45           HB2      GLU  45 -12.016  -0.841   1.006
  347   2HB   GLU  45           HB1      GLU  45 -13.142  -1.755   0.003
  348   1HG   GLU  45           HG2      GLU  45 -14.737  -1.885   1.852
  349   2HG   GLU  45           HG1      GLU  45 -13.603  -1.054   2.916
  350    H    LYS  46           HN       LYS  46 -13.513  -3.256   3.707
  351    HA   LYS  46           HA       LYS  46 -11.847  -1.791   5.529
  352   1HB   LYS  46           HB2      LYS  46 -14.081  -2.097   6.227
  353   2HB   LYS  46           HB1      LYS  46 -14.056  -3.818   5.851
  354   1HG   LYS  46           HG2      LYS  46 -12.583  -4.269   7.729
  355   2HG   LYS  46           HG1      LYS  46 -12.397  -2.543   8.047
  356   1HD   LYS  46           HD2      LYS  46 -14.468  -2.362   9.021
  357   2HD   LYS  46           HD1      LYS  46 -15.181  -3.591   7.974
  358   1HE   LYS  46           HE2      LYS  46 -13.363  -5.073   9.398
  359   2HE   LYS  46           HE1      LYS  46 -13.875  -3.890  10.602
  360   1HZ   LYS  46           HZ2      LYS  46 -16.224  -4.479   9.741
  361   2HZ   LYS  46           HZ1      LYS  46 -15.483  -5.896   9.169
  362   3HZ   LYS  46           HZ3      LYS  46 -15.449  -5.532  10.826
  363    H    GLU  47           HN       GLU  47 -12.310  -5.327   5.156
  364    HA   GLU  47           HA       GLU  47 -10.192  -6.012   6.961
  365   1HB   GLU  47           HB2      GLU  47 -11.771  -7.471   4.878
  366   2HB   GLU  47           HB1      GLU  47 -10.326  -8.236   5.540
  367   1HG   GLU  47           HG2      GLU  47 -11.221  -8.422   7.659
  368   2HG   GLU  47           HG1      GLU  47 -12.243  -6.997   7.466
  369    H    THR  48           HN       THR  48 -10.238  -6.064   3.372
  370    HA   THR  48           HA       THR  48  -7.527  -6.797   3.033
  371    HB   THR  48           HB       THR  48  -9.234  -5.026   1.263
  372    HG1  THR  48           HG1      THR  48  -9.499  -7.049   0.161
  373   1HG2  THR  48          HG22      THR  48  -6.475  -6.002   1.076
  374   2HG2  THR  48          HG21      THR  48  -7.460  -6.416  -0.328
  375   3HG2  THR  48          HG23      THR  48  -7.281  -4.730   0.160
  376    H    PHE  49           HN       PHE  49  -8.888  -3.711   3.960
  377    HA   PHE  49           HA       PHE  49  -6.465  -2.231   3.242
  378   1HB   PHE  49           HB2      PHE  49  -9.050  -1.553   4.597
  379   2HB   PHE  49           HB1      PHE  49  -7.675  -0.475   4.802
  380    HD1  PHE  49           HD1      PHE  49  -8.492  -2.530   1.796
  381    HD2  PHE  49           HD2      PHE  49  -8.319   1.410   3.501
  382    HE1  PHE  49           HE1      PHE  49  -8.913  -1.546  -0.434
  383    HE2  PHE  49           HE2      PHE  49  -8.743   2.392   1.264
  384    HZ   PHE  49           HZ       PHE  49  -9.045   0.912  -0.704
  385    H    CYS  50           HN       CYS  50  -7.747  -3.823   6.117
  386    HA   CYS  50           HA       CYS  50  -5.764  -2.572   7.861
  387   1HB   CYS  50           HB2      CYS  50  -6.949  -3.490   9.567
  388   2HB   CYS  50           HB1      CYS  50  -8.159  -3.809   8.326
  389    NH1  ARG  51           NH2      ARG  51  -7.287 -11.783   4.888
  390    NH2  ARG  51           NH1      ARG  51  -9.057 -11.068   6.096
  391    H    ARG  51           HN       ARG  51  -5.967  -5.547   5.990
  392    HA   ARG  51           HA       ARG  51  -3.609  -6.711   7.284
  393   1HB   ARG  51           HB2      ARG  51  -5.451  -7.487   5.058
  394   2HB   ARG  51           HB1      ARG  51  -3.837  -8.200   5.075
  395   1HG   ARG  51           HG2      ARG  51  -4.200  -8.945   7.407
  396   2HG   ARG  51           HG1      ARG  51  -5.822  -8.258   7.365
  397   1HD   ARG  51           HD2      ARG  51  -5.432  -9.962   5.072
  398   2HD   ARG  51           HD1      ARG  51  -5.043 -10.848   6.547
  399    HE   ARG  51           HE       ARG  51  -7.430  -9.555   7.134
  400   1HH1  ARG  51          HH21      ARG  51  -6.317 -11.744   4.655
  401   2HH1  ARG  51          HH22      ARG  51  -7.885 -12.431   4.418
  402   1HH2  ARG  51          HH11      ARG  51  -9.447 -10.473   6.798
  403   2HH2  ARG  51          HH12      ARG  51  -9.640 -11.722   5.614
  404    H    ALA  52           HN       ALA  52  -4.368  -5.201   4.150
  405    HA   ALA  52           HA       ALA  52  -1.658  -5.290   3.179
  406   1HB   ALA  52           HB1      ALA  52  -4.030  -4.725   2.015
  407   2HB   ALA  52           HB3      ALA  52  -3.437  -3.085   2.282
  408   3HB   ALA  52           HB2      ALA  52  -2.487  -4.223   1.328
  409    H    ALA  53           HN       ALA  53  -3.409  -3.148   5.324
  410    HA   ALA  53           HA       ALA  53  -1.607  -0.899   5.113
  411   1HB   ALA  53           HB3      ALA  53  -3.673  -1.775   7.124
  412   2HB   ALA  53           HB2      ALA  53  -2.621  -0.401   7.461
  413   3HB   ALA  53           HB1      ALA  53  -3.692  -0.367   6.063
  414    H    THR  54           HN       THR  54  -1.902  -3.593   7.447
  415    HA   THR  54           HA       THR  54   0.301  -2.864   9.088
  416    HB   THR  54           HB       THR  54  -1.049  -5.473   8.437
  417    HG1  THR  54           HG1      THR  54  -1.639  -5.284  10.562
  418   1HG2  THR  54          HG23      THR  54   1.563  -5.066   9.881
  419   2HG2  THR  54          HG22      THR  54   0.487  -6.391  10.324
  420   3HG2  THR  54          HG21      THR  54   1.141  -6.296   8.689
  421    H    VAL  55           HN       VAL  55   0.146  -4.659   6.044
  422    HA   VAL  55           HA       VAL  55   2.922  -5.423   6.006
  423    HB   VAL  55           HB       VAL  55   1.075  -4.945   3.644
  424   1HG1  VAL  55          HG13      VAL  55   3.621  -6.539   4.047
  425   2HG1  VAL  55          HG12      VAL  55   2.558  -6.759   2.658
  426   3HG1  VAL  55          HG11      VAL  55   3.356  -5.208   2.921
  427   1HG2  VAL  55          HG21      VAL  55   0.883  -6.831   5.788
  428   2HG2  VAL  55          HG23      VAL  55  -0.107  -6.735   4.331
  429   3HG2  VAL  55          HG22      VAL  55   1.366  -7.706   4.334
  430    H    LEU  56           HN       LEU  56   1.153  -2.549   4.988
  431    HA   LEU  56           HA       LEU  56   3.366  -1.342   3.566
  432   1HB   LEU  56           HB2      LEU  56   0.636  -0.598   4.337
  433   2HB   LEU  56           HB1      LEU  56   1.765   0.756   4.413
  434    HG   LEU  56           HG       LEU  56   2.557   0.072   2.093
  435   1HD1  LEU  56          HD12      LEU  56   1.171  -2.216   2.561
  436   2HD1  LEU  56          HD11      LEU  56  -0.037  -1.300   1.657
  437   3HD1  LEU  56          HD13      LEU  56   1.542  -1.624   0.941
  438   1HD2  LEU  56          HD22      LEU  56  -0.077   1.238   2.831
  439   2HD2  LEU  56          HD21      LEU  56   1.241   1.941   1.894
  440   3HD2  LEU  56          HD23      LEU  56   0.131   0.801   1.135
  441    NH1  ARG  57           NH2      ARG  57   1.663  -0.131  14.031
  442    NH2  ARG  57           NH1      ARG  57   2.498  -2.230  14.033
  443    H    ARG  57           HN       ARG  57   2.462  -1.577   6.927
  444    HA   ARG  57           HA       ARG  57   4.081   0.684   7.796
  445   1HB   ARG  57           HB2      ARG  57   2.082  -0.513   9.023
  446   2HB   ARG  57           HB1      ARG  57   3.338  -1.613   9.590
  447   1HG   ARG  57           HG2      ARG  57   4.563   0.182  10.617
  448   2HG   ARG  57           HG1      ARG  57   3.539   1.395   9.848
  449   1HD   ARG  57           HD2      ARG  57   2.794   1.180  12.127
  450   2HD   ARG  57           HD1      ARG  57   1.581   0.405  11.109
  451    HE   ARG  57           HE       ARG  57   3.278  -1.668  11.779
  452   1HH1  ARG  57          HH21      ARG  57   1.512   0.748  13.583
  453   2HH1  ARG  57          HH22      ARG  57   1.313  -0.280  14.957
  454   1HH2  ARG  57          HH11      ARG  57   2.995  -2.969  13.577
  455   2HH2  ARG  57          HH12      ARG  57   2.142  -2.364  14.958
  456    H    GLN  58           HN       GLN  58   4.494  -2.803   7.428
  457    HA   GLN  58           HA       GLN  58   7.124  -2.858   8.677
  458   1HB   GLN  58           HB2      GLN  58   5.385  -4.771   7.192
  459   2HB   GLN  58           HB1      GLN  58   7.117  -5.104   7.197
  460   1HG   GLN  58           HG2      GLN  58   6.789  -4.537   9.810
  461   2HG   GLN  58           HG1      GLN  58   5.173  -5.147   9.452
  462   1HE2  GLN  58          HE22      GLN  58   8.321  -7.735   8.827
  463   2HE2  GLN  58          HE21      GLN  58   8.546  -6.079   8.526
  464    H    PHE  59           HN       PHE  59   5.891  -2.186   5.474
  465    HA   PHE  59           HA       PHE  59   8.530  -2.516   4.214
  466   1HB   PHE  59           HB2      PHE  59   6.738  -3.107   2.786
  467   2HB   PHE  59           HB1      PHE  59   5.799  -1.682   3.231
  468    HD1  PHE  59           HD1      PHE  59   9.360  -2.135   2.129
  469    HD2  PHE  59           HD2      PHE  59   5.556  -0.298   1.362
  470    HE1  PHE  59           HE1      PHE  59  10.346  -0.893   0.224
  471    HE2  PHE  59           HE2      PHE  59   6.540   0.944  -0.540
  472    HZ   PHE  59           HZ       PHE  59   8.935   0.649  -1.110
  473    OH   TYR  60           OH       TYR  60   7.190   5.502  10.446
  474    H    TYR  60           HN       TYR  60   6.608   0.050   5.627
  475    HA   TYR  60           HA       TYR  60   8.301   2.139   4.399
  476   1HB   TYR  60           HB2      TYR  60   6.454   3.383   4.730
  477   2HB   TYR  60           HB1      TYR  60   5.690   2.049   5.599
  478    HD1  TYR  60           HD1      TYR  60   7.759   5.093   5.941
  479    HD2  TYR  60           HD2      TYR  60   5.733   1.926   8.020
  480    HE1  TYR  60           HE1      TYR  60   8.032   6.322   8.079
  481    HE2  TYR  60           HE2      TYR  60   6.006   3.156  10.158
  482    HH   TYR  60           HH       TYR  60   6.700   5.031  11.124
  483    H    SER  61           HN       SER  61   8.155   0.302   7.357
  484    HA   SER  61           HA       SER  61   9.854   2.263   8.768
  485   1HB   SER  61           HB2      SER  61   8.113   1.140  10.063
  486   2HB   SER  61           HB1      SER  61   8.766  -0.435   9.622
  487    HG   SER  61           HG       SER  61   9.393   0.703  11.730
  488    H    HIS  62           HN       HIS  62  10.195  -0.703   6.957
  489    HA   HIS  62           HA       HIS  62  12.894  -1.200   8.033
  490   1HB   HIS  62           HB2      HIS  62  10.912  -2.691   6.467
  491   2HB   HIS  62           HB1      HIS  62  12.568  -2.920   5.905
  492    HD1  HIS  62           HD1      HIS  62  13.904  -4.599   7.169
  493    HD2  HIS  62           HD2      HIS  62  10.735  -3.135   9.448
  494    HE1  HIS  62           HE1      HIS  62  13.932  -5.890   9.347
  495    H    HIS  63           HN       HIS  63  11.662  -0.911   4.666
  496    HA   HIS  63           HA       HIS  63  14.349  -0.042   3.827
  497   1HB   HIS  63           HB2      HIS  63  11.816  -0.552   2.247
  498   2HB   HIS  63           HB1      HIS  63  13.378  -0.146   1.536
  499    HD1  HIS  63           HD1      HIS  63  15.255  -1.940   1.655
  500    HD2  HIS  63           HD2      HIS  63  11.632  -3.194   3.287
  501    HE1  HIS  63           HE1      HIS  63  15.445  -4.444   1.976
  502    H    GLU  64           HN       GLU  64  13.308   1.937   5.462
  503    HA   GLU  64           HA       GLU  64  12.111   3.970   3.690
  504   1HB   GLU  64           HB2      GLU  64  11.685   5.240   5.610
  505   2HB   GLU  64           HB1      GLU  64  11.509   3.583   6.173
  506   1HG   GLU  64           HG2      GLU  64  13.935   3.659   6.890
  507   2HG   GLU  64           HG1      GLU  64  13.904   5.390   6.546
  508    H    LYS  65           HN       LYS  65  15.221   3.126   5.047
  509    HA   LYS  65           HA       LYS  65  16.455   5.237   3.401
  510   1HB   LYS  65           HB2      LYS  65  15.946   5.770   6.081
  511   2HB   LYS  65           HB1      LYS  65  17.628   5.236   6.080
  512   1HG   LYS  65           HG2      LYS  65  17.828   6.839   4.000
  513   2HG   LYS  65           HG1      LYS  65  16.389   7.589   4.692
  514   1HD   LYS  65           HD2      LYS  65  18.858   7.033   6.344
  515   2HD   LYS  65           HD1      LYS  65  18.643   8.543   5.456
  516   1HE   LYS  65           HE2      LYS  65  16.867   9.234   6.781
  517   2HE   LYS  65           HE1      LYS  65  16.417   7.585   7.216
  518   1HZ   LYS  65           HZ1      LYS  65  18.640   7.531   8.418
  519   2HZ   LYS  65           HZ3      LYS  65  18.645   9.221   8.261
  520   3HZ   LYS  65           HZ2      LYS  65  17.398   8.452   9.123
  521    H    ASP  66           HN       ASP  66  16.490   2.364   3.235
  522    HA   ASP  66           HA       ASP  66  19.115   1.538   4.306
  523   1HB   ASP  66           HB2      ASP  66  16.933   0.077   4.045
  524   2HB   ASP  66           HB1      ASP  66  17.514  -0.127   2.391
  525    H    THR  67           HN       THR  67  20.896   1.000   2.966
  526    HA   THR  67           HA       THR  67  21.191   2.627   0.604
  527    HB   THR  67           HB       THR  67  23.388   1.522   0.394
  528    HG1  THR  67           HG1      THR  67  23.871  -0.097   1.974
  529   1HG2  THR  67          HG22      THR  67  22.392   2.917   2.699
  530   2HG2  THR  67          HG21      THR  67  23.621   1.761   3.212
  531   3HG2  THR  67          HG23      THR  67  24.006   2.975   1.992
  532    NH1  ARG  68           NH2      ARG  68  20.649  -6.345  -2.186
  533    NH2  ARG  68           NH1      ARG  68  19.087  -7.910  -1.733
  534    H    ARG  68           HN       ARG  68  20.151  -0.667   1.144
  535    HA   ARG  68           HA       ARG  68  20.668  -1.727  -1.456
  536   1HB   ARG  68           HB2      ARG  68  19.581  -2.710   0.872
  537   2HB   ARG  68           HB1      ARG  68  18.172  -2.638  -0.189
  538   1HG   ARG  68           HG2      ARG  68  20.708  -3.750  -1.311
  539   2HG   ARG  68           HG1      ARG  68  19.792  -4.756  -0.190
  540   1HD   ARG  68           HD2      ARG  68  17.829  -3.753  -1.849
  541   2HD   ARG  68           HD1      ARG  68  19.172  -3.998  -2.961
  542    HE   ARG  68           HE       ARG  68  17.514  -6.045  -1.889
  543   1HH1  ARG  68          HH21      ARG  68  20.902  -5.408  -2.409
  544   2HH1  ARG  68          HH22      ARG  68  21.353  -7.054  -2.149
  545   1HH2  ARG  68          HH11      ARG  68  18.130  -8.170  -1.597
  546   2HH2  ARG  68          HH12      ARG  68  19.802  -8.608  -1.712
  547    H    CYS  69           HN       CYS  69  17.973   0.183  -0.175
  548    HA   CYS  69           HA       CYS  69  16.442  -0.045  -2.659
  549   1HB   CYS  69           HB2      CYS  69  16.062   1.138   0.012
  550   2HB   CYS  69           HB1      CYS  69  15.333   2.065  -1.300
  551    H    LEU  70           HN       LEU  70  18.881   2.101  -1.388
  552    HA   LEU  70           HA       LEU  70  18.325   4.484  -2.775
  553   1HB   LEU  70           HB2      LEU  70  20.709   3.207  -1.621
  554   2HB   LEU  70           HB1      LEU  70  21.069   4.295  -2.961
  555    HG   LEU  70           HG       LEU  70  21.004   5.382  -0.660
  556   1HD1  LEU  70          HD13      LEU  70  19.303   6.258  -2.985
  557   2HD1  LEU  70          HD12      LEU  70  19.415   7.254  -1.534
  558   3HD1  LEU  70          HD11      LEU  70  20.867   6.883  -2.463
  559   1HD2  LEU  70          HD21      LEU  70  18.794   3.946  -0.228
  560   2HD2  LEU  70          HD23      LEU  70  19.029   5.518   0.537
  561   3HD2  LEU  70          HD22      LEU  70  18.025   5.380  -0.906
  562    H    GLY  71           HN       GLY  71  20.946   2.387  -3.963
  563   1HA   GLY  71           HA2      GLY  71  20.415   1.324  -6.276
  564   2HA   GLY  71           HA1      GLY  71  19.988   2.974  -6.728
  565    H    ALA  72           HN       ALA  72  21.642   4.456  -7.150
  566    HA   ALA  72           HA       ALA  72  24.377   4.091  -6.379
  567   1HB   ALA  72           HB2      ALA  72  23.505   2.917  -8.992
  568   2HB   ALA  72           HB1      ALA  72  25.076   3.714  -8.916
  569   3HB   ALA  72           HB3      ALA  72  24.731   2.345  -7.861
  570    H    THR  73           HN       THR  73  22.676   6.289  -6.337
  571    HA   THR  73           HA       THR  73  24.228   8.205  -7.887
  572    HB   THR  73           HB       THR  73  21.457   8.737  -8.538
  573    HG1  THR  73           HG1      THR  73  20.872   6.903  -9.367
  574   1HG2  THR  73          HG23      THR  73  23.831   9.406  -9.557
  575   2HG2  THR  73          HG22      THR  73  23.517   7.995 -10.568
  576   3HG2  THR  73          HG21      THR  73  22.382   9.344 -10.562
  577    H    ALA  74           HN       ALA  74  23.831  10.386  -7.173
  578    HA   ALA  74           HA       ALA  74  22.892  10.566  -4.436
  579   1HB   ALA  74           HB3      ALA  74  24.711  11.979  -5.722
  580   2HB   ALA  74           HB2      ALA  74  23.329  12.984  -6.160
  581   3HB   ALA  74           HB1      ALA  74  23.738  12.738  -4.462
  582    H    GLN  75           HN       GLN  75  21.448  11.146  -7.577
  583    HA   GLN  75           HA       GLN  75  19.286  12.815  -6.656
  584   1HB   GLN  75           HB2      GLN  75  19.848  11.187  -9.102
  585   2HB   GLN  75           HB1      GLN  75  18.182  11.687  -8.805
  586   1HG   GLN  75           HG2      GLN  75  19.885  13.927  -8.291
  587   2HG   GLN  75           HG1      GLN  75  20.322  13.252  -9.862
  588   1HE2  GLN  75          HE22      GLN  75  17.442  14.516 -11.429
  589   2HE2  GLN  75          HE21      GLN  75  19.002  13.867 -11.584
  590    H    GLN  76           HN       GLN  76  19.782   9.325  -6.830
  591    HA   GLN  76           HA       GLN  76  17.119   8.462  -6.420
  592   1HB   GLN  76           HB2      GLN  76  19.743   7.281  -5.472
  593   2HB   GLN  76           HB1      GLN  76  18.191   6.458  -5.302
  594   1HG   GLN  76           HG2      GLN  76  18.915   7.533  -7.996
  595   2HG   GLN  76           HG1      GLN  76  19.726   6.067  -7.445
  596   1HE2  GLN  76          HE22      GLN  76  16.947   4.206  -8.555
  597   2HE2  GLN  76          HE21      GLN  76  18.629   4.432  -8.597
  598    H    PHE  77           HN       PHE  77  19.432   9.869  -4.188
  599    HA   PHE  77           HA       PHE  77  18.247   9.107  -1.726
  600   1HB   PHE  77           HB2      PHE  77  19.912  11.424  -2.636
  601   2HB   PHE  77           HB1      PHE  77  19.155  11.505  -1.047
  602    HD1  PHE  77           HD1      PHE  77  21.610   9.732  -3.144
  603    HD2  PHE  77           HD2      PHE  77  19.779   9.962   0.735
  604    HE1  PHE  77           HE1      PHE  77  23.377   8.255  -2.222
  605    HE2  PHE  77           HE2      PHE  77  21.544   8.483   1.657
  606    HZ   PHE  77           HZ       PHE  77  23.343   7.630   0.177
  607    H    HIS  78           HN       HIS  78  17.602  11.987  -3.754
  608    HA   HIS  78           HA       HIS  78  15.519  13.030  -2.086
  609   1HB   HIS  78           HB2      HIS  78  16.405  14.545  -3.667
  610   2HB   HIS  78           HB1      HIS  78  16.250  13.391  -4.990
  611    HD1  HIS  78           HD1      HIS  78  13.770  12.902  -5.845
  612    HD2  HIS  78           HD2      HIS  78  14.136  16.121  -3.220
  613    HE1  HIS  78           HE1      HIS  78  11.624  14.237  -6.042
  614    NH1  ARG  79           NH2      ARG  79  12.416  11.364  -9.597
  615    NH2  ARG  79           NH1      ARG  79  14.345  11.897 -10.634
  616    H    ARG  79           HN       ARG  79  15.478  10.807  -4.847
  617    HA   ARG  79           HA       ARG  79  12.613  10.604  -5.014
  618   1HB   ARG  79           HB2      ARG  79  14.944   9.298  -6.206
  619   2HB   ARG  79           HB1      ARG  79  13.603   8.183  -5.940
  620   1HG   ARG  79           HG2      ARG  79  12.081   9.723  -7.121
  621   2HG   ARG  79           HG1      ARG  79  13.419  10.841  -7.390
  622   1HD   ARG  79           HD2      ARG  79  14.253   8.260  -8.260
  623   2HD   ARG  79           HD1      ARG  79  12.665   8.561  -8.957
  624    HE   ARG  79           HE       ARG  79  15.112   9.725  -9.827
  625   1HH1  ARG  79          HH21      ARG  79  11.851  10.724  -9.081
  626   2HH1  ARG  79          HH22      ARG  79  12.028  12.235  -9.895
  627   1HH2  ARG  79          HH11      ARG  79  15.278  11.664 -10.909
  628   2HH2  ARG  79          HH12      ARG  79  13.936  12.758 -10.935
  629    H    HIS  80           HN       HIS  80  14.880   9.302  -2.753
  630    HA   HIS  80           HA       HIS  80  13.208   7.013  -2.018
  631   1HB   HIS  80           HB2      HIS  80  15.773   7.177  -1.818
  632   2HB   HIS  80           HB1      HIS  80  15.475   8.162  -0.388
  633    HD1  HIS  80           HD1      HIS  80  12.790   5.795  -0.538
  634    HD2  HIS  80           HD2      HIS  80  16.763   5.601   0.705
  635    HE1  HIS  80           HE1      HIS  80  12.985   3.738   0.923
  636    H    LYS  81           HN       LYS  81  14.008  10.200  -0.616
  637    HA   LYS  81           HA       LYS  81  12.471   9.868   1.773
  638   1HB   LYS  81           HB2      LYS  81  14.012  11.666   1.762
  639   2HB   LYS  81           HB1      LYS  81  13.391  12.299   0.238
  640   1HG   LYS  81           HG2      LYS  81  11.651  13.384   1.246
  641   2HG   LYS  81           HG1      LYS  81  11.402  12.098   2.425
  642   1HD   LYS  81           HD2      LYS  81  13.932  13.208   3.012
  643   2HD   LYS  81           HD1      LYS  81  12.846  14.574   2.738
  644   1HE   LYS  81           HE2      LYS  81  11.231  13.620   4.336
  645   2HE   LYS  81           HE1      LYS  81  12.302  12.245   4.606
  646   1HZ   LYS  81           HZ2      LYS  81  13.965  14.276   5.041
  647   2HZ   LYS  81           HZ1      LYS  81  12.506  14.971   5.569
  648   3HZ   LYS  81           HZ3      LYS  81  13.057  13.528   6.268
  649    H    GLN  82           HN       GLN  82  11.550  10.783  -1.496
  650    HA   GLN  82           HA       GLN  82   8.936  11.793  -0.733
  651   1HB   GLN  82           HB2      GLN  82   9.999  12.471  -2.848
  652   2HB   GLN  82           HB1      GLN  82   9.938  10.803  -3.420
  653   1HG   GLN  82           HG2      GLN  82   7.457  10.846  -3.189
  654   2HG   GLN  82           HG1      GLN  82   7.553  12.542  -2.718
  655   1HE2  GLN  82          HE22      GLN  82   7.745  13.658  -6.047
  656   2HE2  GLN  82          HE21      GLN  82   7.475  14.036  -4.415
  657    H    LEU  83           HN       LEU  83  10.248   8.628  -1.456
  658    HA   LEU  83           HA       LEU  83   7.652   7.382  -1.904
  659   1HB   LEU  83           HB2      LEU  83   9.735   6.430  -2.838
  660   2HB   LEU  83           HB1      LEU  83  10.329   6.141  -1.204
  661    HG   LEU  83           HG       LEU  83   7.810   4.966  -1.176
  662   1HD1  LEU  83          HD13      LEU  83   8.492   5.285  -3.877
  663   2HD1  LEU  83          HD12      LEU  83   8.874   3.604  -3.505
  664   3HD1  LEU  83          HD11      LEU  83   7.247   4.223  -3.221
  665   1HD2  LEU  83          HD21      LEU  83  10.633   4.143  -1.194
  666   2HD2  LEU  83          HD23      LEU  83   9.309   3.586  -0.170
  667   3HD2  LEU  83          HD22      LEU  83   9.536   2.891  -1.775
  668    H    ILE  84           HN       ILE  84   9.829   7.800   0.855
  669    HA   ILE  84           HA       ILE  84   8.354   6.038   2.609
  670    HB   ILE  84           HB       ILE  84  10.471   8.132   2.960
  671   1HG1  ILE  84          HG12      ILE  84  11.794   6.300   3.636
  672   2HG1  ILE  84          HG11      ILE  84  10.389   5.333   4.084
  673   1HG2  ILE  84          HG22      ILE  84   8.733   6.919   5.117
  674   2HG2  ILE  84          HG21      ILE  84  10.346   7.549   5.453
  675   3HG2  ILE  84          HG23      ILE  84   9.089   8.624   4.841
  676   1HD1  ILE  84          HD12      ILE  84  10.999   6.146   1.231
  677   2HD1  ILE  84          HD11      ILE  84  11.524   4.618   1.933
  678   3HD1  ILE  84          HD13      ILE  84   9.805   4.969   1.778
  679    NH1  ARG  85           NH2      ARG  85   8.962  16.119   3.684
  680    NH2  ARG  85           NH1      ARG  85   7.048  17.232   4.137
  681    H    ARG  85           HN       ARG  85   8.234   9.505   1.927
  682    HA   ARG  85           HA       ARG  85   6.408  10.176   4.049
  683   1HB   ARG  85           HB2      ARG  85   7.761  11.566   2.022
  684   2HB   ARG  85           HB1      ARG  85   6.050  11.795   1.657
  685   1HG   ARG  85           HG2      ARG  85   5.638  12.942   3.617
  686   2HG   ARG  85           HG1      ARG  85   6.906  12.095   4.502
  687   1HD   ARG  85           HD2      ARG  85   8.499  13.600   3.911
  688   2HD   ARG  85           HD1      ARG  85   7.888  13.745   2.263
  689    HE   ARG  85           HE       ARG  85   5.978  15.050   3.777
  690   1HH1  ARG  85          HH21      ARG  85   9.449  15.280   3.447
  691   2HH1  ARG  85          HH22      ARG  85   9.475  16.968   3.815
  692   1HH2  ARG  85          HH11      ARG  85   6.055  17.246   4.248
  693   2HH2  ARG  85          HH12      ARG  85   7.576  18.072   4.264
  694    H    PHE  86           HN       PHE  86   5.833   9.680   0.565
  695    HA   PHE  86           HA       PHE  86   3.037   9.831   0.557
  696   1HB   PHE  86           HB2      PHE  86   5.107   8.677  -1.163
  697   2HB   PHE  86           HB1      PHE  86   3.593   7.781  -1.243
  698    HD1  PHE  86           HD2      PHE  86   1.555   9.853  -0.879
  699    HD2  PHE  86           HD1      PHE  86   5.233   9.989  -3.089
  700    HE1  PHE  86           HE2      PHE  86   0.595  11.591  -2.363
  701    HE2  PHE  86           HE1      PHE  86   4.277  11.728  -4.572
  702    HZ   PHE  86           HZ       PHE  86   1.960  12.534  -4.211
  703    H    LEU  87           HN       LEU  87   5.062   6.967   1.201
  704    HA   LEU  87           HA       LEU  87   2.870   5.154   1.524
  705   1HB   LEU  87           HB2      LEU  87   5.497   4.777   1.325
  706   2HB   LEU  87           HB1      LEU  87   5.381   4.755   3.086
  707    HG   LEU  87           HG       LEU  87   3.427   3.153   1.469
  708   1HD1  LEU  87          HD12      LEU  87   6.121   2.830   1.048
  709   2HD1  LEU  87          HD11      LEU  87   5.830   1.712   2.381
  710   3HD1  LEU  87          HD13      LEU  87   4.921   1.549   0.880
  711   1HD2  LEU  87          HD21      LEU  87   4.098   3.546   4.222
  712   2HD2  LEU  87          HD23      LEU  87   2.849   2.500   3.545
  713   3HD2  LEU  87          HD22      LEU  87   4.477   1.874   3.805
  714    H    LYS  88           HN       LYS  88   4.515   7.309   3.801
  715    HA   LYS  88           HA       LYS  88   3.452   6.253   6.210
  716   1HB   LYS  88           HB2      LYS  88   4.602   8.830   5.331
  717   2HB   LYS  88           HB1      LYS  88   3.501   8.947   6.703
  718   1HG   LYS  88           HG2      LYS  88   4.937   6.775   7.451
  719   2HG   LYS  88           HG1      LYS  88   6.160   7.642   6.519
  720   1HD   LYS  88           HD2      LYS  88   6.414   8.538   8.678
  721   2HD   LYS  88           HD1      LYS  88   5.388   9.726   7.873
  722   1HE   LYS  88           HE2      LYS  88   3.737   9.372   9.362
  723   2HE   LYS  88           HE1      LYS  88   3.741   7.646   8.998
  724   1HZ   LYS  88           HZ1      LYS  88   5.929   7.799  10.462
  725   2HZ   LYS  88           HZ3      LYS  88   5.078   9.097  11.143
  726   3HZ   LYS  88           HZ2      LYS  88   4.394   7.541  11.142
  727    NH1  ARG  89           NH2      ARG  89  -2.586  13.048   0.938
  728    NH2  ARG  89           NH1      ARG  89  -0.711  14.150   0.326
  729    H    ARG  89           HN       ARG  89   2.075   8.431   3.801
  730    HA   ARG  89           HA       ARG  89  -0.308   9.055   5.325
  731   1HB   ARG  89           HB2      ARG  89   0.707   9.519   2.592
  732   2HB   ARG  89           HB1      ARG  89  -1.046   9.378   2.705
  733   1HG   ARG  89           HG2      ARG  89  -0.471  10.986   4.862
  734   2HG   ARG  89           HG1      ARG  89   0.732  11.508   3.682
  735   1HD   ARG  89           HD2      ARG  89  -1.927  11.129   2.508
  736   2HD   ARG  89           HD1      ARG  89  -1.894  12.370   3.761
  737    HE   ARG  89           HE       ARG  89   0.310  12.973   2.223
  738   1HH1  ARG  89          HH21      ARG  89  -3.068  12.412   1.536
  739   2HH1  ARG  89          HH22      ARG  89  -3.074  13.485   0.183
  740   1HH2  ARG  89          HH11      ARG  89   0.258  14.359   0.461
  741   2HH2  ARG  89          HH12      ARG  89  -1.216  14.578  -0.422
  742    H    LEU  90           HN       LEU  90   0.440   6.696   2.774
  743    HA   LEU  90           HA       LEU  90  -2.200   5.618   2.565
  744   1HB   LEU  90           HB2      LEU  90   0.396   5.098   1.461
  745   2HB   LEU  90           HB1      LEU  90  -0.304   3.573   1.996
  746    HG   LEU  90           HG       LEU  90  -0.920   4.067  -0.337
  747   1HD1  LEU  90          HD12      LEU  90  -3.069   4.075   1.773
  748   2HD1  LEU  90          HD11      LEU  90  -3.489   4.105   0.063
  749   3HD1  LEU  90          HD13      LEU  90  -2.557   2.760   0.720
  750   1HD2  LEU  90          HD23      LEU  90  -1.508   6.689   0.848
  751   2HD2  LEU  90          HD22      LEU  90  -1.153   6.258  -0.821
  752   3HD2  LEU  90          HD21      LEU  90  -2.795   6.091  -0.200
  753    H    ASP  91           HN       ASP  91   0.240   5.159   4.994
  754    HA   ASP  91           HA       ASP  91  -0.663   2.517   5.800
  755   1HB   ASP  91           HB2      ASP  91   1.631   3.330   6.262
  756   2HB   ASP  91           HB1      ASP  91   0.968   4.547   7.348
  757    NH1  ARG  92           NH2      ARG  92  -1.855   5.353  13.782
  758    NH2  ARG  92           NH1      ARG  92  -1.552   3.119  13.634
  759    H    ARG  92           HN       ARG  92  -0.710   5.506   7.760
  760    HA   ARG  92           HA       ARG  92  -2.739   4.547   9.512
  761   1HB   ARG  92           HB2      ARG  92  -1.201   6.947   9.168
  762   2HB   ARG  92           HB1      ARG  92  -2.890   7.379   9.433
  763   1HG   ARG  92           HG2      ARG  92  -2.173   7.177  11.629
  764   2HG   ARG  92           HG1      ARG  92  -2.717   5.528  11.329
  765   1HD   ARG  92           HD2      ARG  92  -0.080   5.599  10.390
  766   2HD   ARG  92           HD1      ARG  92  -0.038   6.504  11.900
  767    HE   ARG  92           HE       ARG  92  -0.226   3.671  11.657
  768   1HH1  ARG  92          HH21      ARG  92  -1.678   6.278  13.457
  769   2HH1  ARG  92          HH22      ARG  92  -2.402   5.215  14.607
  770   1HH2  ARG  92          HH11      ARG  92  -1.144   2.325  13.182
  771   2HH2  ARG  92          HH12      ARG  92  -2.093   2.997  14.466
  772    H    ASN  93           HN       ASN  93  -2.985   6.069   6.365
  773    HA   ASN  93           HA       ASN  93  -5.807   6.768   6.759
  774   1HB   ASN  93           HB2      ASN  93  -4.060   6.778   4.283
  775   2HB   ASN  93           HB1      ASN  93  -5.727   7.355   4.331
  776   1HD2  ASN  93          HD22      ASN  93  -4.166  10.500   5.017
  777   2HD2  ASN  93          HD21      ASN  93  -4.850   9.553   3.787
  778    H    LEU  94           HN       LEU  94  -4.006   4.055   5.425
  779    HA   LEU  94           HA       LEU  94  -6.123   2.922   3.874
  780   1HB   LEU  94           HB2      LEU  94  -3.554   2.005   4.970
  781   2HB   LEU  94           HB1      LEU  94  -4.764   0.731   4.826
  782    HG   LEU  94           HG       LEU  94  -4.174   2.646   2.569
  783   1HD1  LEU  94          HD13      LEU  94  -2.878   0.011   3.282
  784   2HD1  LEU  94          HD12      LEU  94  -2.888   0.633   1.633
  785   3HD1  LEU  94          HD11      LEU  94  -2.090   1.545   2.913
  786   1HD2  LEU  94          HD23      LEU  94  -5.854   0.239   3.024
  787   2HD2  LEU  94          HD22      LEU  94  -6.125   1.612   1.951
  788   3HD2  LEU  94          HD21      LEU  94  -5.022   0.322   1.471
  789    CH2  TRP  95           CH2      TRP  95  -5.917   1.349  14.157
  790    H    TRP  95           HN       TRP  95  -5.028   1.805   7.100
  791    HA   TRP  95           HA       TRP  95  -7.647   0.534   7.519
  792   1HB   TRP  95           HB2      TRP  95  -6.653  -0.621   9.253
  793   2HB   TRP  95           HB1      TRP  95  -5.253  -0.295   8.232
  794    HD1  TRP  95           HD1      TRP  95  -3.842   1.965   8.879
  795    HE1  TRP  95           HE1      TRP  95  -3.282   2.906  11.218
  796    HE3  TRP  95           HE3      TRP  95  -7.416  -0.399  11.642
  797    HZ2  TRP  95           HZ2      TRP  95  -4.236   2.675  13.909
  798    HZ3  TRP  95           HZ3      TRP  95  -7.574  -0.024  14.086
  799    HH2  TRP  95           HH2      TRP  95  -5.992   1.509  15.223
  800    H    GLY  96           HN       GLY  96  -6.096   3.505   8.399
  801   1HA   GLY  96           HA2      GLY  96  -7.343   4.165  10.832
  802   2HA   GLY  96           HA1      GLY  96  -6.973   5.355   9.581
  803    H    LEU  97           HN       LEU  97  -8.675   4.002   7.594
  804    HA   LEU  97           HA       LEU  97 -11.265   5.138   8.451
  805   1HB   LEU  97           HB2      LEU  97 -10.648   5.798   6.255
  806   2HB   LEU  97           HB1      LEU  97 -10.112   4.176   5.827
  807    HG   LEU  97           HG       LEU  97 -12.464   3.385   5.935
  808   1HD1  LEU  97          HD13      LEU  97 -12.861   6.219   6.825
  809   2HD1  LEU  97          HD12      LEU  97 -14.138   5.432   5.896
  810   3HD1  LEU  97          HD11      LEU  97 -13.612   4.743   7.432
  811   1HD2  LEU  97          HD22      LEU  97 -11.450   4.287   3.826
  812   2HD2  LEU  97          HD21      LEU  97 -13.204   4.455   3.893
  813   3HD2  LEU  97          HD23      LEU  97 -12.172   5.851   4.202
  814    H    ALA  98           HN       ALA  98  -9.738   2.054   7.756
  815    HA   ALA  98           HA       ALA  98 -12.066   0.430   7.538
  816   1HB   ALA  98           HB2      ALA  98  -9.254  -0.153   8.501
  817   2HB   ALA  98           HB1      ALA  98 -10.480  -1.406   8.309
  818   3HB   ALA  98           HB3      ALA  98  -9.931  -0.487   6.907
  819    H    GLY  99           HN       GLY  99  -9.879   0.434  10.336
  820   1HA   GLY  99           HA2      GLY  99 -10.690   1.003  12.605
  821   2HA   GLY  99           HA1      GLY  99 -12.281   0.414  12.115
  822    H    LEU 100           HN       LEU 100  -9.242  -1.186  11.341
  823    HA   LEU 100           HA       LEU 100  -9.946  -3.356  13.269
  824   1HB   LEU 100           HB2      LEU 100  -9.959  -3.487  10.403
  825   2HB   LEU 100           HB1      LEU 100  -8.642  -4.495  11.004
  826    HG   LEU 100           HG       LEU 100 -10.776  -5.754  10.853
  827   1HD1  LEU 100          HD12      LEU 100  -9.065  -5.468  13.152
  828   2HD1  LEU 100          HD11      LEU 100 -10.701  -5.857  13.684
  829   3HD1  LEU 100          HD13      LEU 100  -9.868  -6.918  12.549
  830   1HD2  LEU 100          HD23      LEU 100 -12.072  -3.554  11.487
  831   2HD2  LEU 100          HD22      LEU 100 -12.706  -5.113  12.009
  832   3HD2  LEU 100          HD21      LEU 100 -11.812  -4.102  13.144
  833    H    ASN 101           HN       ASN 101  -8.301  -2.757  14.716
  834    HA   ASN 101           HA       ASN 101  -5.594  -2.195  13.814
  835   1HB   ASN 101           HB2      ASN 101  -6.172  -1.161  15.853
  836   2HB   ASN 101           HB1      ASN 101  -6.882  -2.639  16.505
  837   1HD2  ASN 101          HD22      ASN 101  -2.904  -1.955  16.940
  838   2HD2  ASN 101          HD21      ASN 101  -3.908  -0.846  16.137
  839    H    SER 102           HN       SER 102  -6.883  -4.859  15.847
  840    HA   SER 102           HA       SER 102  -4.556  -6.494  15.566
  841   1HB   SER 102           HB2      SER 102  -7.007  -6.659  16.933
  842   2HB   SER 102           HB1      SER 102  -6.982  -8.062  15.868
  843    HG   SER 102           HG       SER 102  -4.730  -8.299  16.703
  844    H    CYS 103           HN       CYS 103  -3.844  -7.031  13.541
  845    HA   CYS 103           HA       CYS 103  -5.739  -8.516  11.800
  846   1HB   CYS 103           HB2      CYS 103  -4.007  -6.176  10.962
  847   2HB   CYS 103           HB1      CYS 103  -4.712  -7.313   9.814
  848    HA   PRO 104           HA       PRO 104  -1.667 -10.594  12.641
  849   1HB   PRO 104           HB2      PRO 104  -3.192 -13.043  12.585
  850   2HB   PRO 104           HB1      PRO 104  -2.363 -12.304  13.963
  851   1HG   PRO 104           HG2      PRO 104  -5.203 -12.423  13.476
  852   2HG   PRO 104           HG1      PRO 104  -4.368 -11.680  14.848
  853   1HD   PRO 104           HD2      PRO 104  -5.709 -10.348  12.680
  854   2HD   PRO 104           HD1      PRO 104  -4.836  -9.606  14.035
  855    H    VAL 105           HN       VAL 105  -1.136 -10.022  10.414
  856    HA   VAL 105           HA       VAL 105  -2.339 -11.459   8.190
  857    HB   VAL 105           HB       VAL 105  -1.340  -9.218   7.897
  858   1HG1  VAL 105          HG12      VAL 105   0.710 -10.251   9.476
  859   2HG1  VAL 105          HG11      VAL 105   1.436 -10.124   7.874
  860   3HG1  VAL 105          HG13      VAL 105   0.731  -8.700   8.638
  861   1HG2  VAL 105          HG23      VAL 105   0.092 -11.438   6.402
  862   2HG2  VAL 105          HG22      VAL 105  -1.449 -10.709   5.952
  863   3HG2  VAL 105          HG21      VAL 105   0.031  -9.752   5.888
  864    H    LYS 106           HN       LYS 106  -1.909 -13.579   7.763
  865    HA   LYS 106           HA       LYS 106   0.800 -14.567   7.630
  866   1HB   LYS 106           HB2      LYS 106   0.478 -14.537  10.103
  867   2HB   LYS 106           HB1      LYS 106  -0.894 -15.629   9.911
  868   1HG   LYS 106           HG2      LYS 106   0.670 -17.263  10.180
  869   2HG   LYS 106           HG1      LYS 106   1.021 -16.954   8.481
  870   1HD   LYS 106           HD2      LYS 106   3.023 -15.999   8.947
  871   2HD   LYS 106           HD1      LYS 106   2.375 -15.102  10.321
  872   1HE   LYS 106           HE2      LYS 106   2.273 -17.527  11.408
  873   2HE   LYS 106           HE1      LYS 106   3.546 -17.852  10.232
  874   1HZ   LYS 106           HZ2      LYS 106   4.360 -15.521  11.215
  875   2HZ   LYS 106           HZ1      LYS 106   3.584 -16.158  12.586
  876   3HZ   LYS 106           HZ3      LYS 106   4.843 -17.023  11.849
  877    H    GLU 107           HN       GLU 107  -1.041 -14.651   5.677
  878    HA   GLU 107           HA       GLU 107  -1.686 -17.554   5.532
  879   1HB   GLU 107           HB2      GLU 107  -3.842 -17.003   4.403
  880   2HB   GLU 107           HB1      GLU 107  -3.806 -16.443   6.075
  881   1HG   GLU 107           HG2      GLU 107  -3.369 -14.183   5.404
  882   2HG   GLU 107           HG1      GLU 107  -3.052 -14.672   3.739
  883    H    ALA 108           HN       ALA 108   0.557 -16.538   4.481
  884    HA   ALA 108           HA       ALA 108   0.230 -17.085   1.661
  885   1HB   ALA 108           HB3      ALA 108  -0.445 -14.596   1.998
  886   2HB   ALA 108           HB2      ALA 108   1.279 -14.325   2.256
  887   3HB   ALA 108           HB1      ALA 108   0.711 -14.981   0.721
  888    H    ASP 109           HN       ASP 109   2.283 -17.409   0.659
  889    HA   ASP 109           HA       ASP 109   4.414 -18.013   2.578
  890   1HB   ASP 109           HB2      ASP 109   4.032 -18.505  -0.372
  891   2HB   ASP 109           HB1      ASP 109   5.589 -18.797   0.408
  892    H    GLN 110           HN       GLN 110   5.088 -16.684  -0.652
  893    HA   GLN 110           HA       GLN 110   6.011 -14.132   0.419
  894   1HB   GLN 110           HB2      GLN 110   7.780 -16.238   0.686
  895   2HB   GLN 110           HB1      GLN 110   8.285 -15.499  -0.830
  896   1HG   GLN 110           HG2      GLN 110   8.401 -13.306   0.282
  897   2HG   GLN 110           HG1      GLN 110   7.922 -14.049   1.805
  898   1HE2  GLN 110          HE22      GLN 110  11.097 -15.675   2.290
  899   2HE2  GLN 110          HE21      GLN 110   9.443 -15.801   2.647
  900    H    SER 111           HN       SER 111   4.710 -13.287  -1.285
  901    HA   SER 111           HA       SER 111   5.543 -13.982  -4.061
  902   1HB   SER 111           HB2      SER 111   3.059 -13.739  -3.160
  903   2HB   SER 111           HB1      SER 111   3.350 -12.028  -3.457
  904    HG   SER 111           HG       SER 111   2.720 -13.889  -5.206
  905    H    THR 112           HN       THR 112   6.781 -12.572  -5.239
  906    HA   THR 112           HA       THR 112   8.216 -10.468  -4.090
  907    HB   THR 112           HB       THR 112   8.623  -9.689  -6.438
  908    HG1  THR 112           HG1      THR 112   6.315 -10.936  -6.805
  909   1HG2  THR 112          HG21      THR 112   9.513 -11.917  -5.181
  910   2HG2  THR 112          HG23      THR 112   8.786 -12.643  -6.613
  911   3HG2  THR 112          HG22      THR 112  10.056 -11.432  -6.788
  912    H    LEU 113           HN       LEU 113   7.986  -8.209  -4.047
  913    HA   LEU 113           HA       LEU 113   5.294  -7.231  -3.734
  914   1HB   LEU 113           HB2      LEU 113   7.585  -6.398  -2.705
  915   2HB   LEU 113           HB1      LEU 113   7.602  -5.360  -4.132
  916    HG   LEU 113           HG       LEU 113   5.088  -5.533  -2.506
  917   1HD1  LEU 113          HD13      LEU 113   7.075  -5.131  -0.953
  918   2HD1  LEU 113          HD12      LEU 113   7.347  -3.633  -1.839
  919   3HD1  LEU 113          HD11      LEU 113   5.840  -3.873  -0.955
  920   1HD2  LEU 113          HD23      LEU 113   6.265  -3.883  -4.607
  921   2HD2  LEU 113          HD22      LEU 113   4.580  -4.028  -4.112
  922   3HD2  LEU 113          HD21      LEU 113   5.654  -2.913  -3.267
  923    H    GLU 114           HN       GLU 114   7.214  -7.641  -6.545
  924    HA   GLU 114           HA       GLU 114   6.411  -5.371  -8.064
  925   1HB   GLU 114           HB2      GLU 114   7.248  -8.171  -8.778
  926   2HB   GLU 114           HB1      GLU 114   6.711  -7.050 -10.030
  927   1HG   GLU 114           HG2      GLU 114   8.421  -5.428  -8.756
  928   2HG   GLU 114           HG1      GLU 114   9.166  -6.973  -8.343
  929    H    ASN 115           HN       ASN 115   4.920  -8.606  -7.792
  930    HA   ASN 115           HA       ASN 115   2.651  -7.834  -9.450
  931   1HB   ASN 115           HB2      ASN 115   3.741 -10.235  -8.799
  932   2HB   ASN 115           HB1      ASN 115   2.382 -10.189  -7.673
  933   1HD2  ASN 115          HD22      ASN 115   1.092 -11.618 -10.864
  934   2HD2  ASN 115          HD21      ASN 115   2.239 -12.085  -9.702
  935    H    PHE 116           HN       PHE 116   3.383  -7.535  -6.070
  936    HA   PHE 116           HA       PHE 116   0.621  -7.555  -5.148
  937   1HB   PHE 116           HB2      PHE 116   2.323  -7.996  -3.515
  938   2HB   PHE 116           HB1      PHE 116   3.194  -6.521  -3.930
  939    HD1  PHE 116           HD1      PHE 116  -0.227  -7.609  -2.831
  940    HD2  PHE 116           HD2      PHE 116   2.864  -4.636  -2.593
  941    HE1  PHE 116           HE1      PHE 116  -1.561  -6.356  -1.159
  942    HE2  PHE 116           HE2      PHE 116   1.529  -3.385  -0.920
  943    HZ   PHE 116           HZ       PHE 116  -0.683  -4.243  -0.203
  944    H    LEU 117           HN       LEU 117   2.984  -4.910  -5.644
  945    HA   LEU 117           HA       LEU 117   1.060  -2.825  -5.269
  946   1HB   LEU 117           HB2      LEU 117   3.853  -3.014  -5.815
  947   2HB   LEU 117           HB1      LEU 117   3.142  -1.952  -7.031
  948    HG   LEU 117           HG       LEU 117   3.824  -0.690  -5.005
  949   1HD1  LEU 117          HD12      LEU 117   1.817  -0.054  -6.417
  950   2HD1  LEU 117          HD11      LEU 117   0.807  -0.850  -5.211
  951   3HD1  LEU 117          HD13      LEU 117   1.778   0.551  -4.761
  952   1HD2  LEU 117          HD22      LEU 117   3.099  -2.843  -3.575
  953   2HD2  LEU 117          HD21      LEU 117   3.112  -1.225  -2.876
  954   3HD2  LEU 117          HD23      LEU 117   1.598  -1.928  -3.446
  955    H    GLU 118           HN       GLU 118   2.058  -4.696  -8.115
  956    HA   GLU 118           HA       GLU 118   0.836  -3.013 -10.084
  957   1HB   GLU 118           HB2      GLU 118   2.286  -4.812 -10.810
  958   2HB   GLU 118           HB1      GLU 118   1.265  -6.014 -10.022
  959   1HG   GLU 118           HG2      GLU 118   0.869  -5.887 -12.488
  960   2HG   GLU 118           HG1      GLU 118  -0.576  -5.514 -11.547
  961    NH1  ARG 119           NH2      ARG 119  -4.083 -11.334 -10.439
  962    NH2  ARG 119           NH1      ARG 119  -2.207 -11.868 -11.576
  963    H    ARG 119           HN       ARG 119  -0.421  -5.928  -8.462
  964    HA   ARG 119           HA       ARG 119  -3.118  -5.600  -9.423
  965   1HB   ARG 119           HB2      ARG 119  -2.189  -7.074  -6.939
  966   2HB   ARG 119           HB1      ARG 119  -3.690  -7.339  -7.827
  967   1HG   ARG 119           HG2      ARG 119  -1.420  -7.506  -9.618
  968   2HG   ARG 119           HG1      ARG 119  -1.216  -8.617  -8.264
  969   1HD   ARG 119           HD2      ARG 119  -3.454  -9.555  -8.678
  970   2HD   ARG 119           HD1      ARG 119  -3.683  -8.433 -10.020
  971    HE   ARG 119           HE       ARG 119  -1.342  -9.759 -10.669
  972   1HH1  ARG 119          HH21      ARG 119  -4.597 -10.718  -9.845
  973   2HH1  ARG 119          HH22      ARG 119  -4.510 -12.177 -10.767
  974   1HH2  ARG 119          HH11      ARG 119  -1.270 -11.658 -11.855
  975   2HH2  ARG 119          HH12      ARG 119  -2.647 -12.708 -11.894
  976    H    LEU 120           HN       LEU 120  -1.341  -3.912  -7.005
  977    HA   LEU 120           HA       LEU 120  -3.625  -3.326  -5.299
  978   1HB   LEU 120           HB2      LEU 120  -0.902  -3.097  -4.996
  979   2HB   LEU 120           HB1      LEU 120  -1.384  -1.419  -5.255
  980    HG   LEU 120           HG       LEU 120  -2.434  -3.328  -3.151
  981   1HD1  LEU 120          HD13      LEU 120  -0.371  -1.356  -3.210
  982   2HD1  LEU 120          HD12      LEU 120  -1.679  -0.740  -2.199
  983   3HD1  LEU 120          HD11      LEU 120  -0.938  -2.297  -1.829
  984   1HD2  LEU 120          HD21      LEU 120  -3.544  -0.777  -4.267
  985   2HD2  LEU 120          HD23      LEU 120  -4.397  -2.209  -3.686
  986   3HD2  LEU 120          HD22      LEU 120  -3.695  -1.072  -2.535
  987    H    LYS 121           HN       LYS 121  -1.895  -1.631  -7.911
  988    HA   LYS 121           HA       LYS 121  -3.494   0.769  -7.778
  989   1HB   LYS 121           HB2      LYS 121  -1.214   0.411  -8.957
  990   2HB   LYS 121           HB1      LYS 121  -2.157  -0.291 -10.272
  991   1HG   LYS 121           HG2      LYS 121  -3.424   1.766 -10.533
  992   2HG   LYS 121           HG1      LYS 121  -2.633   2.474  -9.124
  993   1HD   LYS 121           HD2      LYS 121  -1.557   3.326 -11.135
  994   2HD   LYS 121           HD1      LYS 121  -0.437   2.248 -10.301
  995   1HE   LYS 121           HE2      LYS 121  -0.418   0.770 -12.015
  996   2HE   LYS 121           HE1      LYS 121  -2.170   0.839 -12.200
  997   1HZ   LYS 121           HZ2      LYS 121  -1.677   3.162 -13.178
  998   2HZ   LYS 121           HZ1      LYS 121  -0.108   2.553 -13.410
  999   3HZ   LYS 121           HZ3      LYS 121  -1.430   1.786 -14.145
 1000    H    THR 122           HN       THR 122  -3.663  -2.232  -9.579
 1001    HA   THR 122           HA       THR 122  -5.822  -1.494 -11.309
 1002    HB   THR 122           HB       THR 122  -5.997  -4.283 -10.854
 1003    HG1  THR 122           HG1      THR 122  -3.345  -3.872 -11.365
 1004   1HG2  THR 122          HG22      THR 122  -6.146  -3.070 -13.007
 1005   2HG2  THR 122          HG21      THR 122  -4.417  -2.734 -12.920
 1006   3HG2  THR 122          HG23      THR 122  -4.985  -4.396 -13.080
 1007    H    ILE 123           HN       ILE 123  -5.970  -3.686  -8.489
 1008    HA   ILE 123           HA       ILE 123  -8.767  -3.829  -8.275
 1009    HB   ILE 123           HB       ILE 123  -6.718  -3.770  -6.035
 1010   1HG1  ILE 123          HG12      ILE 123  -6.125  -5.790  -6.878
 1011   2HG1  ILE 123          HG11      ILE 123  -7.660  -6.360  -6.242
 1012   1HG2  ILE 123          HG23      ILE 123  -9.637  -4.557  -6.064
 1013   2HG2  ILE 123          HG22      ILE 123  -8.524  -5.007  -4.772
 1014   3HG2  ILE 123          HG21      ILE 123  -8.864  -3.307  -5.088
 1015   1HD1  ILE 123          HD13      ILE 123  -8.711  -5.774  -8.451
 1016   2HD1  ILE 123          HD12      ILE 123  -7.095  -5.420  -9.063
 1017   3HD1  ILE 123          HD11      ILE 123  -7.502  -7.051  -8.543
 1018    H    MET 124           HN       MET 124  -6.579  -1.346  -7.020
 1019    HA   MET 124           HA       MET 124  -8.389   0.056  -5.403
 1020   1HB   MET 124           HB2      MET 124  -6.012   0.964  -7.002
 1021   2HB   MET 124           HB1      MET 124  -6.958   2.102  -6.046
 1022   1HG   MET 124           HG2      MET 124  -5.973  -0.458  -4.814
 1023   2HG   MET 124           HG1      MET 124  -4.910   0.944  -4.929
 1024   1HE   MET 124           HE3      MET 124  -4.397   1.509  -3.002
 1025   2HE   MET 124           HE2      MET 124  -5.156   3.098  -3.080
 1026   3HE   MET 124           HE1      MET 124  -5.363   2.097  -1.643
 1027    NH1  ARG 125           NH2      ARG 125  -7.751   5.803 -14.494
 1028    NH2  ARG 125           NH1      ARG 125  -8.326   4.288 -16.066
 1029    H    ARG 125           HN       ARG 125  -7.547   0.987  -8.750
 1030    HA   ARG 125           HA       ARG 125  -9.759   2.822  -8.955
 1031   1HB   ARG 125           HB2      ARG 125  -7.721   3.055 -10.308
 1032   2HB   ARG 125           HB1      ARG 125  -8.091   1.536 -11.130
 1033   1HG   ARG 125           HG2      ARG 125  -9.874   2.442 -12.306
 1034   2HG   ARG 125           HG1      ARG 125 -10.179   3.686 -11.094
 1035   1HD   ARG 125           HD2      ARG 125  -8.960   5.142 -12.298
 1036   2HD   ARG 125           HD1      ARG 125  -7.547   4.104 -12.103
 1037    HE   ARG 125           HE       ARG 125  -8.997   2.913 -14.150
 1038   1HH1  ARG 125          HH21      ARG 125  -7.676   6.085 -13.539
 1039   2HH1  ARG 125          HH22      ARG 125  -7.452   6.426 -15.218
 1040   1HH2  ARG 125          HH11      ARG 125  -8.695   3.394 -16.318
 1041   2HH2  ARG 125          HH12      ARG 125  -8.022   4.922 -16.777
 1042    H    GLU 126           HN       GLU 126  -9.749  -0.569  -9.117
 1043    HA   GLU 126           HA       GLU 126 -11.822  -0.791 -11.156
 1044   1HB   GLU 126           HB2      GLU 126 -10.018  -2.545 -10.337
 1045   2HB   GLU 126           HB1      GLU 126 -11.281  -2.973  -9.183
 1046   1HG   GLU 126           HG2      GLU 126 -12.495  -2.661 -11.756
 1047   2HG   GLU 126           HG1      GLU 126 -11.091  -3.715 -11.932
 1048    H    LYS 127           HN       LYS 127 -11.890  -1.697  -7.676
 1049    HA   LYS 127           HA       LYS 127 -14.834  -1.402  -7.760
 1050   1HB   LYS 127           HB2      LYS 127 -12.905  -2.570  -5.764
 1051   2HB   LYS 127           HB1      LYS 127 -14.597  -2.290  -5.350
 1052   1HG   LYS 127           HG2      LYS 127 -15.282  -4.072  -6.556
 1053   2HG   LYS 127           HG1      LYS 127 -14.322  -3.582  -7.950
 1054   1HD   LYS 127           HD2      LYS 127 -12.926  -5.291  -7.506
 1055   2HD   LYS 127           HD1      LYS 127 -12.457  -4.459  -6.024
 1056   1HE   LYS 127           HE2      LYS 127 -14.703  -5.519  -5.103
 1057   2HE   LYS 127           HE1      LYS 127 -14.434  -6.675  -6.407
 1058   1HZ   LYS 127           HZ2      LYS 127 -11.988  -6.305  -5.177
 1059   2HZ   LYS 127           HZ1      LYS 127 -13.114  -6.470  -3.915
 1060   3HZ   LYS 127           HZ3      LYS 127 -12.981  -7.681  -5.095
 1061    OH   TYR 128           OH       TYR 128 -10.395  -2.564  -1.729
 1062    H    TYR 128           HN       TYR 128 -12.077   0.315  -6.356
 1063    HA   TYR 128           HA       TYR 128 -13.881   1.864  -4.628
 1064   1HB   TYR 128           HB2      TYR 128 -10.973   2.443  -5.211
 1065   2HB   TYR 128           HB1      TYR 128 -11.926   3.001  -3.835
 1066    HD1  TYR 128           HD2      TYR 128 -13.446   0.440  -3.292
 1067    HD2  TYR 128           HD1      TYR 128  -9.303   1.178  -4.093
 1068    HE1  TYR 128           HE2      TYR 128 -12.844  -1.635  -2.076
 1069    HE2  TYR 128           HE1      TYR 128  -8.689  -0.900  -2.884
 1070    HH   TYR 128           HH       TYR 128 -10.793  -2.528  -0.856
 1071    H    SER 129           HN       SER 129 -13.559   1.948  -7.857
 1072    HA   SER 129           HA       SER 129 -13.021   4.693  -8.436
 1073   1HB   SER 129           HB2      SER 129 -13.679   2.417  -9.914
 1074   2HB   SER 129           HB1      SER 129 -15.049   3.497 -10.163
 1075    HG   SER 129           HG       SER 129 -13.608   5.091 -10.830
 1076    H    LYS 130           HN       LYS 130 -15.770   3.085  -7.019
 1077    HA   LYS 130           HA       LYS 130 -17.153   5.712  -6.931
 1078   1HB   LYS 130           HB2      LYS 130 -18.020   4.009  -8.726
 1079   2HB   LYS 130           HB1      LYS 130 -18.759   3.204  -7.347
 1080   1HG   LYS 130           HG2      LYS 130 -19.398   5.844  -6.882
 1081   2HG   LYS 130           HG1      LYS 130 -19.486   5.740  -8.640
 1082   1HD   LYS 130           HD2      LYS 130 -21.037   3.887  -8.518
 1083   2HD   LYS 130           HD1      LYS 130 -20.844   3.784  -6.768
 1084   1HE   LYS 130           HE2      LYS 130 -22.265   5.513  -6.388
 1085   2HE   LYS 130           HE1      LYS 130 -21.627   6.453  -7.737
 1086   1HZ   LYS 130           HZ3      LYS 130 -23.226   4.050  -8.283
 1087   2HZ   LYS 130           HZ2      LYS 130 -24.018   5.486  -7.839
 1088   3HZ   LYS 130           HZ1      LYS 130 -23.033   5.448  -9.222
 1089    H    CYS 131           HN       CYS 131 -18.113   2.454  -5.771
 1090    HA   CYS 131           HA       CYS 131 -17.317   2.831  -3.064
 1091   1HB   CYS 131           HB2      CYS 131 -19.159   4.658  -3.414
 1092   2HB   CYS 131           HB1      CYS 131 -20.277   3.299  -3.353
 1093    H    SER 132           HN       SER 132 -17.071   0.596  -4.446
 1094    HA   SER 132           HA       SER 132 -19.224  -1.208  -4.665
 1095   1HB   SER 132           HB2      SER 132 -16.439  -1.345  -4.928
 1096   2HB   SER 132           HB1      SER 132 -16.825  -2.530  -3.684
 1097    HG   SER 132           HG       SER 132 -18.000  -2.308  -6.265
 1098    H    SER 133           HN       SER 133 -20.563  -2.027  -3.129
 1099    HA   SER 133           HA       SER 133 -19.981  -1.616  -0.292
 1100   1HB   SER 133           HB2      SER 133 -22.289  -1.447  -1.315
 1101   2HB   SER 133           HB1      SER 133 -22.254  -3.194  -1.526
 1102    HG   SER 133           HG       SER 133 -22.353  -1.656   0.818
   
  Start of MODEL          13
 Raw file had 1102 H/Q atoms
  Start of MODEL   13
    1   1H    GLU   1           HT3      GLU   1 -31.111   6.928  10.265
    2   2H    GLU   1           HT2      GLU   1 -32.238   5.657  10.223
    3   3H    GLU   1           HT1      GLU   1 -30.721   5.428  10.952
    4    HA   GLU   1           HA       GLU   1 -29.738   4.925   9.039
    5   1HB   GLU   1           HB2      GLU   1 -32.628   4.989   8.124
    6   2HB   GLU   1           HB1      GLU   1 -31.312   4.262   7.201
    7   1HG   GLU   1           HG2      GLU   1 -30.878   2.648   8.931
    8   2HG   GLU   1           HG1      GLU   1 -31.962   3.473  10.052
    9    H    ALA   2           HN       ALA   2 -28.697   5.919   7.310
   10    HA   ALA   2           HA       ALA   2 -29.887   8.040   5.755
   11   1HB   ALA   2           HB3      ALA   2 -28.182   8.749   8.123
   12   2HB   ALA   2           HB2      ALA   2 -28.106   9.750   6.673
   13   3HB   ALA   2           HB1      ALA   2 -29.637   9.544   7.523
   14    H    GLU   3           HN       GLU   3 -26.627   7.280   7.060
   15    HA   GLU   3           HA       GLU   3 -25.763   6.362   4.410
   16   1HB   GLU   3           HB2      GLU   3 -25.270   9.092   5.339
   17   2HB   GLU   3           HB1      GLU   3 -23.779   8.230   4.961
   18   1HG   GLU   3           HG2      GLU   3 -25.950   7.839   2.999
   19   2HG   GLU   3           HG1      GLU   3 -25.337   9.490   3.097
   20    H    ALA   4           HN       ALA   4 -24.401   4.686   4.810
   21    HA   ALA   4           HA       ALA   4 -23.343   4.249   7.484
   22   1HB   ALA   4           HB1      ALA   4 -22.831   2.793   4.874
   23   2HB   ALA   4           HB3      ALA   4 -22.265   2.249   6.452
   24   3HB   ALA   4           HB2      ALA   4 -23.994   2.333   6.117
   25    H    HIS   5           HN       HIS   5 -21.604   4.414   4.351
   26    HA   HIS   5           HA       HIS   5 -19.562   6.104   5.708
   27   1HB   HIS   5           HB2      HIS   5 -17.758   4.777   4.937
   28   2HB   HIS   5           HB1      HIS   5 -18.922   3.601   5.543
   29    HD1  HIS   5           HD1      HIS   5 -20.168   2.139   3.813
   30    HD2  HIS   5           HD2      HIS   5 -17.465   4.808   2.097
   31    HE1  HIS   5           HE1      HIS   5 -19.914   1.443   1.392
   32    H    LYS   6           HN       LYS   6 -18.198   7.262   4.069
   33    HA   LYS   6           HA       LYS   6 -19.768   7.704   1.559
   34   1HB   LYS   6           HB2      LYS   6 -18.515  10.014   1.667
   35   2HB   LYS   6           HB1      LYS   6 -19.954   9.751   2.650
   36   1HG   LYS   6           HG2      LYS   6 -17.319   8.994   3.832
   37   2HG   LYS   6           HG1      LYS   6 -17.699  10.709   3.712
   38   1HD   LYS   6           HD2      LYS   6 -19.994  10.043   4.744
   39   2HD   LYS   6           HD1      LYS   6 -19.164   8.566   5.234
   40   1HE   LYS   6           HE2      LYS   6 -18.647   9.831   7.074
   41   2HE   LYS   6           HE1      LYS   6 -17.334  10.377   6.033
   42   1HZ   LYS   6           HZ3      LYS   6 -19.210  12.043   5.256
   43   2HZ   LYS   6           HZ2      LYS   6 -19.771  11.765   6.836
   44   3HZ   LYS   6           HZ1      LYS   6 -18.207  12.376   6.582
   45    H    CYS   7           HN       CYS   7 -18.515   6.065   0.492
   46    HA   CYS   7           HA       CYS   7 -15.710   5.901   0.311
   47   1HB   CYS   7           HB2      CYS   7 -16.472   4.188  -0.958
   48   2HB   CYS   7           HB1      CYS   7 -18.006   5.005  -1.262
   49    H    ASP   8           HN       ASP   8 -17.885   8.235  -1.118
   50    HA   ASP   8           HA       ASP   8 -16.409   9.239  -3.250
   51   1HB   ASP   8           HB2      ASP   8 -18.147  10.665  -1.237
   52   2HB   ASP   8           HB1      ASP   8 -17.482  11.469  -2.659
   53    H    ILE   9           HN       ILE   9 -15.946  10.118   0.194
   54    HA   ILE   9           HA       ILE   9 -13.731  11.870  -0.665
   55    HB   ILE   9           HB       ILE   9 -14.897  13.001   0.958
   56   1HG1  ILE   9          HG12      ILE   9 -13.050  11.645   2.885
   57   2HG1  ILE   9          HG11      ILE   9 -12.372  12.516   1.509
   58   1HG2  ILE   9          HG22      ILE   9 -15.473  10.326   2.073
   59   2HG2  ILE   9          HG21      ILE   9 -15.299  11.615   3.261
   60   3HG2  ILE   9          HG23      ILE   9 -16.497  11.756   1.976
   61   1HD1  ILE   9          HD13      ILE   9 -14.092  14.390   2.306
   62   2HD1  ILE   9          HD12      ILE   9 -13.899  13.567   3.853
   63   3HD1  ILE   9          HD11      ILE   9 -12.492  14.247   3.037
   64    H    THR  10           HN       THR  10 -13.634   9.830   2.244
   65    HA   THR  10           HA       THR  10 -10.915   9.480   2.358
   66    HB   THR  10           HB       THR  10 -12.712   7.169   3.017
   67    HG1  THR  10           HG1      THR  10 -13.523   8.276   4.682
   68   1HG2  THR  10          HG22      THR  10 -10.078   8.239   3.823
   69   2HG2  THR  10          HG21      THR  10 -11.092   7.674   5.150
   70   3HG2  THR  10          HG23      THR  10 -10.673   6.579   3.833
   71    H    LEU  11           HN       LEU  11 -13.078   7.467   0.327
   72    HA   LEU  11           HA       LEU  11 -10.826   5.717  -0.321
   73   1HB   LEU  11           HB2      LEU  11 -13.638   5.541  -0.503
   74   2HB   LEU  11           HB1      LEU  11 -13.010   5.369  -2.143
   75    HG   LEU  11           HG       LEU  11 -11.431   3.638  -1.361
   76   1HD1  LEU  11          HD11      LEU  11 -12.058   4.734   1.180
   77   2HD1  LEU  11          HD13      LEU  11 -12.630   3.066   1.191
   78   3HD1  LEU  11          HD12      LEU  11 -10.941   3.417   0.823
   79   1HD2  LEU  11          HD23      LEU  11 -13.862   3.133  -2.052
   80   2HD2  LEU  11          HD22      LEU  11 -13.011   1.881  -1.149
   81   3HD2  LEU  11          HD21      LEU  11 -14.177   2.920  -0.330
   82    H    GLN  12           HN       GLN  12 -12.218   8.579  -1.818
   83    HA   GLN  12           HA       GLN  12 -10.983   7.969  -4.394
   84   1HB   GLN  12           HB2      GLN  12 -12.174   9.737  -5.164
   85   2HB   GLN  12           HB1      GLN  12 -12.962   9.705  -3.595
   86   1HG   GLN  12           HG2      GLN  12 -12.318  11.927  -3.708
   87   2HG   GLN  12           HG1      GLN  12 -10.914  11.253  -2.892
   88   1HE2  GLN  12          HE22      GLN  12  -9.022  12.802  -5.477
   89   2HE2  GLN  12          HE21      GLN  12  -9.401  12.801  -3.822
   90    H    GLU  13           HN       GLU  13 -10.043   9.624  -1.457
   91    HA   GLU  13           HA       GLU  13  -7.603  10.717  -2.692
   92   1HB   GLU  13           HB2      GLU  13  -8.835  10.792   0.052
   93   2HB   GLU  13           HB1      GLU  13  -7.127  11.191  -0.149
   94   1HG   GLU  13           HG2      GLU  13  -8.016  12.715  -2.106
   95   2HG   GLU  13           HG1      GLU  13  -9.541  12.614  -1.226
   96    H    ILE  14           HN       ILE  14  -8.616   7.979  -0.721
   97    HA   ILE  14           HA       ILE  14  -5.988   7.068   0.016
   98    HB   ILE  14           HB       ILE  14  -8.736   6.023   0.069
   99   1HG1  ILE  14          HG12      ILE  14  -6.621   4.954   1.850
  100   2HG1  ILE  14          HG11      ILE  14  -6.841   6.703   1.901
  101   1HG2  ILE  14          HG22      ILE  14  -6.414   4.151  -0.466
  102   2HG2  ILE  14          HG21      ILE  14  -7.944   3.626   0.234
  103   3HG2  ILE  14          HG23      ILE  14  -7.908   4.301  -1.391
  104   1HD1  ILE  14          HD11      ILE  14  -9.443   5.618   1.884
  105   2HD1  ILE  14          HD13      ILE  14  -8.522   4.629   3.017
  106   3HD1  ILE  14          HD12      ILE  14  -8.615   6.375   3.246
  107    H    ILE  15           HN       ILE  15  -8.032   6.653  -2.829
  108    HA   ILE  15           HA       ILE  15  -6.347   4.683  -4.130
  109    HB   ILE  15           HB       ILE  15  -8.649   6.418  -4.893
  110   1HG1  ILE  15          HG12      ILE  15  -9.605   4.352  -5.566
  111   2HG1  ILE  15          HG11      ILE  15  -8.027   3.576  -5.704
  112   1HG2  ILE  15          HG21      ILE  15  -6.569   5.388  -6.821
  113   2HG2  ILE  15          HG23      ILE  15  -8.246   5.610  -7.316
  114   3HG2  ILE  15          HG22      ILE  15  -7.305   6.990  -6.750
  115   1HD1  ILE  15          HD12      ILE  15  -8.925   4.667  -3.056
  116   2HD1  ILE  15          HD11      ILE  15  -9.506   3.096  -3.597
  117   3HD1  ILE  15          HD13      ILE  15  -7.778   3.373  -3.388
  118    H    LYS  16           HN       LYS  16  -6.678   8.226  -4.327
  119    HA   LYS  16           HA       LYS  16  -4.797   8.699  -6.378
  120   1HB   LYS  16           HB2      LYS  16  -6.190  10.493  -5.476
  121   2HB   LYS  16           HB1      LYS  16  -5.381  10.367  -3.914
  122   1HG   LYS  16           HG2      LYS  16  -3.622  11.603  -4.615
  123   2HG   LYS  16           HG1      LYS  16  -3.492  10.695  -6.122
  124   1HD   LYS  16           HD2      LYS  16  -4.046  12.929  -6.755
  125   2HD   LYS  16           HD1      LYS  16  -5.533  11.995  -6.928
  126   1HE   LYS  16           HE2      LYS  16  -6.560  13.044  -5.169
  127   2HE   LYS  16           HE1      LYS  16  -5.057  13.217  -4.261
  128   1HZ   LYS  16           HZ2      LYS  16  -4.579  14.806  -6.345
  129   2HZ   LYS  16           HZ1      LYS  16  -6.262  14.996  -6.209
  130   3HZ   LYS  16           HZ3      LYS  16  -5.261  15.351  -4.887
  131    H    THR  17           HN       THR  17  -4.309   8.017  -2.951
  132    HA   THR  17           HA       THR  17  -1.471   8.594  -2.945
  133    HB   THR  17           HB       THR  17  -2.819   6.634  -1.084
  134    HG1  THR  17           HG1      THR  17  -3.079   8.853   0.068
  135   1HG2  THR  17          HG22      THR  17  -0.664   8.740  -0.730
  136   2HG2  THR  17          HG21      THR  17  -1.261   7.670   0.539
  137   3HG2  THR  17          HG23      THR  17  -0.397   7.001  -0.845
  138    H    LEU  18           HN       LEU  18  -3.414   5.655  -3.371
  139    HA   LEU  18           HA       LEU  18  -1.352   3.727  -3.497
  140   1HB   LEU  18           HB2      LEU  18  -4.050   3.654  -3.795
  141   2HB   LEU  18           HB1      LEU  18  -3.558   3.486  -5.478
  142    HG   LEU  18           HG       LEU  18  -3.764   1.279  -4.473
  143   1HD1  LEU  18          HD12      LEU  18  -1.871   1.841  -6.080
  144   2HD1  LEU  18          HD11      LEU  18  -0.819   1.927  -4.668
  145   3HD1  LEU  18          HD13      LEU  18  -1.623   0.413  -5.078
  146   1HD2  LEU  18          HD21      LEU  18  -3.073   2.437  -2.141
  147   2HD2  LEU  18          HD23      LEU  18  -2.903   0.703  -2.419
  148   3HD2  LEU  18          HD22      LEU  18  -1.506   1.766  -2.592
  149    H    ASN  19           HN       ASN  19  -2.542   5.945  -6.001
  150    HA   ASN  19           HA       ASN  19  -0.904   4.808  -8.106
  151   1HB   ASN  19           HB2      ASN  19  -2.986   6.182  -8.487
  152   2HB   ASN  19           HB1      ASN  19  -2.078   7.600  -7.965
  153   1HD2  ASN  19          HD22      ASN  19  -1.354   5.983 -11.648
  154   2HD2  ASN  19          HD21      ASN  19  -2.326   5.154 -10.531
  155    H    SER  20           HN       SER  20  -0.527   7.476  -5.807
  156    HA   SER  20           HA       SER  20   1.764   8.700  -6.902
  157   1HB   SER  20           HB2      SER  20   1.086   9.913  -5.086
  158   2HB   SER  20           HB1      SER  20   0.569   8.482  -4.196
  159    HG   SER  20           HG       SER  20   3.206   9.462  -4.579
  160    H    LEU  21           HN       LEU  21   1.506   5.786  -4.881
  161    HA   LEU  21           HA       LEU  21   4.375   5.500  -4.575
  162   1HB   LEU  21           HB2      LEU  21   2.254   3.337  -4.321
  163   2HB   LEU  21           HB1      LEU  21   3.885   3.300  -3.649
  164    HG   LEU  21           HG       LEU  21   1.690   5.251  -2.898
  165   1HD1  LEU  21          HD13      LEU  21   1.860   2.701  -2.090
  166   2HD1  LEU  21          HD12      LEU  21   3.035   3.398  -0.977
  167   3HD1  LEU  21          HD11      LEU  21   1.373   3.990  -0.988
  168   1HD2  LEU  21          HD23      LEU  21   4.619   5.042  -2.205
  169   2HD2  LEU  21          HD22      LEU  21   3.697   6.470  -2.672
  170   3HD2  LEU  21          HD21      LEU  21   3.481   5.767  -1.070
  171    H    THR  22           HN       THR  22   2.041   4.442  -6.978
  172    HA   THR  22           HA       THR  22   3.615   2.413  -8.223
  173    HB   THR  22           HB       THR  22   1.464   4.250  -9.282
  174    HG1  THR  22           HG1      THR  22   0.416   2.127  -9.331
  175   1HG2  THR  22          HG22      THR  22   2.997   2.052 -10.690
  176   2HG2  THR  22          HG21      THR  22   1.421   2.627 -11.237
  177   3HG2  THR  22          HG23      THR  22   2.799   3.728 -11.204
  178    H    GLU  23           HN       GLU  23   4.035   5.859  -8.237
  179    HA   GLU  23           HA       GLU  23   5.249   6.206 -10.780
  180   1HB   GLU  23           HB2      GLU  23   4.639   8.050  -9.162
  181   2HB   GLU  23           HB1      GLU  23   6.084   7.625  -8.239
  182   1HG   GLU  23           HG2      GLU  23   7.457   7.979 -10.292
  183   2HG   GLU  23           HG1      GLU  23   6.003   8.511 -11.138
  184    H    GLN  24           HN       GLN  24   6.468   4.676  -7.889
  185    HA   GLN  24           HA       GLN  24   8.903   3.895  -9.374
  186   1HB   GLN  24           HB2      GLN  24   9.224   6.106  -8.017
  187   2HB   GLN  24           HB1      GLN  24   9.231   5.040  -6.614
  188   1HG   GLN  24           HG2      GLN  24  10.905   3.818  -8.532
  189   2HG   GLN  24           HG1      GLN  24  11.342   5.527  -8.518
  190   1HE2  GLN  24          HE22      GLN  24  12.256   5.436  -4.985
  191   2HE2  GLN  24          HE21      GLN  24  11.428   6.433  -6.082
  192    H    LYS  25           HN       LYS  25   7.051   2.074  -8.876
  193    HA   LYS  25           HA       LYS  25   8.016   0.662  -6.419
  194   1HB   LYS  25           HB2      LYS  25   5.242   0.875  -7.574
  195   2HB   LYS  25           HB1      LYS  25   5.702  -0.495  -6.564
  196   1HG   LYS  25           HG2      LYS  25   6.340   2.264  -5.593
  197   2HG   LYS  25           HG1      LYS  25   4.676   1.695  -5.478
  198   1HD   LYS  25           HD2      LYS  25   5.200   0.041  -3.954
  199   2HD   LYS  25           HD1      LYS  25   6.855  -0.126  -4.539
  200   1HE   LYS  25           HE2      LYS  25   7.629   1.429  -3.090
  201   2HE   LYS  25           HE1      LYS  25   6.319   2.543  -3.472
  202   1HZ   LYS  25           HZ3      LYS  25   5.309   0.344  -2.019
  203   2HZ   LYS  25           HZ2      LYS  25   6.625   1.010  -1.184
  204   3HZ   LYS  25           HZ1      LYS  25   5.304   1.987  -1.601
  205    H    THR  26           HN       THR  26   9.594   0.001  -8.320
  206    HA   THR  26           HA       THR  26   8.637  -2.643  -9.252
  207    HB   THR  26           HB       THR  26   9.913  -2.020 -11.491
  208    HG1  THR  26           HG1      THR  26  10.510   0.042 -10.919
  209   1HG2  THR  26          HG23      THR  26   7.184  -1.994 -10.613
  210   2HG2  THR  26          HG22      THR  26   7.408  -0.724 -11.817
  211   3HG2  THR  26          HG21      THR  26   7.819  -2.394 -12.209
  212    H    LEU  27           HN       LEU  27  11.367  -0.355  -9.138
  213    HA   LEU  27           HA       LEU  27  13.358  -2.487  -9.192
  214   1HB   LEU  27           HB2      LEU  27  13.665  -0.046  -9.966
  215   2HB   LEU  27           HB1      LEU  27  13.787   0.358  -8.254
  216    HG   LEU  27           HG       LEU  27  15.574  -1.533  -8.163
  217   1HD1  LEU  27          HD13      LEU  27  15.450  -0.929 -11.133
  218   2HD1  LEU  27          HD12      LEU  27  16.793  -1.763 -10.350
  219   3HD1  LEU  27          HD11      LEU  27  15.187  -2.493 -10.361
  220   1HD2  LEU  27          HD22      LEU  27  15.898   1.020  -8.068
  221   2HD2  LEU  27          HD21      LEU  27  17.294   0.063  -8.564
  222   3HD2  LEU  27          HD23      LEU  27  16.332   0.910  -9.774
  223    H    CYS  28           HN       CYS  28  12.197  -0.203  -6.702
  224    HA   CYS  28           HA       CYS  28  13.629  -1.556  -4.572
  225   1HB   CYS  28           HB2      CYS  28  12.073   0.833  -4.881
  226   2HB   CYS  28           HB1      CYS  28  11.450  -0.077  -3.505
  227    H    THR  29           HN       THR  29  10.770  -2.332  -6.269
  228    HA   THR  29           HA       THR  29   9.485  -3.687  -3.985
  229    HB   THR  29           HB       THR  29   7.735  -4.257  -5.610
  230    HG1  THR  29           HG1      THR  29   8.946  -4.638  -7.424
  231   1HG2  THR  29          HG21      THR  29   7.780  -1.987  -4.592
  232   2HG2  THR  29          HG23      THR  29   8.691  -1.412  -5.989
  233   3HG2  THR  29          HG22      THR  29   7.040  -2.000  -6.193
  234    H    GLU  30           HN       GLU  30  12.157  -4.471  -5.602
  235    HA   GLU  30           HA       GLU  30  11.422  -7.215  -6.378
  236   1HB   GLU  30           HB2      GLU  30  13.554  -5.350  -6.968
  237   2HB   GLU  30           HB1      GLU  30  14.223  -6.901  -6.457
  238   1HG   GLU  30           HG2      GLU  30  11.938  -6.910  -8.387
  239   2HG   GLU  30           HG1      GLU  30  13.541  -6.480  -8.989
  240    H    LEU  31           HN       LEU  31  11.583  -6.095  -3.429
  241    HA   LEU  31           HA       LEU  31  13.568  -8.001  -2.363
  242   1HB   LEU  31           HB2      LEU  31  11.743  -6.004  -0.976
  243   2HB   LEU  31           HB1      LEU  31  12.921  -7.025  -0.151
  244    HG   LEU  31           HG       LEU  31  13.595  -5.035  -2.338
  245   1HD1  LEU  31          HD12      LEU  31  12.814  -4.175  -0.006
  246   2HD1  LEU  31          HD11      LEU  31  14.359  -4.806   0.566
  247   3HD1  LEU  31          HD13      LEU  31  14.323  -3.546  -0.669
  248   1HD2  LEU  31          HD23      LEU  31  15.155  -7.012  -0.702
  249   2HD2  LEU  31          HD22      LEU  31  15.302  -6.624  -2.416
  250   3HD2  LEU  31          HD21      LEU  31  15.931  -5.509  -1.202
  251    H    THR  32           HN       THR  32  10.794  -7.726  -0.315
  252    HA   THR  32           HA       THR  32   9.146  -9.724  -1.549
  253    HB   THR  32           HB       THR  32   9.825 -11.361   0.523
  254    HG1  THR  32           HG1      THR  32  12.299 -10.536  -0.516
  255   1HG2  THR  32          HG21      THR  32  10.002 -11.321  -2.313
  256   2HG2  THR  32          HG23      THR  32  11.525 -11.973  -1.712
  257   3HG2  THR  32          HG22      THR  32   9.999 -12.729  -1.252
  258    H    VAL  33           HN       VAL  33   7.160  -9.538  -0.623
  259    HA   VAL  33           HA       VAL  33   7.019  -8.562   2.195
  260    HB   VAL  33           HB       VAL  33   5.002  -7.282   1.547
  261   1HG1  VAL  33          HG13      VAL  33   7.250  -6.229   1.451
  262   2HG1  VAL  33          HG12      VAL  33   7.381  -6.704  -0.242
  263   3HG1  VAL  33          HG11      VAL  33   6.149  -5.544   0.256
  264   1HG2  VAL  33          HG22      VAL  33   4.972  -8.982  -0.655
  265   2HG2  VAL  33          HG21      VAL  33   3.973  -7.542  -0.459
  266   3HG2  VAL  33          HG23      VAL  33   5.499  -7.445  -1.340
  267    H    THR  34           HN       THR  34   3.888  -8.915   1.584
  268    HA   THR  34           HA       THR  34   3.959 -11.899   1.847
  269    HB   THR  34           HB       THR  34   2.908  -9.854   3.650
  270    HG1  THR  34           HG1      THR  34   3.552 -11.345   4.963
  271   1HG2  THR  34          HG21      THR  34   1.032 -12.036   2.700
  272   2HG2  THR  34          HG23      THR  34   0.800 -11.093   4.171
  273   3HG2  THR  34          HG22      THR  34   0.764 -10.295   2.601
  274    H    ASP  35           HN       ASP  35   2.515 -12.974   0.512
  275    HA   ASP  35           HA       ASP  35   0.997 -11.371  -1.420
  276   1HB   ASP  35           HB2      ASP  35   0.258 -13.659  -2.272
  277   2HB   ASP  35           HB1      ASP  35   1.987 -13.345  -2.348
  278    H    ILE  36           HN       ILE  36  -1.202 -11.079  -1.439
  279    HA   ILE  36           HA       ILE  36  -2.785 -12.493   0.657
  280    HB   ILE  36           HB       ILE  36  -3.527 -10.560   1.617
  281   1HG1  ILE  36          HG12      ILE  36  -3.314  -9.368  -1.158
  282   2HG1  ILE  36          HG11      ILE  36  -4.779  -9.707  -0.236
  283   1HG2  ILE  36          HG22      ILE  36  -0.992 -10.464   1.559
  284   2HG2  ILE  36          HG21      ILE  36  -1.136  -9.369   0.183
  285   3HG2  ILE  36          HG23      ILE  36  -1.781  -8.898   1.754
  286   1HD1  ILE  36          HD11      ILE  36  -3.446  -8.064   1.488
  287   2HD1  ILE  36          HD13      ILE  36  -2.941  -7.403  -0.066
  288   3HD1  ILE  36          HD12      ILE  36  -4.655  -7.507   0.332
  289    H    PHE  37           HN       PHE  37  -2.477 -12.001  -2.602
  290    HA   PHE  37           HA       PHE  37  -5.421 -11.926  -3.070
  291   1HB   PHE  37           HB2      PHE  37  -3.080 -11.470  -4.943
  292   2HB   PHE  37           HB1      PHE  37  -4.766 -11.511  -5.460
  293    HD1  PHE  37           HD2      PHE  37  -6.321 -10.050  -3.673
  294    HD2  PHE  37           HD1      PHE  37  -2.225  -9.320  -4.745
  295    HE1  PHE  37           HE2      PHE  37  -6.578  -7.670  -3.035
  296    HE2  PHE  37           HE1      PHE  37  -2.483  -6.938  -4.107
  297    HZ   PHE  37           HZ       PHE  37  -4.661  -6.113  -3.254
  298    H    ALA  38           HN       ALA  38  -3.810 -14.291  -2.136
  299    HA   ALA  38           HA       ALA  38  -4.058 -16.060  -4.520
  300   1HB   ALA  38           HB1      ALA  38  -2.474 -16.150  -1.990
  301   2HB   ALA  38           HB3      ALA  38  -2.944 -17.684  -2.722
  302   3HB   ALA  38           HB2      ALA  38  -1.975 -16.529  -3.638
  303    H    ALA  39           HN       ALA  39  -5.216 -15.628  -1.206
  304    HA   ALA  39           HA       ALA  39  -7.225 -17.777  -1.753
  305   1HB   ALA  39           HB1      ALA  39  -5.443 -18.074   0.146
  306   2HB   ALA  39           HB3      ALA  39  -6.458 -16.935   1.030
  307   3HB   ALA  39           HB2      ALA  39  -7.128 -18.470   0.480
  308    H    SER  40           HN       SER  40  -7.905 -15.341  -2.687
  309    HA   SER  40           HA       SER  40  -9.388 -13.869  -0.595
  310   1HB   SER  40           HB2      SER  40  -8.119 -12.743  -2.510
  311   2HB   SER  40           HB1      SER  40  -9.384 -13.343  -3.578
  312    HG   SER  40           HG       SER  40 -10.877 -12.268  -2.108
  313    H    LYS  41           HN       LYS  41 -10.607 -16.109  -0.399
  314    HA   LYS  41           HA       LYS  41 -12.885 -16.118  -2.338
  315   1HB   LYS  41           HB2      LYS  41 -12.146 -18.399  -0.507
  316   2HB   LYS  41           HB1      LYS  41 -13.132 -18.446  -1.969
  317   1HG   LYS  41           HG2      LYS  41 -11.109 -17.805  -3.293
  318   2HG   LYS  41           HG1      LYS  41 -10.151 -17.918  -1.817
  319   1HD   LYS  41           HD2      LYS  41 -11.280 -20.314  -1.662
  320   2HD   LYS  41           HD1      LYS  41 -11.448 -20.100  -3.406
  321   1HE   LYS  41           HE2      LYS  41  -8.797 -19.362  -2.346
  322   2HE   LYS  41           HE1      LYS  41  -9.198 -21.071  -2.179
  323   1HZ   LYS  41           HZ1      LYS  41  -9.532 -19.577  -4.715
  324   2HZ   LYS  41           HZ3      LYS  41  -8.112 -20.417  -4.322
  325   3HZ   LYS  41           HZ2      LYS  41  -9.578 -21.259  -4.482
  326    H    ASP  42           HN       ASP  42 -12.175 -15.051   0.743
  327    HA   ASP  42           HA       ASP  42 -14.984 -14.843   1.430
  328   1HB   ASP  42           HB2      ASP  42 -14.751 -16.148   3.587
  329   2HB   ASP  42           HB1      ASP  42 -14.743 -17.139   2.127
  330    H    THR  43           HN       THR  43 -13.715 -12.661   1.273
  331    HA   THR  43           HA       THR  43 -13.130 -11.845   4.045
  332    HB   THR  43           HB       THR  43 -11.123 -10.620   2.399
  333    HG1  THR  43           HG1      THR  43 -10.063 -12.909   2.301
  334   1HG2  THR  43          HG21      THR  43 -11.134 -10.991   4.885
  335   2HG2  THR  43          HG23      THR  43 -10.835 -12.702   4.580
  336   3HG2  THR  43          HG22      THR  43  -9.640 -11.498   4.097
  337    H    THR  44           HN       THR  44 -12.633  -9.302   3.919
  338    HA   THR  44           HA       THR  44 -14.503  -8.163   1.885
  339    HB   THR  44           HB       THR  44 -14.765  -6.380   3.855
  340    HG1  THR  44           HG1      THR  44 -14.855  -7.693   5.818
  341   1HG2  THR  44          HG21      THR  44 -16.539  -7.768   2.750
  342   2HG2  THR  44          HG23      THR  44 -16.184  -9.051   3.908
  343   3HG2  THR  44          HG22      THR  44 -16.815  -7.505   4.473
  344    H    GLU  45           HN       GLU  45 -14.164  -5.609   1.904
  345    HA   GLU  45           HA       GLU  45 -11.388  -5.219   1.091
  346   1HB   GLU  45           HB2      GLU  45 -12.074  -3.109   0.257
  347   2HB   GLU  45           HB1      GLU  45 -13.470  -4.156  -0.002
  348   1HG   GLU  45           HG2      GLU  45 -14.289  -3.351   2.299
  349   2HG   GLU  45           HG1      GLU  45 -13.064  -2.089   2.160
  350    H    LYS  46           HN       LYS  46 -13.392  -4.293   3.869
  351    HA   LYS  46           HA       LYS  46 -11.514  -2.380   4.906
  352   1HB   LYS  46           HB2      LYS  46 -12.971  -2.169   6.637
  353   2HB   LYS  46           HB1      LYS  46 -14.033  -3.137   5.620
  354   1HG   LYS  46           HG2      LYS  46 -13.122  -5.200   6.721
  355   2HG   LYS  46           HG1      LYS  46 -12.209  -4.162   7.818
  356   1HD   LYS  46           HD2      LYS  46 -14.209  -4.692   8.989
  357   2HD   LYS  46           HD1      LYS  46 -14.446  -3.050   8.390
  358   1HE   LYS  46           HE2      LYS  46 -15.667  -3.971   6.427
  359   2HE   LYS  46           HE1      LYS  46 -15.488  -5.590   7.103
  360   1HZ   LYS  46           HZ1      LYS  46 -16.497  -3.901   9.095
  361   2HZ   LYS  46           HZ3      LYS  46 -17.437  -3.679   7.700
  362   3HZ   LYS  46           HZ2      LYS  46 -17.254  -5.233   8.361
  363    H    GLU  47           HN       GLU  47 -11.795  -5.898   5.206
  364    HA   GLU  47           HA       GLU  47  -9.647  -6.072   7.173
  365   1HB   GLU  47           HB2      GLU  47 -11.516  -7.893   5.939
  366   2HB   GLU  47           HB1      GLU  47  -9.881  -8.545   5.817
  367   1HG   GLU  47           HG2      GLU  47  -9.570  -8.566   8.137
  368   2HG   GLU  47           HG1      GLU  47 -10.835  -7.367   8.412
  369    H    THR  48           HN       THR  48  -9.933  -6.438   3.647
  370    HA   THR  48           HA       THR  48  -7.188  -7.244   3.232
  371    HB   THR  48           HB       THR  48  -9.383  -6.174   1.484
  372    HG1  THR  48           HG1      THR  48  -8.440  -8.181   0.371
  373   1HG2  THR  48          HG23      THR  48  -6.446  -6.299   0.810
  374   2HG2  THR  48          HG22      THR  48  -7.694  -6.405  -0.432
  375   3HG2  THR  48          HG21      THR  48  -7.567  -4.959   0.569
  376    H    PHE  49           HN       PHE  49  -8.659  -4.185   3.928
  377    HA   PHE  49           HA       PHE  49  -6.525  -2.582   2.739
  378   1HB   PHE  49           HB2      PHE  49  -8.973  -2.031   4.383
  379   2HB   PHE  49           HB1      PHE  49  -7.726  -0.793   4.270
  380    HD1  PHE  49           HD1      PHE  49  -8.651  -3.244   1.622
  381    HD2  PHE  49           HD2      PHE  49  -8.855   0.838   2.940
  382    HE1  PHE  49           HE1      PHE  49  -9.588  -2.587  -0.574
  383    HE2  PHE  49           HE2      PHE  49  -9.788   1.498   0.735
  384    HZ   PHE  49           HZ       PHE  49 -10.164  -0.222  -1.016
  385    H    CYS  50           HN       CYS  50  -7.484  -3.569   6.048
  386    HA   CYS  50           HA       CYS  50  -5.281  -2.129   7.285
  387   1HB   CYS  50           HB2      CYS  50  -6.404  -2.662   9.163
  388   2HB   CYS  50           HB1      CYS  50  -7.555  -3.573   8.182
  389    NH1  ARG  51           NH2      ARG  51  -6.911 -12.040   5.925
  390    NH2  ARG  51           NH1      ARG  51  -5.157 -13.063   6.913
  391    H    ARG  51           HN       ARG  51  -5.684  -5.355   5.935
  392    HA   ARG  51           HA       ARG  51  -3.298  -6.456   7.170
  393   1HB   ARG  51           HB2      ARG  51  -5.146  -7.304   4.954
  394   2HB   ARG  51           HB1      ARG  51  -3.613  -8.145   5.188
  395   1HG   ARG  51           HG2      ARG  51  -4.203  -8.719   7.466
  396   2HG   ARG  51           HG1      ARG  51  -5.658  -7.724   7.385
  397   1HD   ARG  51           HD2      ARG  51  -6.787  -9.508   6.599
  398   2HD   ARG  51           HD1      ARG  51  -5.771  -9.472   5.163
  399    HE   ARG  51           HE       ARG  51  -4.245 -10.793   7.092
  400   1HH1  ARG  51          HH21      ARG  51  -7.370 -11.216   5.599
  401   2HH1  ARG  51          HH22      ARG  51  -7.351 -12.931   5.807
  402   1HH2  ARG  51          HH11      ARG  51  -4.258 -13.019   7.351
  403   2HH2  ARG  51          HH12      ARG  51  -5.611 -13.945   6.791
  404    H    ALA  52           HN       ALA  52  -4.056  -5.202   3.916
  405    HA   ALA  52           HA       ALA  52  -1.365  -5.536   2.936
  406   1HB   ALA  52           HB1      ALA  52  -3.796  -4.049   2.009
  407   2HB   ALA  52           HB3      ALA  52  -2.245  -3.787   1.212
  408   3HB   ALA  52           HB2      ALA  52  -2.957  -5.400   1.245
  409    H    ALA  53           HN       ALA  53  -2.957  -3.010   4.769
  410    HA   ALA  53           HA       ALA  53  -0.928  -1.000   4.137
  411   1HB   ALA  53           HB2      ALA  53  -3.401  -1.127   5.697
  412   2HB   ALA  53           HB1      ALA  53  -2.151  -0.145   6.452
  413   3HB   ALA  53           HB3      ALA  53  -2.702   0.228   4.818
  414    H    THR  54           HN       THR  54  -1.533  -3.330   6.739
  415    HA   THR  54           HA       THR  54   0.524  -2.345   8.502
  416    HB   THR  54           HB       THR  54  -0.495  -5.195   8.223
  417    HG1  THR  54           HG1      THR  54  -1.830  -4.424  10.043
  418   1HG2  THR  54          HG21      THR  54   1.601  -4.223   9.720
  419   2HG2  THR  54          HG23      THR  54   0.255  -4.138  10.858
  420   3HG2  THR  54          HG22      THR  54   0.675  -5.675  10.100
  421    H    VAL  55           HN       VAL  55   0.439  -4.738   5.898
  422    HA   VAL  55           HA       VAL  55   3.179  -5.577   6.158
  423    HB   VAL  55           HB       VAL  55   1.392  -5.577   3.690
  424   1HG1  VAL  55          HG11      VAL  55   4.018  -6.003   3.641
  425   2HG1  VAL  55          HG13      VAL  55   3.557  -7.575   4.294
  426   3HG1  VAL  55          HG12      VAL  55   2.929  -7.051   2.732
  427   1HG2  VAL  55          HG22      VAL  55   0.915  -6.839   6.100
  428   2HG2  VAL  55          HG21      VAL  55   0.330  -7.404   4.535
  429   3HG2  VAL  55          HG23      VAL  55   1.816  -8.069   5.213
  430    H    LEU  56           HN       LEU  56   1.538  -3.009   4.384
  431    HA   LEU  56           HA       LEU  56   3.827  -2.123   2.881
  432   1HB   LEU  56           HB2      LEU  56   1.100  -1.329   3.227
  433   2HB   LEU  56           HB1      LEU  56   2.117   0.087   3.501
  434    HG   LEU  56           HG       LEU  56   3.332  -0.990   1.313
  435   1HD1  LEU  56          HD13      LEU  56   1.470  -2.720   1.251
  436   2HD1  LEU  56          HD12      LEU  56   0.367  -1.400   0.861
  437   3HD1  LEU  56          HD11      LEU  56   1.688  -1.800  -0.236
  438   1HD2  LEU  56          HD22      LEU  56   2.204   1.351   1.904
  439   2HD2  LEU  56          HD21      LEU  56   2.580   0.918   0.236
  440   3HD2  LEU  56          HD23      LEU  56   0.934   0.738   0.845
  441    NH1  ARG  57           NH2      ARG  57   2.304  -0.156  13.029
  442    NH2  ARG  57           NH1      ARG  57   3.868   1.420  13.434
  443    H    ARG  57           HN       ARG  57   2.754  -1.669   6.174
  444    HA   ARG  57           HA       ARG  57   4.330   0.651   6.792
  445   1HB   ARG  57           HB2      ARG  57   3.044   0.384   8.638
  446   2HB   ARG  57           HB1      ARG  57   2.680  -1.286   8.207
  447   1HG   ARG  57           HG2      ARG  57   4.747  -2.057   9.222
  448   2HG   ARG  57           HG1      ARG  57   5.257  -0.394   9.532
  449   1HD   ARG  57           HD2      ARG  57   2.594  -0.963  10.598
  450   2HD   ARG  57           HD1      ARG  57   3.833  -2.010  11.292
  451    HE   ARG  57           HE       ARG  57   4.957   0.514  11.429
  452   1HH1  ARG  57          HH21      ARG  57   1.948  -0.914  12.484
  453   2HH1  ARG  57          HH22      ARG  57   1.797   0.157  13.831
  454   1HH2  ARG  57          HH11      ARG  57   4.725   1.876  13.195
  455   2HH2  ARG  57          HH12      ARG  57   3.347   1.721  14.233
  456    H    GLN  58           HN       GLN  58   4.883  -2.851   6.958
  457    HA   GLN  58           HA       GLN  58   7.527  -2.737   8.057
  458   1HB   GLN  58           HB2      GLN  58   5.846  -4.770   7.406
  459   2HB   GLN  58           HB1      GLN  58   6.948  -4.834   6.030
  460   1HG   GLN  58           HG2      GLN  58   8.802  -5.315   7.365
  461   2HG   GLN  58           HG1      GLN  58   8.065  -4.621   8.811
  462   1HE2  GLN  58          HE22      GLN  58   7.838  -8.519   8.484
  463   2HE2  GLN  58          HE21      GLN  58   9.072  -7.517   7.889
  464    H    PHE  59           HN       PHE  59   6.234  -2.295   4.816
  465    HA   PHE  59           HA       PHE  59   8.633  -2.511   3.316
  466   1HB   PHE  59           HB2      PHE  59   6.284  -2.236   2.385
  467   2HB   PHE  59           HB1      PHE  59   6.412  -0.521   2.774
  468    HD1  PHE  59           HD1      PHE  59   7.809  -3.261   0.724
  469    HD2  PHE  59           HD2      PHE  59   7.823   0.965   1.486
  470    HE1  PHE  59           HE1      PHE  59   9.105  -2.893  -1.354
  471    HE2  PHE  59           HE2      PHE  59   9.117   1.330  -0.596
  472    HZ   PHE  59           HZ       PHE  59   9.760  -0.595  -2.015
  473    OH   TYR  60           OH       TYR  60   5.497   3.951   9.832
  474    H    TYR  60           HN       TYR  60   7.127   0.466   4.650
  475    HA   TYR  60           HA       TYR  60   9.654   1.912   4.185
  476   1HB   TYR  60           HB2      TYR  60   8.445   3.849   4.452
  477   2HB   TYR  60           HB1      TYR  60   7.114   2.767   4.036
  478    HD1  TYR  60           HD2      TYR  60   5.863   1.603   5.942
  479    HD2  TYR  60           HD1      TYR  60   8.508   4.931   6.554
  480    HE1  TYR  60           HE2      TYR  60   4.822   2.024   8.152
  481    HE2  TYR  60           HE1      TYR  60   7.469   5.352   8.764
  482    HH   TYR  60           HH       TYR  60   6.166   3.820  10.508
  483    H    SER  61           HN       SER  61   8.836  -0.221   6.518
  484    HA   SER  61           HA       SER  61   9.695   1.400   8.823
  485   1HB   SER  61           HB2      SER  61   7.918  -0.296   9.115
  486   2HB   SER  61           HB1      SER  61   9.045  -1.556   8.618
  487    HG   SER  61           HG       SER  61   9.637  -1.589  10.627
  488    H    HIS  62           HN       HIS  62  10.796  -1.705   7.410
  489    HA   HIS  62           HA       HIS  62  13.468  -1.236   8.580
  490   1HB   HIS  62           HB2      HIS  62  12.115  -3.491   8.469
  491   2HB   HIS  62           HB1      HIS  62  12.805  -3.595   6.849
  492    HD1  HIS  62           HD1      HIS  62  15.178  -4.416   6.689
  493    HD2  HIS  62           HD2      HIS  62  14.209  -3.204  10.558
  494    HE1  HIS  62           HE1      HIS  62  17.154  -5.032   8.149
  495    H    HIS  63           HN       HIS  63  11.959  -1.426   5.359
  496    HA   HIS  63           HA       HIS  63  14.545  -1.223   4.020
  497   1HB   HIS  63           HB2      HIS  63  11.858  -0.717   2.747
  498   2HB   HIS  63           HB1      HIS  63  13.343  -1.257   1.971
  499    HD1  HIS  63           HD1      HIS  63  14.000  -3.747   2.218
  500    HD2  HIS  63           HD2      HIS  63  10.447  -2.765   4.171
  501    HE1  HIS  63           HE1      HIS  63  12.890  -5.940   2.835
  502    H    GLU  64           HN       GLU  64  12.868   1.075   5.725
  503    HA   GLU  64           HA       GLU  64  12.966   3.297   3.888
  504   1HB   GLU  64           HB2      GLU  64  11.690   4.056   5.594
  505   2HB   GLU  64           HB1      GLU  64  12.351   2.869   6.716
  506   1HG   GLU  64           HG2      GLU  64  14.306   4.266   7.120
  507   2HG   GLU  64           HG1      GLU  64  13.781   5.413   5.883
  508    H    LYS  65           HN       LYS  65  15.311   1.774   6.006
  509    HA   LYS  65           HA       LYS  65  17.327   3.770   5.057
  510   1HB   LYS  65           HB2      LYS  65  16.592   3.008   7.770
  511   2HB   LYS  65           HB1      LYS  65  18.306   2.724   7.460
  512   1HG   LYS  65           HG2      LYS  65  16.838   5.321   6.911
  513   2HG   LYS  65           HG1      LYS  65  17.895   5.024   8.291
  514   1HD   LYS  65           HD2      LYS  65  19.199   4.294   5.798
  515   2HD   LYS  65           HD1      LYS  65  18.675   5.980   5.775
  516   1HE   LYS  65           HE2      LYS  65  20.814   6.082   6.764
  517   2HE   LYS  65           HE1      LYS  65  19.716   6.120   8.144
  518   1HZ   LYS  65           HZ2      LYS  65  20.780   3.569   7.107
  519   2HZ   LYS  65           HZ1      LYS  65  21.669   4.502   8.214
  520   3HZ   LYS  65           HZ3      LYS  65  20.140   3.908   8.644
  521    H    ASP  66           HN       ASP  66  16.572   1.096   3.972
  522    HA   ASP  66           HA       ASP  66  18.929  -0.563   4.658
  523   1HB   ASP  66           HB2      ASP  66  16.334  -1.005   3.286
  524   2HB   ASP  66           HB1      ASP  66  17.693  -1.927   2.658
  525    H    THR  67           HN       THR  67  20.653  -0.840   3.284
  526    HA   THR  67           HA       THR  67  21.047   1.114   1.176
  527    HB   THR  67           HB       THR  67  22.723  -1.356   1.648
  528    HG1  THR  67           HG1      THR  67  22.307   0.893   3.222
  529   1HG2  THR  67          HG23      THR  67  22.948   1.082   0.090
  530   2HG2  THR  67          HG22      THR  67  24.288   0.930   1.228
  531   3HG2  THR  67          HG21      THR  67  23.969  -0.356   0.063
  532    NH1  ARG  68           NH2      ARG  68  19.210  -7.539   3.223
  533    NH2  ARG  68           NH1      ARG  68  21.398  -7.335   3.746
  534    H    ARG  68           HN       ARG  68  20.010  -2.236   1.298
  535    HA   ARG  68           HA       ARG  68  20.493  -3.004  -1.386
  536   1HB   ARG  68           HB2      ARG  68  18.605  -3.840   0.758
  537   2HB   ARG  68           HB1      ARG  68  18.176  -4.301  -0.889
  538   1HG   ARG  68           HG2      ARG  68  20.100  -5.601  -1.170
  539   2HG   ARG  68           HG1      ARG  68  20.972  -4.765   0.115
  540   1HD   ARG  68           HD2      ARG  68  18.682  -5.855   1.342
  541   2HD   ARG  68           HD1      ARG  68  19.310  -7.126   0.292
  542    HE   ARG  68           HE       ARG  68  21.560  -6.175   1.591
  543   1HH1  ARG  68          HH21      ARG  68  18.443  -7.382   2.603
  544   2HH1  ARG  68          HH22      ARG  68  19.058  -8.020   4.086
  545   1HH2  ARG  68          HH11      ARG  68  22.321  -7.017   3.524
  546   2HH2  ARG  68          HH12      ARG  68  21.230  -7.821   4.604
  547    H    CYS  69           HN       CYS  69  17.704  -1.274   0.020
  548    HA   CYS  69           HA       CYS  69  16.403  -1.105  -2.606
  549   1HB   CYS  69           HB2      CYS  69  15.513  -0.995   0.029
  550   2HB   CYS  69           HB1      CYS  69  15.333   0.660  -0.548
  551    H    LEU  70           HN       LEU  70  18.609   0.860  -0.769
  552    HA   LEU  70           HA       LEU  70  17.853   3.388  -1.926
  553   1HB   LEU  70           HB2      LEU  70  20.355   2.387  -0.568
  554   2HB   LEU  70           HB1      LEU  70  20.280   4.006  -1.263
  555    HG   LEU  70           HG       LEU  70  18.378   2.891   0.825
  556   1HD1  LEU  70          HD12      LEU  70  20.816   4.635   0.933
  557   2HD1  LEU  70          HD11      LEU  70  19.503   4.932   2.073
  558   3HD1  LEU  70          HD13      LEU  70  20.303   3.361   2.041
  559   1HD2  LEU  70          HD21      LEU  70  18.503   5.480  -0.713
  560   2HD2  LEU  70          HD23      LEU  70  17.105   4.458  -0.378
  561   3HD2  LEU  70          HD22      LEU  70  17.805   5.443   0.907
  562    H    GLY  71           HN       GLY  71  21.069   1.992  -2.530
  563   1HA   GLY  71           HA2      GLY  71  21.389   1.132  -4.942
  564   2HA   GLY  71           HA1      GLY  71  20.635   2.657  -5.409
  565    H    ALA  72           HN       ALA  72  22.936   2.567  -6.542
  566    HA   ALA  72           HA       ALA  72  24.942   3.777  -4.692
  567   1HB   ALA  72           HB2      ALA  72  25.335   1.659  -6.294
  568   2HB   ALA  72           HB1      ALA  72  25.707   2.939  -7.449
  569   3HB   ALA  72           HB3      ALA  72  26.618   2.816  -5.944
  570    H    THR  73           HN       THR  73  22.635   5.186  -5.991
  571    HA   THR  73           HA       THR  73  24.244   7.190  -7.533
  572    HB   THR  73           HB       THR  73  21.454   7.409  -8.163
  573    HG1  THR  73           HG1      THR  73  21.251   5.249  -7.652
  574   1HG2  THR  73          HG23      THR  73  23.853   6.494  -9.771
  575   2HG2  THR  73          HG22      THR  73  22.309   7.005 -10.451
  576   3HG2  THR  73          HG21      THR  73  23.312   8.161  -9.576
  577    H    ALA  74           HN       ALA  74  24.059   9.297  -6.805
  578    HA   ALA  74           HA       ALA  74  22.854   9.772  -4.229
  579   1HB   ALA  74           HB2      ALA  74  24.841  11.020  -5.218
  580   2HB   ALA  74           HB1      ALA  74  23.686  11.890  -6.227
  581   3HB   ALA  74           HB3      ALA  74  23.609  12.037  -4.471
  582    H    GLN  75           HN       GLN  75  21.801  10.350  -7.547
  583    HA   GLN  75           HA       GLN  75  19.618  12.094  -6.950
  584   1HB   GLN  75           HB2      GLN  75  19.958  10.071  -9.187
  585   2HB   GLN  75           HB1      GLN  75  18.702  11.310  -9.141
  586   1HG   GLN  75           HG2      GLN  75  21.488  12.255  -8.715
  587   2HG   GLN  75           HG1      GLN  75  21.096  11.693 -10.339
  588   1HE2  GLN  75          HE22      GLN  75  18.881  14.395 -11.039
  589   2HE2  GLN  75          HE21      GLN  75  19.363  12.838 -11.513
  590    H    GLN  76           HN       GLN  76  19.943   8.586  -6.892
  591    HA   GLN  76           HA       GLN  76  17.155   7.980  -6.583
  592   1HB   GLN  76           HB2      GLN  76  19.717   6.558  -6.371
  593   2HB   GLN  76           HB1      GLN  76  18.477   5.947  -5.273
  594   1HG   GLN  76           HG2      GLN  76  17.749   6.508  -8.130
  595   2HG   GLN  76           HG1      GLN  76  18.615   5.021  -7.740
  596   1HE2  GLN  76          HE22      GLN  76  14.836   4.589  -7.405
  597   2HE2  GLN  76          HE21      GLN  76  15.779   5.277  -8.638
  598    H    PHE  77           HN       PHE  77  19.641   9.015  -4.353
  599    HA   PHE  77           HA       PHE  77  18.409   8.218  -1.905
  600   1HB   PHE  77           HB2      PHE  77  20.607   9.916  -2.769
  601   2HB   PHE  77           HB1      PHE  77  19.753  10.625  -1.400
  602    HD1  PHE  77           HD1      PHE  77  21.394   7.505  -2.610
  603    HD2  PHE  77           HD2      PHE  77  20.007   9.739   0.788
  604    HE1  PHE  77           HE1      PHE  77  22.515   5.892  -1.092
  605    HE2  PHE  77           HE2      PHE  77  21.125   8.127   2.305
  606    HZ   PHE  77           HZ       PHE  77  22.380   6.203   1.364
  607    H    HIS  78           HN       HIS  78  18.030  11.136  -3.891
  608    HA   HIS  78           HA       HIS  78  16.300  12.448  -1.951
  609   1HB   HIS  78           HB2      HIS  78  17.632  13.824  -3.417
  610   2HB   HIS  78           HB1      HIS  78  16.949  13.047  -4.845
  611    HD1  HIS  78           HD1      HIS  78  15.771  15.111  -1.863
  612    HD2  HIS  78           HD2      HIS  78  14.688  14.321  -5.810
  613    HE1  HIS  78           HE1      HIS  78  13.834  16.650  -2.394
  614    NH1  ARG  79           NH2      ARG  79  15.353   7.205 -10.451
  615    NH2  ARG  79           NH1      ARG  79  17.066   8.659 -10.700
  616    H    ARG  79           HN       ARG  79  15.734  10.770  -5.060
  617    HA   ARG  79           HA       ARG  79  12.890  11.289  -4.994
  618   1HB   ARG  79           HB2      ARG  79  12.763   9.597  -6.813
  619   2HB   ARG  79           HB1      ARG  79  13.989  10.828  -7.110
  620   1HG   ARG  79           HG2      ARG  79  15.755   9.353  -6.464
  621   2HG   ARG  79           HG1      ARG  79  14.618   8.163  -5.826
  622   1HD   ARG  79           HD2      ARG  79  14.775   7.185  -7.869
  623   2HD   ARG  79           HD1      ARG  79  13.733   8.496  -8.417
  624    HE   ARG  79           HE       ARG  79  16.337   9.521  -8.525
  625   1HH1  ARG  79          HH21      ARG  79  14.581   6.849  -9.929
  626   2HH1  ARG  79          HH22      ARG  79  15.582   6.797 -11.335
  627   1HH2  ARG  79          HH11      ARG  79  17.612   9.425 -10.362
  628   2HH2  ARG  79          HH12      ARG  79  17.286   8.240 -11.581
  629    H    HIS  80           HN       HIS  80  14.858   8.939  -3.387
  630    HA   HIS  80           HA       HIS  80  12.582   7.100  -2.972
  631   1HB   HIS  80           HB2      HIS  80  14.558   5.870  -3.116
  632   2HB   HIS  80           HB1      HIS  80  15.503   7.097  -2.275
  633    HD1  HIS  80           HD1      HIS  80  13.201   4.195  -1.670
  634    HD2  HIS  80           HD2      HIS  80  15.381   6.956   0.570
  635    HE1  HIS  80           HE1      HIS  80  13.187   3.354   0.722
  636    H    LYS  81           HN       LYS  81  14.449   9.541  -1.244
  637    HA   LYS  81           HA       LYS  81  13.510   9.166   1.385
  638   1HB   LYS  81           HB2      LYS  81  14.531  11.450  -0.209
  639   2HB   LYS  81           HB1      LYS  81  13.601  11.874   1.229
  640   1HG   LYS  81           HG2      LYS  81  15.357   9.731   1.922
  641   2HG   LYS  81           HG1      LYS  81  16.305  10.961   1.085
  642   1HD   LYS  81           HD2      LYS  81  16.021  12.499   2.745
  643   2HD   LYS  81           HD1      LYS  81  14.362  11.998   3.062
  644   1HE   LYS  81           HE2      LYS  81  16.785  10.370   3.870
  645   2HE   LYS  81           HE1      LYS  81  15.959  11.496   4.947
  646   1HZ   LYS  81           HZ3      LYS  81  13.929  10.026   3.963
  647   2HZ   LYS  81           HZ2      LYS  81  15.167   8.869   4.071
  648   3HZ   LYS  81           HZ1      LYS  81  14.697   9.746   5.450
  649    H    GLN  82           HN       GLN  82  11.907  10.557  -1.416
  650    HA   GLN  82           HA       GLN  82   9.687  11.685   0.072
  651   1HB   GLN  82           HB2      GLN  82  10.384  11.241  -2.788
  652   2HB   GLN  82           HB1      GLN  82   8.666  11.378  -2.406
  653   1HG   GLN  82           HG2      GLN  82  10.234  13.377  -0.987
  654   2HG   GLN  82           HG1      GLN  82  10.457  13.499  -2.733
  655   1HE2  GLN  82          HE22      GLN  82   6.630  13.940  -1.264
  656   2HE2  GLN  82          HE21      GLN  82   7.719  12.933  -0.437
  657    H    LEU  83           HN       LEU  83  10.263   8.631  -1.653
  658    HA   LEU  83           HA       LEU  83   7.674   7.530  -1.546
  659   1HB   LEU  83           HB2      LEU  83   9.623   6.459  -2.669
  660   2HB   LEU  83           HB1      LEU  83  10.292   6.065  -1.086
  661    HG   LEU  83           HG       LEU  83   7.480   5.236  -1.514
  662   1HD1  LEU  83          HD11      LEU  83   9.437   4.662  -3.511
  663   2HD1  LEU  83          HD13      LEU  83   9.141   3.175  -2.610
  664   3HD1  LEU  83          HD12      LEU  83   7.799   4.021  -3.382
  665   1HD2  LEU  83          HD22      LEU  83   9.988   3.938  -0.398
  666   2HD2  LEU  83          HD21      LEU  83   8.664   4.642   0.529
  667   3HD2  LEU  83          HD23      LEU  83   8.400   3.174  -0.409
  668    H    ILE  84           HN       ILE  84  10.074   7.905   0.999
  669    HA   ILE  84           HA       ILE  84   8.867   6.136   2.911
  670    HB   ILE  84           HB       ILE  84  10.363   8.680   3.583
  671   1HG1  ILE  84          HG12      ILE  84  11.757   7.589   1.971
  672   2HG1  ILE  84          HG11      ILE  84  12.389   7.112   3.547
  673   1HG2  ILE  84          HG21      ILE  84   9.292   6.480   5.078
  674   2HG2  ILE  84          HG23      ILE  84  11.051   6.418   5.171
  675   3HG2  ILE  84          HG22      ILE  84  10.192   7.873   5.677
  676   1HD1  ILE  84          HD13      ILE  84  10.604   5.138   3.218
  677   2HD1  ILE  84          HD12      ILE  84  10.932   5.486   1.520
  678   3HD1  ILE  84          HD11      ILE  84  12.250   5.024   2.597
  679    NH1  ARG  85           NH2      ARG  85  11.323  11.330   5.671
  680    NH2  ARG  85           NH1      ARG  85  11.701  13.550   5.861
  681    H    ARG  85           HN       ARG  85   8.438   9.639   2.356
  682    HA   ARG  85           HA       ARG  85   6.585  10.040   4.506
  683   1HB   ARG  85           HB2      ARG  85   7.472  11.553   2.115
  684   2HB   ARG  85           HB1      ARG  85   5.888  11.986   2.755
  685   1HG   ARG  85           HG2      ARG  85   7.602  13.361   3.819
  686   2HG   ARG  85           HG1      ARG  85   6.903  12.262   5.009
  687   1HD   ARG  85           HD2      ARG  85   8.819  10.983   5.157
  688   2HD   ARG  85           HD1      ARG  85   9.297  11.321   3.492
  689    HE   ARG  85           HE       ARG  85   9.535  13.773   4.741
  690   1HH1  ARG  85          HH21      ARG  85  10.753  10.564   5.377
  691   2HH1  ARG  85          HH22      ARG  85  12.197  11.152   6.125
  692   1HH2  ARG  85          HH11      ARG  85  11.413  14.496   5.713
  693   2HH2  ARG  85          HH12      ARG  85  12.574  13.358   6.310
  694    H    PHE  86           HN       PHE  86   6.006   9.617   1.014
  695    HA   PHE  86           HA       PHE  86   3.216   9.756   1.014
  696   1HB   PHE  86           HB2      PHE  86   5.253   8.923  -0.786
  697   2HB   PHE  86           HB1      PHE  86   4.010   7.671  -0.782
  698    HD1  PHE  86           HD2      PHE  86   1.514   8.605  -0.770
  699    HD2  PHE  86           HD1      PHE  86   4.944  10.766  -2.186
  700    HE1  PHE  86           HE2      PHE  86   0.037  10.057  -2.128
  701    HE2  PHE  86           HE1      PHE  86   3.467  12.221  -3.543
  702    HZ   PHE  86           HZ       PHE  86   1.012  11.869  -3.515
  703    H    LEU  87           HN       LEU  87   5.184   6.793   1.426
  704    HA   LEU  87           HA       LEU  87   3.009   5.005   1.760
  705   1HB   LEU  87           HB2      LEU  87   5.673   4.682   1.650
  706   2HB   LEU  87           HB1      LEU  87   5.454   4.547   3.395
  707    HG   LEU  87           HG       LEU  87   3.580   3.037   1.624
  708   1HD1  LEU  87          HD11      LEU  87   6.444   2.239   2.216
  709   2HD1  LEU  87          HD13      LEU  87   5.212   1.137   1.600
  710   3HD1  LEU  87          HD12      LEU  87   5.732   2.510   0.624
  711   1HD2  LEU  87          HD21      LEU  87   3.417   3.147   4.141
  712   2HD2  LEU  87          HD23      LEU  87   3.569   1.511   3.500
  713   3HD2  LEU  87          HD22      LEU  87   4.968   2.309   4.220
  714    H    LYS  88           HN       LYS  88   4.725   6.975   4.187
  715    HA   LYS  88           HA       LYS  88   3.511   5.903   6.506
  716   1HB   LYS  88           HB2      LYS  88   4.569   8.642   5.828
  717   2HB   LYS  88           HB1      LYS  88   3.857   8.310   7.406
  718   1HG   LYS  88           HG2      LYS  88   5.450   6.330   7.574
  719   2HG   LYS  88           HG1      LYS  88   6.268   6.977   6.152
  720   1HD   LYS  88           HD2      LYS  88   6.289   9.216   7.533
  721   2HD   LYS  88           HD1      LYS  88   6.073   8.141   8.914
  722   1HE   LYS  88           HE2      LYS  88   8.064   6.856   7.538
  723   2HE   LYS  88           HE1      LYS  88   8.438   8.545   7.197
  724   1HZ   LYS  88           HZ1      LYS  88   7.816   7.672   9.943
  725   2HZ   LYS  88           HZ3      LYS  88   9.380   7.479   9.315
  726   3HZ   LYS  88           HZ2      LYS  88   8.696   9.030   9.426
  727    NH1  ARG  89           NH2      ARG  89  -2.117  14.229   2.315
  728    NH2  ARG  89           NH1      ARG  89  -4.126  13.402   1.698
  729    H    ARG  89           HN       ARG  89   2.346   8.511   4.370
  730    HA   ARG  89           HA       ARG  89   0.010   9.078   5.966
  731   1HB   ARG  89           HB2      ARG  89   0.790  10.769   4.454
  732   2HB   ARG  89           HB1      ARG  89   0.718   9.663   3.084
  733   1HG   ARG  89           HG2      ARG  89  -1.654   9.644   3.078
  734   2HG   ARG  89           HG1      ARG  89  -1.742  10.353   4.692
  735   1HD   ARG  89           HD2      ARG  89  -1.028  12.480   3.913
  736   2HD   ARG  89           HD1      ARG  89  -0.472  11.819   2.378
  737    HE   ARG  89           HE       ARG  89  -3.202  11.257   2.448
  738   1HH1  ARG  89          HH21      ARG  89  -1.198  14.103   2.685
  739   2HH1  ARG  89          HH22      ARG  89  -2.417  15.140   2.034
  740   1HH2  ARG  89          HH11      ARG  89  -4.755  12.632   1.598
  741   2HH2  ARG  89          HH12      ARG  89  -4.409  14.318   1.413
  742    H    LEU  90           HN       LEU  90   0.662   6.859   3.308
  743    HA   LEU  90           HA       LEU  90  -2.106   6.192   2.807
  744   1HB   LEU  90           HB2      LEU  90  -0.394   5.821   1.105
  745   2HB   LEU  90           HB1      LEU  90   0.456   4.703   2.171
  746    HG   LEU  90           HG       LEU  90  -1.399   3.146   2.122
  747   1HD1  LEU  90          HD13      LEU  90  -2.786   5.498   0.917
  748   2HD1  LEU  90          HD12      LEU  90  -3.255   3.901   0.332
  749   3HD1  LEU  90          HD11      LEU  90  -3.399   4.289   2.046
  750   1HD2  LEU  90          HD22      LEU  90  -0.616   4.236  -0.594
  751   2HD2  LEU  90          HD21      LEU  90   0.093   2.867   0.261
  752   3HD2  LEU  90          HD23      LEU  90  -1.540   2.747  -0.394
  753    H    ASP  91           HN       ASP  91   0.162   5.216   5.245
  754    HA   ASP  91           HA       ASP  91  -0.993   2.619   5.787
  755   1HB   ASP  91           HB2      ASP  91   1.317   3.629   6.503
  756   2HB   ASP  91           HB1      ASP  91   0.409   4.263   7.875
  757    NH1  ARG  92           NH2      ARG  92  -0.926   3.438  12.841
  758    NH2  ARG  92           NH1      ARG  92   0.155   5.044  14.002
  759    H    ARG  92           HN       ARG  92  -1.375   5.812   7.371
  760    HA   ARG  92           HA       ARG  92  -3.413   4.751   9.170
  761   1HB   ARG  92           HB2      ARG  92  -1.764   7.040   9.064
  762   2HB   ARG  92           HB1      ARG  92  -3.423   7.631   8.995
  763   1HG   ARG  92           HG2      ARG  92  -2.587   7.402  11.333
  764   2HG   ARG  92           HG1      ARG  92  -3.992   6.388  11.016
  765   1HD   ARG  92           HD2      ARG  92  -2.831   4.530  11.514
  766   2HD   ARG  92           HD1      ARG  92  -1.574   4.952  10.353
  767    HE   ARG  92           HE       ARG  92  -1.021   6.589  12.500
  768   1HH1  ARG  92          HH21      ARG  92  -1.552   3.156  12.118
  769   2HH1  ARG  92          HH22      ARG  92  -0.493   2.746  13.420
  770   1HH2  ARG  92          HH11      ARG  92   0.359   6.009  14.169
  771   2HH2  ARG  92          HH12      ARG  92   0.580   4.338  14.567
  772    H    ASN  93           HN       ASN  93  -3.457   6.393   6.059
  773    HA   ASN  93           HA       ASN  93  -6.250   7.170   6.279
  774   1HB   ASN  93           HB2      ASN  93  -4.129   7.311   4.242
  775   2HB   ASN  93           HB1      ASN  93  -5.751   7.100   3.585
  776   1HD2  ASN  93          HD22      ASN  93  -5.238  10.759   3.984
  777   2HD2  ASN  93          HD21      ASN  93  -4.554   9.524   3.042
  778    H    LEU  94           HN       LEU  94  -4.568   4.529   4.561
  779    HA   LEU  94           HA       LEU  94  -7.121   3.392   3.694
  780   1HB   LEU  94           HB2      LEU  94  -5.263   3.137   2.207
  781   2HB   LEU  94           HB1      LEU  94  -4.245   2.479   3.485
  782    HG   LEU  94           HG       LEU  94  -6.686   0.920   3.191
  783   1HD1  LEU  94          HD12      LEU  94  -5.389   1.819   0.746
  784   2HD1  LEU  94          HD11      LEU  94  -5.303   0.066   0.915
  785   3HD1  LEU  94          HD13      LEU  94  -6.867   0.879   0.946
  786   1HD2  LEU  94          HD21      LEU  94  -3.704   0.445   3.066
  787   2HD2  LEU  94          HD23      LEU  94  -4.826  -0.009   4.348
  788   3HD2  LEU  94          HD22      LEU  94  -4.861  -0.860   2.805
  789    CH2  TRP  95           CH2      TRP  95  -3.894  -2.282  12.436
  790    H    TRP  95           HN       TRP  95  -4.578   2.383   6.021
  791    HA   TRP  95           HA       TRP  95  -6.223   0.121   6.886
  792   1HB   TRP  95           HB2      TRP  95  -4.144  -0.571   7.392
  793   2HB   TRP  95           HB1      TRP  95  -3.499   1.047   7.259
  794    HD1  TRP  95           HD1      TRP  95  -3.935   2.609   9.518
  795    HE1  TRP  95           HE1      TRP  95  -3.714   1.932  11.995
  796    HE3  TRP  95           HE3      TRP  95  -4.264  -2.449   9.055
  797    HZ2  TRP  95           HZ2      TRP  95  -3.681  -0.468  13.573
  798    HZ3  TRP  95           HZ3      TRP  95  -4.128  -3.910  11.049
  799    HH2  TRP  95           HH2      TRP  95  -3.833  -2.924  13.302
  800    H    GLY  96           HN       GLY  96  -5.999   3.454   7.727
  801   1HA   GLY  96           HA2      GLY  96  -6.676   3.417  10.469
  802   2HA   GLY  96           HA1      GLY  96  -7.134   4.700   9.357
  803    H    LEU  97           HN       LEU  97  -8.877   3.589   7.663
  804    HA   LEU  97           HA       LEU  97 -11.175   2.978   9.413
  805   1HB   LEU  97           HB2      LEU  97 -12.525   3.556   7.537
  806   2HB   LEU  97           HB1      LEU  97 -11.175   4.689   7.500
  807    HG   LEU  97           HG       LEU  97 -10.159   2.608   6.046
  808   1HD1  LEU  97          HD12      LEU  97 -13.041   2.290   6.111
  809   2HD1  LEU  97          HD11      LEU  97 -12.492   2.621   4.469
  810   3HD1  LEU  97          HD13      LEU  97 -11.826   1.255   5.364
  811   1HD2  LEU  97          HD22      LEU  97 -11.673   5.101   5.266
  812   2HD2  LEU  97          HD21      LEU  97  -9.932   4.819   5.249
  813   3HD2  LEU  97          HD23      LEU  97 -10.961   4.050   4.042
  814    H    ALA  98           HN       ALA  98  -8.870   1.048   8.272
  815    HA   ALA  98           HA       ALA  98 -10.562  -0.997   7.002
  816   1HB   ALA  98           HB2      ALA  98  -8.107  -0.284   6.401
  817   2HB   ALA  98           HB1      ALA  98  -7.679  -1.405   7.689
  818   3HB   ALA  98           HB3      ALA  98  -8.584  -1.970   6.291
  819    H    GLY  99           HN       GLY  99  -8.695  -0.608  10.022
  820   1HA   GLY  99           HA2      GLY  99 -10.192  -2.058  11.768
  821   2HA   GLY  99           HA1      GLY  99  -9.339  -3.331  10.885
  822    H    LEU 100           HN       LEU 100  -9.072  -0.975  13.317
  823    HA   LEU 100           HA       LEU 100  -6.158  -0.817  13.289
  824   1HB   LEU 100           HB2      LEU 100  -8.124   0.103  15.399
  825   2HB   LEU 100           HB1      LEU 100  -6.417   0.518  15.340
  826    HG   LEU 100           HG       LEU 100  -7.367   2.391  14.352
  827   1HD1  LEU 100          HD13      LEU 100  -5.773   1.077  12.787
  828   2HD1  LEU 100          HD12      LEU 100  -7.229   0.703  11.864
  829   3HD1  LEU 100          HD11      LEU 100  -6.736   2.378  12.096
  830   1HD2  LEU 100          HD22      LEU 100  -9.616   0.786  14.131
  831   2HD2  LEU 100          HD21      LEU 100  -9.498   2.464  13.599
  832   3HD2  LEU 100          HD23      LEU 100  -9.220   1.153  12.452
  833    H    ASN 101           HN       ASN 101  -8.429  -2.058  15.799
  834    HA   ASN 101           HA       ASN 101  -6.183  -3.334  17.122
  835   1HB   ASN 101           HB2      ASN 101  -8.363  -2.375  18.173
  836   2HB   ASN 101           HB1      ASN 101  -9.047  -3.953  17.801
  837   1HD2  ASN 101          HD22      ASN 101  -6.473  -3.569  20.898
  838   2HD2  ASN 101          HD21      ASN 101  -6.955  -2.233  19.969
  839    H    SER 102           HN       SER 102  -9.231  -5.052  16.273
  840    HA   SER 102           HA       SER 102  -7.831  -7.554  16.066
  841   1HB   SER 102           HB2      SER 102 -10.459  -7.140  14.689
  842   2HB   SER 102           HB1      SER 102  -9.907  -8.506  15.656
  843    HG   SER 102           HG       SER 102 -10.684  -7.559  17.359
  844    H    CYS 103           HN       CYS 103  -6.285  -7.774  14.491
  845    HA   CYS 103           HA       CYS 103  -7.124  -7.785  11.715
  846   1HB   CYS 103           HB2      CYS 103  -5.966  -5.374  12.846
  847   2HB   CYS 103           HB1      CYS 103  -4.935  -6.015  11.570
  848    HA   PRO 104           HA       PRO 104  -3.548 -10.447  13.186
  849   1HB   PRO 104           HB2      PRO 104  -4.870 -12.734  12.125
  850   2HB   PRO 104           HB1      PRO 104  -4.654 -12.320  13.830
  851   1HG   PRO 104           HG2      PRO 104  -7.091 -12.201  12.238
  852   2HG   PRO 104           HG1      PRO 104  -6.901 -11.960  13.981
  853   1HD   PRO 104           HD2      PRO 104  -7.408  -9.955  12.002
  854   2HD   PRO 104           HD1      PRO 104  -7.094  -9.710  13.731
  855    H    VAL 105           HN       VAL 105  -2.437  -9.341  11.357
  856    HA   VAL 105           HA       VAL 105  -2.947 -10.290   8.633
  857    HB   VAL 105           HB       VAL 105  -0.394  -8.898   9.422
  858   1HG1  VAL 105          HG13      VAL 105  -2.259  -8.800   7.037
  859   2HG1  VAL 105          HG12      VAL 105  -0.824  -7.791   7.223
  860   3HG1  VAL 105          HG11      VAL 105  -0.659  -9.542   7.103
  861   1HG2  VAL 105          HG23      VAL 105  -3.193  -7.820   9.542
  862   2HG2  VAL 105          HG22      VAL 105  -1.804  -7.439  10.561
  863   3HG2  VAL 105          HG21      VAL 105  -1.914  -6.772   8.930
  864    H    LYS 106           HN       LYS 106  -2.506 -12.455   8.345
  865    HA   LYS 106           HA       LYS 106   0.241 -13.325   8.315
  866   1HB   LYS 106           HB2      LYS 106  -0.247 -13.404  10.788
  867   2HB   LYS 106           HB1      LYS 106  -1.497 -14.602  10.448
  868   1HG   LYS 106           HG2      LYS 106   0.247 -16.053  10.813
  869   2HG   LYS 106           HG1      LYS 106   0.544 -15.731   9.104
  870   1HD   LYS 106           HD2      LYS 106   1.854 -13.630  10.244
  871   2HD   LYS 106           HD1      LYS 106   2.081 -14.864  11.482
  872   1HE   LYS 106           HE2      LYS 106   2.556 -15.584   8.608
  873   2HE   LYS 106           HE1      LYS 106   3.793 -14.677   9.479
  874   1HZ   LYS 106           HZ3      LYS 106   2.586 -17.180  10.508
  875   2HZ   LYS 106           HZ2      LYS 106   4.011 -17.147   9.587
  876   3HZ   LYS 106           HZ1      LYS 106   3.955 -16.373  11.099
  877    H    GLU 107           HN       GLU 107  -0.195 -14.131   6.262
  878    HA   GLU 107           HA       GLU 107  -1.421 -16.734   6.062
  879   1HB   GLU 107           HB2      GLU 107  -3.462 -15.244   6.169
  880   2HB   GLU 107           HB1      GLU 107  -2.903 -14.472   4.685
  881   1HG   GLU 107           HG2      GLU 107  -2.761 -17.038   3.894
  882   2HG   GLU 107           HG1      GLU 107  -4.043 -17.191   5.092
  883    H    ALA 108           HN       ALA 108   1.069 -15.880   5.417
  884    HA   ALA 108           HA       ALA 108   1.301 -16.657   2.676
  885   1HB   ALA 108           HB2      ALA 108   0.402 -14.284   2.445
  886   2HB   ALA 108           HB1      ALA 108   1.922 -13.738   3.150
  887   3HB   ALA 108           HB3      ALA 108   1.924 -14.603   1.618
  888    H    ASP 109           HN       ASP 109   3.464 -16.988   2.107
  889    HA   ASP 109           HA       ASP 109   5.359 -17.087   4.338
  890   1HB   ASP 109           HB2      ASP 109   5.575 -17.816   1.401
  891   2HB   ASP 109           HB1      ASP 109   6.918 -17.980   2.533
  892    H    GLN 110           HN       GLN 110   6.010 -15.915   1.042
  893    HA   GLN 110           HA       GLN 110   6.459 -13.197   1.857
  894   1HB   GLN 110           HB2      GLN 110   8.909 -13.137   1.518
  895   2HB   GLN 110           HB1      GLN 110   8.470 -14.162   2.886
  896   1HG   GLN 110           HG2      GLN 110   8.391 -16.020   0.987
  897   2HG   GLN 110           HG1      GLN 110   9.517 -14.914   0.203
  898   1HE2  GLN 110          HE22      GLN 110  12.136 -15.469   2.569
  899   2HE2  GLN 110          HE21      GLN 110  11.542 -14.385   1.406
  900    H    SER 111           HN       SER 111   5.298 -12.649   0.009
  901    HA   SER 111           HA       SER 111   6.059 -13.762  -2.599
  902   1HB   SER 111           HB2      SER 111   4.041 -12.953  -3.312
  903   2HB   SER 111           HB1      SER 111   3.707 -12.866  -1.586
  904    HG   SER 111           HG       SER 111   3.669 -10.784  -1.759
  905    H    THR 112           HN       THR 112   5.768 -11.502  -4.216
  906    HA   THR 112           HA       THR 112   8.100  -9.843  -3.353
  907    HB   THR 112           HB       THR 112   8.793  -9.672  -5.649
  908    HG1  THR 112           HG1      THR 112   7.094  -9.595  -6.915
  909   1HG2  THR 112          HG21      THR 112   8.830 -12.014  -4.234
  910   2HG2  THR 112          HG23      THR 112   8.081 -12.535  -5.743
  911   3HG2  THR 112          HG22      THR 112   9.669 -11.767  -5.766
  912    H    LEU 113           HN       LEU 113   7.719  -7.679  -3.255
  913    HA   LEU 113           HA       LEU 113   5.108  -6.633  -3.314
  914   1HB   LEU 113           HB2      LEU 113   7.163  -5.639  -2.213
  915   2HB   LEU 113           HB1      LEU 113   7.611  -5.010  -3.797
  916    HG   LEU 113           HG       LEU 113   5.330  -3.925  -3.906
  917   1HD1  LEU 113          HD13      LEU 113   5.024  -5.476  -1.505
  918   2HD1  LEU 113          HD12      LEU 113   4.829  -3.766  -1.115
  919   3HD1  LEU 113          HD11      LEU 113   3.816  -4.511  -2.349
  920   1HD2  LEU 113          HD22      LEU 113   7.658  -3.036  -2.757
  921   2HD2  LEU 113          HD21      LEU 113   6.235  -2.032  -3.035
  922   3HD2  LEU 113          HD23      LEU 113   6.495  -2.777  -1.457
  923    H    GLU 114           HN       GLU 114   7.175  -7.266  -6.027
  924    HA   GLU 114           HA       GLU 114   6.202  -5.232  -7.789
  925   1HB   GLU 114           HB2      GLU 114   8.161  -7.050  -8.002
  926   2HB   GLU 114           HB1      GLU 114   6.911  -7.899  -8.911
  927   1HG   GLU 114           HG2      GLU 114   6.950  -5.108  -9.654
  928   2HG   GLU 114           HG1      GLU 114   8.561  -5.804  -9.835
  929    H    ASN 115           HN       ASN 115   5.258  -8.681  -7.622
  930    HA   ASN 115           HA       ASN 115   3.004  -8.295  -9.388
  931   1HB   ASN 115           HB2      ASN 115   3.764 -10.549  -7.521
  932   2HB   ASN 115           HB1      ASN 115   2.364 -10.610  -8.590
  933   1HD2  ASN 115          HD22      ASN 115   5.823 -11.694 -10.132
  934   2HD2  ASN 115          HD21      ASN 115   5.394 -11.775  -8.491
  935    H    PHE 116           HN       PHE 116   3.201  -8.750  -5.833
  936    HA   PHE 116           HA       PHE 116   0.396  -8.634  -5.367
  937   1HB   PHE 116           HB2      PHE 116   1.453  -9.275  -3.439
  938   2HB   PHE 116           HB1      PHE 116   2.855  -8.251  -3.747
  939    HD1  PHE 116           HD1      PHE 116  -0.816  -7.923  -2.986
  940    HD2  PHE 116           HD2      PHE 116   3.147  -6.361  -2.453
  941    HE1  PHE 116           HE1      PHE 116  -1.703  -6.203  -1.435
  942    HE2  PHE 116           HE2      PHE 116   2.264  -4.638  -0.906
  943    HZ   PHE 116           HZ       PHE 116  -0.163  -4.559  -0.395
  944    H    LEU 117           HN       LEU 117   2.772  -5.957  -4.987
  945    HA   LEU 117           HA       LEU 117   0.819  -3.941  -4.594
  946   1HB   LEU 117           HB2      LEU 117   3.446  -3.864  -4.428
  947   2HB   LEU 117           HB1      LEU 117   3.328  -3.300  -6.095
  948    HG   LEU 117           HG       LEU 117   1.337  -1.895  -4.677
  949   1HD1  LEU 117          HD12      LEU 117   3.256  -2.712  -2.822
  950   2HD1  LEU 117          HD11      LEU 117   3.736  -1.072  -3.243
  951   3HD1  LEU 117          HD13      LEU 117   2.117  -1.385  -2.624
  952   1HD2  LEU 117          HD21      LEU 117   4.100  -1.071  -5.604
  953   2HD2  LEU 117          HD23      LEU 117   2.631  -1.050  -6.575
  954   3HD2  LEU 117          HD22      LEU 117   2.799   0.048  -5.205
  955    H    GLU 118           HN       GLU 118   1.876  -5.544  -7.525
  956    HA   GLU 118           HA       GLU 118   0.935  -3.587  -9.400
  957   1HB   GLU 118           HB2      GLU 118   2.061  -5.140 -10.624
  958   2HB   GLU 118           HB1      GLU 118   1.741  -6.423  -9.460
  959   1HG   GLU 118           HG2      GLU 118  -0.456  -6.802 -10.365
  960   2HG   GLU 118           HG1      GLU 118  -0.344  -5.362 -11.379
  961    NH1  ARG 119           NH2      ARG 119  -5.648 -11.124  -9.675
  962    NH2  ARG 119           NH1      ARG 119  -6.264  -9.524 -11.146
  963    H    ARG 119           HN       ARG 119  -0.614  -6.431  -7.927
  964    HA   ARG 119           HA       ARG 119  -3.214  -6.008  -9.097
  965   1HB   ARG 119           HB2      ARG 119  -2.329  -7.479  -6.592
  966   2HB   ARG 119           HB1      ARG 119  -3.976  -7.516  -7.221
  967   1HG   ARG 119           HG2      ARG 119  -2.337  -8.064  -9.435
  968   2HG   ARG 119           HG1      ARG 119  -1.651  -9.005  -8.108
  969   1HD   ARG 119           HD2      ARG 119  -3.276 -10.492  -8.800
  970   2HD   ARG 119           HD1      ARG 119  -4.230  -9.545  -7.661
  971    HE   ARG 119           HE       ARG 119  -4.498  -8.202 -10.084
  972   1HH1  ARG 119          HH21      ARG 119  -5.075 -11.442  -8.922
  973   2HH1  ARG 119          HH22      ARG 119  -6.345 -11.730 -10.057
  974   1HH2  ARG 119          HH11      ARG 119  -6.158  -8.605 -11.526
  975   2HH2  ARG 119          HH12      ARG 119  -6.961 -10.139 -11.515
  976    H    LEU 120           HN       LEU 120  -1.510  -4.354  -6.603
  977    HA   LEU 120           HA       LEU 120  -3.795  -3.497  -5.049
  978   1HB   LEU 120           HB2      LEU 120  -0.946  -3.155  -5.007
  979   2HB   LEU 120           HB1      LEU 120  -1.693  -1.564  -4.936
  980    HG   LEU 120           HG       LEU 120  -2.227  -3.903  -3.083
  981   1HD1  LEU 120          HD12      LEU 120  -0.676  -1.355  -2.945
  982   2HD1  LEU 120          HD11      LEU 120  -1.542  -1.854  -1.492
  983   3HD1  LEU 120          HD13      LEU 120  -0.330  -2.920  -2.207
  984   1HD2  LEU 120          HD22      LEU 120  -3.899  -1.668  -3.832
  985   2HD2  LEU 120          HD21      LEU 120  -4.246  -2.972  -2.697
  986   3HD2  LEU 120          HD23      LEU 120  -3.424  -1.513  -2.141
  987    H    LYS 121           HN       LYS 121  -1.734  -1.800  -7.435
  988    HA   LYS 121           HA       LYS 121  -3.336   0.553  -7.634
  989   1HB   LYS 121           HB2      LYS 121  -1.141   0.660  -8.544
  990   2HB   LYS 121           HB1      LYS 121  -1.393  -0.787  -9.519
  991   1HG   LYS 121           HG2      LYS 121  -3.287   1.426 -10.045
  992   2HG   LYS 121           HG1      LYS 121  -1.614   1.741 -10.500
  993   1HD   LYS 121           HD2      LYS 121  -1.710  -0.637 -11.572
  994   2HD   LYS 121           HD1      LYS 121  -3.458  -0.419 -11.499
  995   1HE   LYS 121           HE2      LYS 121  -1.525   1.512 -12.815
  996   2HE   LYS 121           HE1      LYS 121  -2.515   0.329 -13.671
  997   1HZ   LYS 121           HZ2      LYS 121  -4.184   1.756 -11.950
  998   2HZ   LYS 121           HZ1      LYS 121  -3.238   2.892 -12.791
  999   3HZ   LYS 121           HZ3      LYS 121  -4.176   1.767 -13.648
 1000    H    THR 122           HN       THR 122  -3.445  -2.505  -9.356
 1001    HA   THR 122           HA       THR 122  -5.336  -1.675 -11.351
 1002    HB   THR 122           HB       THR 122  -5.712  -4.416 -11.060
 1003    HG1  THR 122           HG1      THR 122  -3.355  -4.956 -10.946
 1004   1HG2  THR 122          HG23      THR 122  -3.656  -2.849 -12.637
 1005   2HG2  THR 122          HG22      THR 122  -4.074  -4.535 -12.947
 1006   3HG2  THR 122          HG21      THR 122  -5.287  -3.273 -13.162
 1007    H    ILE 123           HN       ILE 123  -5.794  -3.522  -8.364
 1008    HA   ILE 123           HA       ILE 123  -8.610  -3.822  -8.602
 1009    HB   ILE 123           HB       ILE 123  -6.791  -3.797  -6.188
 1010   1HG1  ILE 123          HG12      ILE 123  -6.449  -5.623  -7.835
 1011   2HG1  ILE 123          HG11      ILE 123  -7.080  -6.234  -6.305
 1012   1HG2  ILE 123          HG22      ILE 123  -9.744  -4.396  -6.431
 1013   2HG2  ILE 123          HG21      ILE 123  -8.761  -4.992  -5.093
 1014   3HG2  ILE 123          HG23      ILE 123  -8.956  -3.256  -5.341
 1015   1HD1  ILE 123          HD12      ILE 123  -9.325  -5.532  -7.897
 1016   2HD1  ILE 123          HD11      ILE 123  -8.232  -6.453  -8.930
 1017   3HD1  ILE 123          HD13      ILE 123  -8.809  -7.146  -7.415
 1018    H    MET 124           HN       MET 124  -6.816  -1.531  -6.537
 1019    HA   MET 124           HA       MET 124  -9.079  -0.108  -5.614
 1020   1HB   MET 124           HB2      MET 124  -6.159   0.362  -5.677
 1021   2HB   MET 124           HB1      MET 124  -7.166   1.797  -5.488
 1022   1HG   MET 124           HG2      MET 124  -8.028   1.102  -3.458
 1023   2HG   MET 124           HG1      MET 124  -7.815  -0.608  -3.834
 1024   1HE   MET 124           HE2      MET 124  -6.817   2.261  -1.946
 1025   2HE   MET 124           HE1      MET 124  -5.072   2.258  -1.715
 1026   3HE   MET 124           HE3      MET 124  -5.763   2.754  -3.270
 1027    NH1  ARG 125           NH2      ARG 125  -7.462   1.893 -15.244
 1028    NH2  ARG 125           NH1      ARG 125  -5.382   2.666 -15.654
 1029    H    ARG 125           HN       ARG 125  -6.961   0.647  -8.386
 1030    HA   ARG 125           HA       ARG 125  -8.272   3.101  -9.050
 1031   1HB   ARG 125           HB2      ARG 125  -5.997   2.246  -9.854
 1032   2HB   ARG 125           HB1      ARG 125  -6.898   1.307 -11.043
 1033   1HG   ARG 125           HG2      ARG 125  -7.764   4.106 -10.884
 1034   2HG   ARG 125           HG1      ARG 125  -6.081   3.924 -11.380
 1035   1HD   ARG 125           HD2      ARG 125  -7.856   1.998 -12.690
 1036   2HD   ARG 125           HD1      ARG 125  -8.288   3.670 -13.042
 1037    HE   ARG 125           HE       ARG 125  -5.539   3.598 -13.392
 1038   1HH1  ARG 125          HH21      ARG 125  -8.255   1.796 -14.646
 1039   2HH1  ARG 125          HH22      ARG 125  -7.478   1.483 -16.157
 1040   1HH2  ARG 125          HH11      ARG 125  -4.569   3.171 -15.363
 1041   2HH2  ARG 125          HH12      ARG 125  -5.411   2.243 -16.560
 1042    H    GLU 126           HN       GLU 126  -8.485   0.004 -10.803
 1043    HA   GLU 126           HA       GLU 126 -10.559   0.712 -12.549
 1044   1HB   GLU 126           HB2      GLU 126  -9.146  -1.407 -12.553
 1045   2HB   GLU 126           HB1      GLU 126 -10.276  -2.050 -11.361
 1046   1HG   GLU 126           HG2      GLU 126 -12.144  -1.710 -12.906
 1047   2HG   GLU 126           HG1      GLU 126 -11.052  -1.001 -14.097
 1048    H    LYS 127           HN       LYS 127 -11.003  -1.034  -9.436
 1049    HA   LYS 127           HA       LYS 127 -13.862  -1.048  -9.636
 1050   1HB   LYS 127           HB2      LYS 127 -11.882  -1.560  -7.454
 1051   2HB   LYS 127           HB1      LYS 127 -13.588  -1.401  -7.036
 1052   1HG   LYS 127           HG2      LYS 127 -14.169  -3.343  -8.094
 1053   2HG   LYS 127           HG1      LYS 127 -12.976  -3.123  -9.376
 1054   1HD   LYS 127           HD2      LYS 127 -11.986  -4.871  -8.235
 1055   2HD   LYS 127           HD1      LYS 127 -11.274  -3.513  -7.359
 1056   1HE   LYS 127           HE2      LYS 127 -12.085  -4.752  -5.579
 1057   2HE   LYS 127           HE1      LYS 127 -13.491  -3.739  -5.909
 1058   1HZ   LYS 127           HZ3      LYS 127 -13.155  -6.327  -7.278
 1059   2HZ   LYS 127           HZ2      LYS 127 -13.814  -6.263  -5.713
 1060   3HZ   LYS 127           HZ1      LYS 127 -14.577  -5.447  -6.993
 1061    OH   TYR 128           OH       TYR 128 -12.380  -0.807  -1.980
 1062    H    TYR 128           HN       TYR 128 -11.751   1.066  -7.629
 1063    HA   TYR 128           HA       TYR 128 -14.056   2.600  -6.749
 1064   1HB   TYR 128           HB2      TYR 128 -11.093   3.165  -6.486
 1065   2HB   TYR 128           HB1      TYR 128 -12.372   4.082  -5.686
 1066    HD1  TYR 128           HD2      TYR 128 -14.276   2.334  -4.676
 1067    HD2  TYR 128           HD1      TYR 128 -10.059   1.610  -5.066
 1068    HE1  TYR 128           HE2      TYR 128 -14.404   0.621  -2.890
 1069    HE2  TYR 128           HE1      TYR 128 -10.192  -0.108  -3.278
 1070    HH   TYR 128           HH       TYR 128 -13.181  -1.318  -2.121
 1071    H    SER 129           HN       SER 129 -12.679   2.588  -9.749
 1072    HA   SER 129           HA       SER 129 -12.506   5.452 -10.199
 1073   1HB   SER 129           HB2      SER 129 -11.426   4.637 -12.003
 1074   2HB   SER 129           HB1      SER 129 -12.061   3.019 -11.712
 1075    HG   SER 129           HG       SER 129 -12.761   4.747 -13.592
 1076    H    LYS 130           HN       LYS 130 -15.137   3.320  -9.762
 1077    HA   LYS 130           HA       LYS 130 -16.973   5.359 -10.920
 1078   1HB   LYS 130           HB2      LYS 130 -17.498   2.390 -11.159
 1079   2HB   LYS 130           HB1      LYS 130 -18.316   3.711 -11.994
 1080   1HG   LYS 130           HG2      LYS 130 -15.833   4.194 -12.861
 1081   2HG   LYS 130           HG1      LYS 130 -15.666   2.464 -12.559
 1082   1HD   LYS 130           HD2      LYS 130 -18.052   2.478 -13.840
 1083   2HD   LYS 130           HD1      LYS 130 -17.293   3.879 -14.599
 1084   1HE   LYS 130           HE2      LYS 130 -15.460   2.597 -15.388
 1085   2HE   LYS 130           HE1      LYS 130 -15.834   1.250 -14.314
 1086   1HZ   LYS 130           HZ1      LYS 130 -18.044   1.205 -15.602
 1087   2HZ   LYS 130           HZ3      LYS 130 -17.202   2.085 -16.783
 1088   3HZ   LYS 130           HZ2      LYS 130 -16.658   0.542 -16.328
 1089    H    CYS 131           HN       CYS 131 -16.482   5.466  -8.294
 1090    HA   CYS 131           HA       CYS 131 -18.575   3.824  -6.936
 1091   1HB   CYS 131           HB2      CYS 131 -16.411   3.657  -5.873
 1092   2HB   CYS 131           HB1      CYS 131 -16.224   5.409  -5.864
 1093    H    SER 132           HN       SER 132 -17.566   7.148  -7.594
 1094    HA   SER 132           HA       SER 132 -19.719   8.283  -5.953
 1095   1HB   SER 132           HB2      SER 132 -18.931  10.433  -7.152
 1096   2HB   SER 132           HB1      SER 132 -17.788   9.648  -6.066
 1097    HG   SER 132           HG       SER 132 -17.160  10.270  -8.367
 1098    H    SER 133           HN       SER 133 -21.675   9.079  -6.729
 1099    HA   SER 133           HA       SER 133 -22.177   9.380  -9.586
 1100   1HB   SER 133           HB2      SER 133 -22.872   6.884  -8.200
 1101   2HB   SER 133           HB1      SER 133 -24.239   7.635  -9.016
 1102    HG   SER 133           HG       SER 133 -22.825   6.168 -10.282
   
  Start of MODEL          14
 Raw file had 1102 H/Q atoms
  Start of MODEL   14
    1   1H    GLU   1           HT1      GLU   1 -13.961  17.184   4.822
    2   2H    GLU   1           HT3      GLU   1 -14.099  18.583   5.770
    3   3H    GLU   1           HT2      GLU   1 -14.003  17.061   6.517
    4    HA   GLU   1           HA       GLU   1 -16.239  17.400   6.653
    5   1HB   GLU   1           HB2      GLU   1 -15.832  18.952   4.098
    6   2HB   GLU   1           HB1      GLU   1 -17.445  18.473   4.624
    7   1HG   GLU   1           HG2      GLU   1 -16.579  19.497   6.938
    8   2HG   GLU   1           HG1      GLU   1 -15.557  20.434   5.845
    9    H    ALA   2           HN       ALA   2 -18.173  16.496   5.229
   10    HA   ALA   2           HA       ALA   2 -17.131  14.321   3.466
   11   1HB   ALA   2           HB2      ALA   2 -17.918  13.763   5.971
   12   2HB   ALA   2           HB1      ALA   2 -19.501  13.757   5.192
   13   3HB   ALA   2           HB3      ALA   2 -18.236  12.664   4.629
   14    H    GLU   3           HN       GLU   3 -18.902  13.418   2.057
   15    HA   GLU   3           HA       GLU   3 -21.352  14.963   1.759
   16   1HB   GLU   3           HB2      GLU   3 -18.972  15.762   0.305
   17   2HB   GLU   3           HB1      GLU   3 -20.245  15.257  -0.807
   18   1HG   GLU   3           HG2      GLU   3 -21.766  16.867   0.010
   19   2HG   GLU   3           HG1      GLU   3 -20.841  17.115   1.492
   20    H    ALA   4           HN       ALA   4 -19.048  12.828   0.052
   21    HA   ALA   4           HA       ALA   4 -20.976  11.526  -1.591
   22   1HB   ALA   4           HB1      ALA   4 -18.359  11.396  -1.600
   23   2HB   ALA   4           HB3      ALA   4 -18.597  10.065  -0.468
   24   3HB   ALA   4           HB2      ALA   4 -19.287   9.979  -2.089
   25    H    HIS   5           HN       HIS   5 -20.818   8.802  -1.020
   26    HA   HIS   5           HA       HIS   5 -22.193   8.645   1.634
   27   1HB   HIS   5           HB2      HIS   5 -22.785   7.108  -0.914
   28   2HB   HIS   5           HB1      HIS   5 -23.570   6.823   0.640
   29    HD1  HIS   5           HD1      HIS   5 -23.720   9.929   1.396
   30    HD2  HIS   5           HD2      HIS   5 -25.099   8.200  -2.138
   31    HE1  HIS   5           HE1      HIS   5 -25.475  11.501   0.467
   32    H    LYS   6           HN       LYS   6 -20.937   6.267  -0.737
   33    HA   LYS   6           HA       LYS   6 -19.643   4.886   1.554
   34   1HB   LYS   6           HB2      LYS   6 -20.079   3.844  -1.257
   35   2HB   LYS   6           HB1      LYS   6 -19.613   2.904   0.162
   36   1HG   LYS   6           HG2      LYS   6 -21.795   2.568   0.600
   37   2HG   LYS   6           HG1      LYS   6 -21.969   4.301   0.873
   38   1HD   LYS   6           HD2      LYS   6 -22.642   4.707  -1.353
   39   2HD   LYS   6           HD1      LYS   6 -22.016   3.156  -1.915
   40   1HE   LYS   6           HE2      LYS   6 -23.909   2.051  -1.337
   41   2HE   LYS   6           HE1      LYS   6 -24.036   2.900   0.203
   42   1HZ   LYS   6           HZ3      LYS   6 -24.619   4.872  -1.460
   43   2HZ   LYS   6           HZ2      LYS   6 -25.188   3.563  -2.383
   44   3HZ   LYS   6           HZ1      LYS   6 -25.796   3.832  -0.819
   45    H    CYS   7           HN       CYS   7 -18.560   7.282   0.159
   46    HA   CYS   7           HA       CYS   7 -15.818   6.538   0.115
   47   1HB   CYS   7           HB2      CYS   7 -15.545   7.001  -2.451
   48   2HB   CYS   7           HB1      CYS   7 -16.005   5.387  -1.914
   49    H    ASP   8           HN       ASP   8 -16.047   8.545   1.382
   50    HA   ASP   8           HA       ASP   8 -16.846  11.019   0.153
   51   1HB   ASP   8           HB2      ASP   8 -14.858  10.669   2.417
   52   2HB   ASP   8           HB1      ASP   8 -15.844  12.091   2.074
   53    H    ILE   9           HN       ILE   9 -14.547  12.672   0.675
   54    HA   ILE   9           HA       ILE   9 -13.105  12.269  -1.804
   55    HB   ILE   9           HB       ILE   9 -12.150  14.060   0.428
   56   1HG1  ILE   9          HG12      ILE   9 -14.575  14.381  -1.346
   57   2HG1  ILE   9          HG11      ILE   9 -14.447  14.636   0.394
   58   1HG2  ILE   9          HG23      ILE   9 -11.028  13.647  -1.915
   59   2HG2  ILE   9          HG22      ILE   9 -12.307  14.711  -2.499
   60   3HG2  ILE   9          HG21      ILE   9 -11.163  15.289  -1.289
   61   1HD1  ILE   9          HD13      ILE   9 -12.621  16.433  -0.416
   62   2HD1  ILE   9          HD12      ILE   9 -13.654  16.433  -1.845
   63   3HD1  ILE   9          HD11      ILE   9 -14.332  16.834  -0.267
   64    H    THR  10           HN       THR  10 -12.756  10.855   1.276
   65    HA   THR  10           HA       THR  10  -9.890  10.662   1.406
   66    HB   THR  10           HB       THR  10 -11.945   8.767   2.577
   67    HG1  THR  10           HG1      THR  10 -12.446  10.345   3.840
   68   1HG2  THR  10          HG22      THR  10  -9.187   8.609   2.531
   69   2HG2  THR  10          HG21      THR  10  -9.500   9.416   4.067
   70   3HG2  THR  10          HG23      THR  10 -10.229   7.845   3.732
   71    H    LEU  11           HN       LEU  11 -12.409   8.529   0.051
   72    HA   LEU  11           HA       LEU  11 -10.532   6.443  -0.628
   73   1HB   LEU  11           HB2      LEU  11 -13.295   6.668  -0.585
   74   2HB   LEU  11           HB1      LEU  11 -12.919   6.528  -2.305
   75    HG   LEU  11           HG       LEU  11 -11.493   4.555  -1.787
   76   1HD1  LEU  11          HD13      LEU  11 -11.904   5.474   0.891
   77   2HD1  LEU  11          HD12      LEU  11 -12.554   3.841   0.751
   78   3HD1  LEU  11          HD11      LEU  11 -10.872   4.159   0.330
   79   1HD2  LEU  11          HD23      LEU  11 -13.999   4.456  -2.366
   80   2HD2  LEU  11          HD22      LEU  11 -13.291   3.017  -1.631
   81   3HD2  LEU  11          HD21      LEU  11 -14.254   4.125  -0.652
   82    H    GLN  12           HN       GLN  12 -11.923   9.168  -2.466
   83    HA   GLN  12           HA       GLN  12 -10.820   8.453  -5.004
   84   1HB   GLN  12           HB2      GLN  12 -11.851  10.934  -3.733
   85   2HB   GLN  12           HB1      GLN  12 -10.754  11.167  -5.094
   86   1HG   GLN  12           HG2      GLN  12 -12.904   9.126  -5.413
   87   2HG   GLN  12           HG1      GLN  12 -13.387  10.823  -5.450
   88   1HE2  GLN  12          HE22      GLN  12 -12.062   9.416  -8.829
   89   2HE2  GLN  12          HE21      GLN  12 -12.964   8.601  -7.645
   90    H    GLU  13           HN       GLU  13  -9.491  10.464  -2.378
   91    HA   GLU  13           HA       GLU  13  -6.968  10.915  -3.729
   92   1HB   GLU  13           HB2      GLU  13  -7.712  11.119  -0.793
   93   2HB   GLU  13           HB1      GLU  13  -6.202  11.703  -1.493
   94   1HG   GLU  13           HG2      GLU  13  -7.929  12.917  -3.160
   95   2HG   GLU  13           HG1      GLU  13  -8.955  12.812  -1.729
   96    H    ILE  14           HN       ILE  14  -8.277   8.303  -1.841
   97    HA   ILE  14           HA       ILE  14  -5.767   7.134  -1.004
   98    HB   ILE  14           HB       ILE  14  -8.547   6.605  -0.693
   99   1HG1  ILE  14          HG12      ILE  14  -6.477   4.796   0.475
  100   2HG1  ILE  14          HG11      ILE  14  -6.371   6.518   0.851
  101   1HG2  ILE  14          HG21      ILE  14  -8.333   5.000  -2.566
  102   2HG2  ILE  14          HG23      ILE  14  -7.005   4.201  -1.721
  103   3HG2  ILE  14          HG22      ILE  14  -8.630   4.170  -1.040
  104   1HD1  ILE  14          HD11      ILE  14  -8.962   6.254   1.317
  105   2HD1  ILE  14          HD13      ILE  14  -8.531   4.558   1.540
  106   3HD1  ILE  14          HD12      ILE  14  -7.785   5.796   2.549
  107    H    ILE  15           HN       ILE  15  -7.782   6.933  -3.879
  108    HA   ILE  15           HA       ILE  15  -6.355   4.694  -5.058
  109    HB   ILE  15           HB       ILE  15  -8.594   6.450  -5.733
  110   1HG1  ILE  15          HG12      ILE  15  -7.823   3.693  -6.744
  111   2HG1  ILE  15          HG11      ILE  15  -8.672   3.984  -5.225
  112   1HG2  ILE  15          HG21      ILE  15  -6.654   5.629  -7.907
  113   2HG2  ILE  15          HG23      ILE  15  -8.329   6.082  -8.214
  114   3HG2  ILE  15          HG22      ILE  15  -7.215   7.259  -7.529
  115   1HD1  ILE  15          HD11      ILE  15 -10.479   5.140  -6.488
  116   2HD1  ILE  15          HD13      ILE  15  -9.645   4.751  -7.992
  117   3HD1  ILE  15          HD12      ILE  15 -10.291   3.457  -6.982
  118    H    LYS  16           HN       LYS  16  -6.368   8.220  -5.610
  119    HA   LYS  16           HA       LYS  16  -4.419   8.311  -7.652
  120   1HB   LYS  16           HB2      LYS  16  -5.148  10.248  -5.458
  121   2HB   LYS  16           HB1      LYS  16  -3.882  10.622  -6.627
  122   1HG   LYS  16           HG2      LYS  16  -5.823   9.779  -8.314
  123   2HG   LYS  16           HG1      LYS  16  -6.818  10.441  -7.017
  124   1HD   LYS  16           HD2      LYS  16  -4.482  12.030  -8.028
  125   2HD   LYS  16           HD1      LYS  16  -5.984  12.019  -8.952
  126   1HE   LYS  16           HE2      LYS  16  -6.044  12.540  -5.991
  127   2HE   LYS  16           HE1      LYS  16  -5.650  13.845  -7.109
  128   1HZ   LYS  16           HZ2      LYS  16  -7.720  13.351  -8.305
  129   2HZ   LYS  16           HZ1      LYS  16  -8.108  12.178  -7.138
  130   3HZ   LYS  16           HZ3      LYS  16  -8.003  13.812  -6.695
  131    H    THR  17           HN       THR  17  -3.954   8.333  -4.124
  132    HA   THR  17           HA       THR  17  -1.089   8.567  -4.238
  133    HB   THR  17           HB       THR  17  -2.813   7.346  -2.063
  134    HG1  THR  17           HG1      THR  17  -2.184   9.639  -1.279
  135   1HG2  THR  17          HG23      THR  17   0.068   8.147  -2.266
  136   2HG2  THR  17          HG22      THR  17  -0.765   8.344  -0.724
  137   3HG2  THR  17          HG21      THR  17  -0.648   6.748  -1.465
  138    H    LEU  18           HN       LEU  18  -3.288   5.780  -4.053
  139    HA   LEU  18           HA       LEU  18  -1.362   3.753  -3.703
  140   1HB   LEU  18           HB2      LEU  18  -3.838   3.410  -3.651
  141   2HB   LEU  18           HB1      LEU  18  -3.878   3.613  -5.398
  142    HG   LEU  18           HG       LEU  18  -3.821   1.200  -4.437
  143   1HD1  LEU  18          HD12      LEU  18  -2.971   2.316  -6.824
  144   2HD1  LEU  18          HD11      LEU  18  -1.607   1.306  -6.342
  145   3HD1  LEU  18          HD13      LEU  18  -3.210   0.598  -6.513
  146   1HD2  LEU  18          HD23      LEU  18  -1.844   1.830  -2.915
  147   2HD2  LEU  18          HD22      LEU  18  -1.725   0.305  -3.794
  148   3HD2  LEU  18          HD21      LEU  18  -0.850   1.725  -4.368
  149    H    ASN  19           HN       ASN  19  -2.252   5.599  -6.554
  150    HA   ASN  19           HA       ASN  19  -0.673   3.876  -8.339
  151   1HB   ASN  19           HB2      ASN  19  -2.632   4.779  -9.337
  152   2HB   ASN  19           HB1      ASN  19  -2.283   6.400  -8.734
  153   1HD2  ASN  19          HD22      ASN  19  -0.261   7.250 -11.493
  154   2HD2  ASN  19          HD21      ASN  19  -1.024   7.761 -10.066
  155    H    SER  20           HN       SER  20  -0.250   6.858  -6.554
  156    HA   SER  20           HA       SER  20   1.983   7.861  -8.089
  157   1HB   SER  20           HB2      SER  20   1.127   9.516  -6.720
  158   2HB   SER  20           HB1      SER  20   0.805   8.402  -5.394
  159    HG   SER  20           HG       SER  20   3.068   9.842  -6.010
  160    H    LEU  21           HN       LEU  21   1.694   5.559  -5.422
  161    HA   LEU  21           HA       LEU  21   4.505   5.458  -4.807
  162   1HB   LEU  21           HB2      LEU  21   2.128   3.752  -4.222
  163   2HB   LEU  21           HB1      LEU  21   3.719   3.008  -4.061
  164    HG   LEU  21           HG       LEU  21   4.365   5.097  -2.701
  165   1HD1  LEU  21          HD13      LEU  21   1.427   5.463  -3.088
  166   2HD1  LEU  21          HD12      LEU  21   2.095   5.859  -1.504
  167   3HD1  LEU  21          HD11      LEU  21   2.702   6.674  -2.946
  168   1HD2  LEU  21          HD22      LEU  21   2.817   2.722  -1.971
  169   2HD2  LEU  21          HD21      LEU  21   4.234   3.419  -1.188
  170   3HD2  LEU  21          HD23      LEU  21   2.625   4.037  -0.813
  171    H    THR  22           HN       THR  22   2.758   4.354  -7.551
  172    HA   THR  22           HA       THR  22   4.668   2.191  -8.148
  173    HB   THR  22           HB       THR  22   2.930   2.999 -10.347
  174    HG1  THR  22           HG1      THR  22   1.041   2.875  -9.362
  175   1HG2  THR  22          HG22      THR  22   4.148   0.787  -9.884
  176   2HG2  THR  22          HG21      THR  22   2.872   0.461  -8.712
  177   3HG2  THR  22          HG23      THR  22   2.471   0.671 -10.417
  178    H    GLU  23           HN       GLU  23   5.216   5.329  -8.140
  179    HA   GLU  23           HA       GLU  23   6.135   5.694 -10.907
  180   1HB   GLU  23           HB2      GLU  23   5.472   7.395  -8.716
  181   2HB   GLU  23           HB1      GLU  23   7.164   7.690  -9.118
  182   1HG   GLU  23           HG2      GLU  23   5.035   7.560 -11.255
  183   2HG   GLU  23           HG1      GLU  23   5.392   9.060 -10.399
  184    H    GLN  24           HN       GLN  24   7.623   5.549  -7.668
  185    HA   GLN  24           HA       GLN  24  10.215   4.783  -8.972
  186   1HB   GLN  24           HB2      GLN  24   9.643   6.732  -7.006
  187   2HB   GLN  24           HB1      GLN  24  10.431   5.409  -6.147
  188   1HG   GLN  24           HG2      GLN  24  11.651   6.148  -8.746
  189   2HG   GLN  24           HG1      GLN  24  11.794   7.353  -7.467
  190   1HE2  GLN  24          HE22      GLN  24  13.657   5.051  -5.314
  191   2HE2  GLN  24          HE21      GLN  24  12.376   6.159  -5.198
  192    H    LYS  25           HN       LYS  25   8.159   2.902  -8.690
  193    HA   LYS  25           HA       LYS  25   9.212   1.218  -6.460
  194   1HB   LYS  25           HB2      LYS  25   6.494   1.823  -7.305
  195   2HB   LYS  25           HB1      LYS  25   6.795   0.085  -7.289
  196   1HG   LYS  25           HG2      LYS  25   8.009   0.857  -4.956
  197   2HG   LYS  25           HG1      LYS  25   6.661   1.989  -5.033
  198   1HD   LYS  25           HD2      LYS  25   5.497  -0.402  -5.772
  199   2HD   LYS  25           HD1      LYS  25   6.647  -0.896  -4.530
  200   1HE   LYS  25           HE2      LYS  25   4.406   1.116  -4.297
  201   2HE   LYS  25           HE1      LYS  25   4.655  -0.346  -3.345
  202   1HZ   LYS  25           HZ2      LYS  25   6.939   0.970  -2.898
  203   2HZ   LYS  25           HZ1      LYS  25   5.859   2.271  -3.065
  204   3HZ   LYS  25           HZ3      LYS  25   5.572   1.077  -1.896
  205    H    THR  26           HN       THR  26  10.806   0.188  -7.554
  206    HA   THR  26           HA       THR  26  10.100  -2.028  -9.257
  207    HB   THR  26           HB       THR  26  10.005  -0.220 -10.956
  208    HG1  THR  26           HG1      THR  26  12.398  -1.418 -11.598
  209   1HG2  THR  26          HG21      THR  26  11.687   1.225  -9.693
  210   2HG2  THR  26          HG23      THR  26  12.944   0.204 -10.392
  211   3HG2  THR  26          HG22      THR  26  11.893   1.155 -11.442
  212    H    LEU  27           HN       LEU  27  12.622   0.205  -8.172
  213    HA   LEU  27           HA       LEU  27  14.725  -1.815  -8.224
  214   1HB   LEU  27           HB2      LEU  27  14.976   0.750  -8.438
  215   2HB   LEU  27           HB1      LEU  27  14.730   0.799  -6.692
  216    HG   LEU  27           HG       LEU  27  16.784  -1.065  -7.862
  217   1HD1  LEU  27          HD12      LEU  27  16.861   1.893  -7.777
  218   2HD1  LEU  27          HD11      LEU  27  18.274   1.085  -7.098
  219   3HD1  LEU  27          HD13      LEU  27  17.794   0.770  -8.765
  220   1HD2  LEU  27          HD23      LEU  27  15.902  -0.186  -5.249
  221   2HD2  LEU  27          HD22      LEU  27  17.037  -1.472  -5.657
  222   3HD2  LEU  27          HD21      LEU  27  17.612   0.184  -5.465
  223    H    CYS  28           HN       CYS  28  12.553  -0.381  -5.827
  224    HA   CYS  28           HA       CYS  28  13.713  -2.043  -3.680
  225   1HB   CYS  28           HB2      CYS  28  12.448   0.431  -3.701
  226   2HB   CYS  28           HB1      CYS  28  11.215  -0.653  -3.058
  227    H    THR  29           HN       THR  29  11.185  -2.235  -6.030
  228    HA   THR  29           HA       THR  29   9.447  -4.028  -4.529
  229    HB   THR  29           HB       THR  29   8.272  -4.320  -6.632
  230    HG1  THR  29           HG1      THR  29   9.944  -4.612  -8.036
  231   1HG2  THR  29          HG22      THR  29   8.114  -2.099  -5.437
  232   2HG2  THR  29          HG21      THR  29   9.325  -1.482  -6.558
  233   3HG2  THR  29          HG23      THR  29   7.760  -2.022  -7.163
  234    H    GLU  30           HN       GLU  30  12.534  -4.496  -5.757
  235    HA   GLU  30           HA       GLU  30  12.107  -7.175  -6.837
  236   1HB   GLU  30           HB2      GLU  30  14.200  -5.202  -6.836
  237   2HB   GLU  30           HB1      GLU  30  14.854  -6.739  -6.268
  238   1HG   GLU  30           HG2      GLU  30  13.049  -6.733  -8.661
  239   2HG   GLU  30           HG1      GLU  30  14.724  -6.215  -8.858
  240    H    LEU  31           HN       LEU  31  11.816  -6.206  -3.742
  241    HA   LEU  31           HA       LEU  31  13.490  -8.317  -2.547
  242   1HB   LEU  31           HB2      LEU  31  11.540  -6.379  -1.247
  243   2HB   LEU  31           HB1      LEU  31  12.674  -7.431  -0.401
  244    HG   LEU  31           HG       LEU  31  13.692  -5.505  -2.472
  245   1HD1  LEU  31          HD12      LEU  31  12.219  -4.249  -0.865
  246   2HD1  LEU  31          HD11      LEU  31  13.234  -4.836   0.452
  247   3HD1  LEU  31          HD13      LEU  31  13.915  -3.774  -0.781
  248   1HD2  LEU  31          HD23      LEU  31  14.909  -7.441  -1.014
  249   2HD2  LEU  31          HD22      LEU  31  15.734  -5.970  -1.528
  250   3HD2  LEU  31          HD21      LEU  31  15.069  -6.083   0.101
  251    H    THR  32           HN       THR  32  10.633  -8.138  -0.755
  252    HA   THR  32           HA       THR  32   8.874  -9.719  -2.360
  253    HB   THR  32           HB       THR  32   9.353 -11.752  -0.576
  254    HG1  THR  32           HG1      THR  32  11.906 -11.210  -1.514
  255   1HG2  THR  32          HG21      THR  32   9.687 -11.199  -3.398
  256   2HG2  THR  32          HG23      THR  32  10.941 -12.305  -2.839
  257   3HG2  THR  32          HG22      THR  32   9.241 -12.710  -2.611
  258    H    VAL  33           HN       VAL  33   6.887 -10.074  -1.284
  259    HA   VAL  33           HA       VAL  33   6.745  -9.292   1.581
  260    HB   VAL  33           HB       VAL  33   4.892  -7.757   1.135
  261   1HG1  VAL  33          HG13      VAL  33   7.503  -7.236   0.622
  262   2HG1  VAL  33          HG12      VAL  33   6.793  -6.841  -0.942
  263   3HG1  VAL  33          HG11      VAL  33   6.233  -6.018   0.513
  264   1HG2  VAL  33          HG23      VAL  33   5.128  -8.973  -1.575
  265   2HG2  VAL  33          HG22      VAL  33   3.690  -8.434  -0.708
  266   3HG2  VAL  33          HG21      VAL  33   4.728  -7.257  -1.513
  267    H    THR  34           HN       THR  34   3.744  -9.310   1.390
  268    HA   THR  34           HA       THR  34   3.399 -12.245   0.946
  269    HB   THR  34           HB       THR  34   2.927 -10.610   3.268
  270    HG1  THR  34           HG1      THR  34   2.969 -12.544   4.175
  271   1HG2  THR  34          HG22      THR  34   0.471 -11.975   2.129
  272   2HG2  THR  34          HG21      THR  34   0.614 -11.370   3.774
  273   3HG2  THR  34          HG23      THR  34   0.668 -10.247   2.416
  274    H    ASP  35           HN       ASP  35   1.481 -12.917  -0.073
  275    HA   ASP  35           HA       ASP  35   0.074 -10.811  -1.605
  276   1HB   ASP  35           HB2      ASP  35   0.875 -13.042  -2.610
  277   2HB   ASP  35           HB1      ASP  35  -0.445 -13.793  -1.712
  278    H    ILE  36           HN       ILE  36  -1.655  -9.886  -0.591
  279    HA   ILE  36           HA       ILE  36  -3.081 -11.464   1.472
  280    HB   ILE  36           HB       ILE  36  -3.888  -9.402   2.311
  281   1HG1  ILE  36          HG12      ILE  36  -3.177  -8.321  -0.428
  282   2HG1  ILE  36          HG11      ILE  36  -4.764  -8.354   0.344
  283   1HG2  ILE  36          HG23      ILE  36  -1.323  -9.854   2.344
  284   2HG2  ILE  36          HG22      ILE  36  -1.235  -8.550   1.160
  285   3HG2  ILE  36          HG21      ILE  36  -1.889  -8.238   2.767
  286   1HD1  ILE  36          HD11      ILE  36  -3.628  -6.898   2.190
  287   2HD1  ILE  36          HD13      ILE  36  -2.410  -6.582   0.954
  288   3HD1  ILE  36          HD12      ILE  36  -4.090  -6.131   0.672
  289    H    PHE  37           HN       PHE  37  -3.415 -11.915  -1.475
  290    HA   PHE  37           HA       PHE  37  -6.368 -11.452  -1.575
  291   1HB   PHE  37           HB2      PHE  37  -4.546 -11.651  -3.989
  292   2HB   PHE  37           HB1      PHE  37  -6.245 -11.178  -3.963
  293    HD1  PHE  37           HD2      PHE  37  -6.373  -9.331  -1.686
  294    HD2  PHE  37           HD1      PHE  37  -3.354  -9.762  -4.710
  295    HE1  PHE  37           HE2      PHE  37  -5.713  -6.962  -1.365
  296    HE2  PHE  37           HE1      PHE  37  -2.693  -7.393  -4.389
  297    HZ   PHE  37           HZ       PHE  37  -3.872  -5.994  -2.716
  298    H    ALA  38           HN       ALA  38  -4.957 -13.702  -0.430
  299    HA   ALA  38           HA       ALA  38  -4.678 -15.924  -2.155
  300   1HB   ALA  38           HB3      ALA  38  -5.349 -15.641   0.763
  301   2HB   ALA  38           HB2      ALA  38  -5.373 -17.231   0.001
  302   3HB   ALA  38           HB1      ALA  38  -3.885 -16.285   0.018
  303    H    ALA  39           HN       ALA  39  -7.590 -14.515  -0.734
  304    HA   ALA  39           HA       ALA  39  -9.171 -16.618  -2.162
  305   1HB   ALA  39           HB1      ALA  39  -9.376 -15.501   0.516
  306   2HB   ALA  39           HB3      ALA  39 -10.889 -15.326  -0.375
  307   3HB   ALA  39           HB2      ALA  39 -10.167 -16.922  -0.165
  308    H    SER  40           HN       SER  40 -11.582 -15.546  -2.418
  309    HA   SER  40           HA       SER  40 -11.096 -13.202  -4.171
  310   1HB   SER  40           HB2      SER  40 -12.305 -14.863  -5.329
  311   2HB   SER  40           HB1      SER  40 -13.310 -15.233  -3.930
  312    HG   SER  40           HG       SER  40 -13.303 -12.771  -5.354
  313    H    LYS  41           HN       LYS  41 -13.002 -14.180  -1.341
  314    HA   LYS  41           HA       LYS  41 -13.344 -11.345  -0.643
  315   1HB   LYS  41           HB2      LYS  41 -15.261 -12.091  -2.234
  316   2HB   LYS  41           HB1      LYS  41 -15.851 -13.004  -0.845
  317   1HG   LYS  41           HG2      LYS  41 -15.603 -10.791   0.468
  318   2HG   LYS  41           HG1      LYS  41 -15.505 -10.020  -1.116
  319   1HD   LYS  41           HD2      LYS  41 -17.710 -11.967  -0.810
  320   2HD   LYS  41           HD1      LYS  41 -17.850 -10.517   0.185
  321   1HE   LYS  41           HE2      LYS  41 -17.225 -10.399  -2.772
  322   2HE   LYS  41           HE1      LYS  41 -18.875 -10.365  -2.149
  323   1HZ   LYS  41           HZ2      LYS  41 -16.845  -8.518  -1.078
  324   2HZ   LYS  41           HZ1      LYS  41 -17.639  -8.157  -2.537
  325   3HZ   LYS  41           HZ3      LYS  41 -18.536  -8.351  -1.111
  326    H    ASP  42           HN       ASP  42 -12.131 -13.843   0.507
  327    HA   ASP  42           HA       ASP  42 -13.662 -14.898   2.635
  328   1HB   ASP  42           HB2      ASP  42 -11.719 -15.901   3.241
  329   2HB   ASP  42           HB1      ASP  42 -11.045 -15.158   1.792
  330    H    THR  43           HN       THR  43 -11.943 -11.841   2.348
  331    HA   THR  43           HA       THR  43 -12.983 -11.097   5.052
  332    HB   THR  43           HB       THR  43 -11.035  -9.236   4.474
  333    HG1  THR  43           HG1      THR  43  -9.268 -10.600   3.798
  334   1HG2  THR  43          HG22      THR  43 -11.285 -11.678   6.123
  335   2HG2  THR  43          HG21      THR  43  -9.633 -11.112   5.865
  336   3HG2  THR  43          HG23      THR  43 -10.828 -10.041   6.594
  337    H    THR  44           HN       THR  44 -12.777  -8.363   4.909
  338    HA   THR  44           HA       THR  44 -14.710  -7.743   2.726
  339    HB   THR  44           HB       THR  44 -14.632  -5.571   4.485
  340    HG1  THR  44           HG1      THR  44 -15.156  -7.095   6.414
  341   1HG2  THR  44          HG22      THR  44 -16.510  -7.115   3.337
  342   2HG2  THR  44          HG21      THR  44 -16.590  -7.756   4.979
  343   3HG2  THR  44          HG23      THR  44 -16.869  -6.038   4.687
  344    H    GLU  45           HN       GLU  45 -14.536  -5.169   2.275
  345    HA   GLU  45           HA       GLU  45 -11.974  -4.848   0.958
  346   1HB   GLU  45           HB2      GLU  45 -12.864  -2.885  -0.013
  347   2HB   GLU  45           HB1      GLU  45 -14.261  -3.933   0.173
  348   1HG   GLU  45           HG2      GLU  45 -13.525  -1.811   2.223
  349   2HG   GLU  45           HG1      GLU  45 -14.602  -1.509   0.871
  350    H    LYS  46           HN       LYS  46 -13.478  -3.498   3.861
  351    HA   LYS  46           HA       LYS  46 -11.309  -1.649   4.380
  352   1HB   LYS  46           HB2      LYS  46 -12.339  -1.565   6.704
  353   2HB   LYS  46           HB1      LYS  46 -13.411  -1.116   5.380
  354   1HG   LYS  46           HG2      LYS  46 -14.578  -3.174   5.483
  355   2HG   LYS  46           HG1      LYS  46 -13.307  -3.947   6.427
  356   1HD   LYS  46           HD2      LYS  46 -13.952  -2.934   8.400
  357   2HD   LYS  46           HD1      LYS  46 -14.646  -1.536   7.578
  358   1HE   LYS  46           HE2      LYS  46 -16.008  -4.003   6.837
  359   2HE   LYS  46           HE1      LYS  46 -16.059  -3.729   8.579
  360   1HZ   LYS  46           HZ1      LYS  46 -16.644  -1.315   7.821
  361   2HZ   LYS  46           HZ3      LYS  46 -17.156  -2.096   6.405
  362   3HZ   LYS  46           HZ2      LYS  46 -17.847  -2.511   7.902
  363    H    GLU  47           HN       GLU  47 -12.048  -4.967   5.403
  364    HA   GLU  47           HA       GLU  47  -9.874  -5.127   7.298
  365   1HB   GLU  47           HB2      GLU  47 -11.901  -6.704   7.101
  366   2HB   GLU  47           HB1      GLU  47 -11.038  -7.461   5.762
  367   1HG   GLU  47           HG2      GLU  47  -9.637  -8.545   7.164
  368   2HG   GLU  47           HG1      GLU  47  -9.313  -7.075   8.082
  369    H    THR  48           HN       THR  48 -10.208  -5.589   3.833
  370    HA   THR  48           HA       THR  48  -7.682  -6.882   3.386
  371    HB   THR  48           HB       THR  48  -9.287  -5.081   1.543
  372    HG1  THR  48           HG1      THR  48  -9.685  -7.382   0.732
  373   1HG2  THR  48          HG21      THR  48  -6.925  -6.903   1.132
  374   2HG2  THR  48          HG23      THR  48  -8.031  -6.533  -0.189
  375   3HG2  THR  48          HG22      THR  48  -7.135  -5.234   0.599
  376    H    PHE  49           HN       PHE  49  -8.676  -3.488   3.618
  377    HA   PHE  49           HA       PHE  49  -6.156  -2.384   2.772
  378   1HB   PHE  49           HB2      PHE  49  -8.245  -1.199   4.626
  379   2HB   PHE  49           HB1      PHE  49  -6.929  -0.307   3.870
  380    HD1  PHE  49           HD2      PHE  49  -6.926  -1.603   1.149
  381    HD2  PHE  49           HD1      PHE  49 -10.152  -0.226   3.629
  382    HE1  PHE  49           HE2      PHE  49  -8.330  -1.263  -0.864
  383    HE2  PHE  49           HE1      PHE  49 -11.556   0.114   1.616
  384    HZ   PHE  49           HZ       PHE  49 -10.645  -0.406  -0.632
  385    H    CYS  50           HN       CYS  50  -7.401  -3.446   5.913
  386    HA   CYS  50           HA       CYS  50  -5.294  -2.366   7.528
  387   1HB   CYS  50           HB2      CYS  50  -7.396  -3.284   8.463
  388   2HB   CYS  50           HB1      CYS  50  -6.908  -4.903   7.959
  389    NH1  ARG  51           NH2      ARG  51  -7.290 -11.520   4.786
  390    NH2  ARG  51           NH1      ARG  51  -5.556 -12.346   3.595
  391    H    ARG  51           HN       ARG  51  -5.635  -5.583   5.981
  392    HA   ARG  51           HA       ARG  51  -3.160  -6.639   6.927
  393   1HB   ARG  51           HB2      ARG  51  -4.993  -7.252   4.642
  394   2HB   ARG  51           HB1      ARG  51  -3.381  -7.967   4.633
  395   1HG   ARG  51           HG2      ARG  51  -3.794  -9.269   6.488
  396   2HG   ARG  51           HG1      ARG  51  -4.922  -8.105   7.182
  397   1HD   ARG  51           HD2      ARG  51  -6.342  -9.842   6.503
  398   2HD   ARG  51           HD1      ARG  51  -6.433  -8.721   5.145
  399    HE   ARG  51           HE       ARG  51  -4.341 -10.410   4.477
  400   1HH1  ARG  51          HH21      ARG  51  -7.681 -10.832   5.396
  401   2HH1  ARG  51          HH22      ARG  51  -7.857 -12.282   4.473
  402   1HH2  ARG  51          HH11      ARG  51  -4.606 -12.288   3.290
  403   2HH2  ARG  51          HH12      ARG  51  -6.134 -13.103   3.289
  404    H    ALA  52           HN       ALA  52  -3.940  -4.916   3.905
  405    HA   ALA  52           HA       ALA  52  -1.244  -4.942   2.901
  406   1HB   ALA  52           HB2      ALA  52  -3.795  -3.589   2.216
  407   2HB   ALA  52           HB1      ALA  52  -2.323  -2.772   1.689
  408   3HB   ALA  52           HB3      ALA  52  -2.648  -4.427   1.170
  409    H    ALA  53           HN       ALA  53  -2.796  -3.074   5.362
  410    HA   ALA  53           HA       ALA  53  -1.018  -0.769   5.155
  411   1HB   ALA  53           HB1      ALA  53  -3.434  -1.168   6.369
  412   2HB   ALA  53           HB3      ALA  53  -2.343  -1.330   7.745
  413   3HB   ALA  53           HB2      ALA  53  -2.337   0.148   6.784
  414    H    THR  54           HN       THR  54  -1.146  -3.808   6.935
  415    HA   THR  54           HA       THR  54   1.063  -3.175   8.705
  416    HB   THR  54           HB       THR  54  -0.345  -5.721   7.903
  417    HG1  THR  54           HG1      THR  54  -1.268  -4.344   9.472
  418   1HG2  THR  54          HG23      THR  54   2.204  -5.397   9.489
  419   2HG2  THR  54          HG22      THR  54   1.147  -6.796   9.686
  420   3HG2  THR  54          HG21      THR  54   1.901  -6.471   8.124
  421    H    VAL  55           HN       VAL  55   0.728  -4.963   5.643
  422    HA   VAL  55           HA       VAL  55   3.477  -5.712   5.403
  423    HB   VAL  55           HB       VAL  55   1.337  -5.202   3.314
  424   1HG1  VAL  55          HG13      VAL  55   4.225  -5.879   3.076
  425   2HG1  VAL  55          HG12      VAL  55   3.114  -6.800   2.062
  426   3HG1  VAL  55          HG11      VAL  55   3.168  -5.042   1.940
  427   1HG2  VAL  55          HG23      VAL  55   1.349  -7.164   5.107
  428   2HG2  VAL  55          HG22      VAL  55   0.903  -7.483   3.431
  429   3HG2  VAL  55          HG21      VAL  55   2.527  -7.868   3.999
  430    H    LEU  56           HN       LEU  56   1.682  -2.810   4.482
  431    HA   LEU  56           HA       LEU  56   3.805  -1.516   3.053
  432   1HB   LEU  56           HB2      LEU  56   1.142  -0.891   3.849
  433   2HB   LEU  56           HB1      LEU  56   2.178   0.398   4.460
  434    HG   LEU  56           HG       LEU  56   3.229   0.163   1.998
  435   1HD1  LEU  56          HD12      LEU  56   0.323  -0.670   1.734
  436   2HD1  LEU  56          HD11      LEU  56   1.344  -0.164   0.388
  437   3HD1  LEU  56          HD13      LEU  56   1.733  -1.630   1.287
  438   1HD2  LEU  56          HD23      LEU  56   0.715   1.678   2.776
  439   2HD2  LEU  56          HD22      LEU  56   2.378   2.245   2.924
  440   3HD2  LEU  56          HD21      LEU  56   1.664   2.017   1.328
  441    NH1  ARG  57           NH2      ARG  57   6.775  -1.730  12.879
  442    NH2  ARG  57           NH1      ARG  57   5.583  -0.511  14.359
  443    H    ARG  57           HN       ARG  57   2.943  -1.757   6.461
  444    HA   ARG  57           HA       ARG  57   4.690   0.254   7.479
  445   1HB   ARG  57           HB2      ARG  57   2.878  -1.410   8.615
  446   2HB   ARG  57           HB1      ARG  57   4.367  -2.240   9.067
  447   1HG   ARG  57           HG2      ARG  57   4.408   0.698   9.422
  448   2HG   ARG  57           HG1      ARG  57   3.305  -0.172  10.487
  449   1HD   ARG  57           HD2      ARG  57   5.480  -1.776  10.657
  450   2HD   ARG  57           HD1      ARG  57   6.268  -0.222  10.385
  451    HE   ARG  57           HE       ARG  57   4.421   0.324  12.366
  452   1HH1  ARG  57          HH21      ARG  57   6.980  -2.009  11.942
  453   2HH1  ARG  57          HH22      ARG  57   7.298  -2.120  13.636
  454   1HH2  ARG  57          HH11      ARG  57   4.863   0.155  14.557
  455   2HH2  ARG  57          HH12      ARG  57   6.115  -0.909  15.105
  456    H    GLN  58           HN       GLN  58   5.209  -3.200   6.793
  457    HA   GLN  58           HA       GLN  58   7.951  -3.224   7.678
  458   1HB   GLN  58           HB2      GLN  58   6.193  -5.168   6.952
  459   2HB   GLN  58           HB1      GLN  58   7.173  -5.068   5.489
  460   1HG   GLN  58           HG2      GLN  58   8.195  -6.696   6.963
  461   2HG   GLN  58           HG1      GLN  58   9.226  -5.265   6.933
  462   1HE2  GLN  58          HE22      GLN  58   6.874  -5.688  10.290
  463   2HE2  GLN  58          HE21      GLN  58   6.212  -6.050   8.769
  464    H    PHE  59           HN       PHE  59   6.360  -2.181   4.748
  465    HA   PHE  59           HA       PHE  59   8.608  -2.310   2.978
  466   1HB   PHE  59           HB2      PHE  59   6.139  -1.917   2.386
  467   2HB   PHE  59           HB1      PHE  59   6.416  -0.234   2.839
  468    HD1  PHE  59           HD2      PHE  59   8.428   0.973   1.721
  469    HD2  PHE  59           HD1      PHE  59   6.697  -2.662   0.222
  470    HE1  PHE  59           HE2      PHE  59   9.439   1.409  -0.499
  471    HE2  PHE  59           HE1      PHE  59   7.707  -2.224  -2.000
  472    HZ   PHE  59           HZ       PHE  59   9.079  -0.189  -2.360
  473    OH   TYR  60           OH       TYR  60   5.588   3.465  10.135
  474    H    TYR  60           HN       TYR  60   7.280   0.488   4.802
  475    HA   TYR  60           HA       TYR  60   9.768   1.971   4.240
  476   1HB   TYR  60           HB2      TYR  60   8.616   3.893   4.819
  477   2HB   TYR  60           HB1      TYR  60   7.285   2.879   4.275
  478    HD1  TYR  60           HD1      TYR  60   8.988   4.312   7.221
  479    HD2  TYR  60           HD2      TYR  60   5.682   1.940   5.841
  480    HE1  TYR  60           HE1      TYR  60   7.908   4.521   9.444
  481    HE2  TYR  60           HE2      TYR  60   4.606   2.149   8.065
  482    HH   TYR  60           HH       TYR  60   6.116   2.975  10.768
  483    H    SER  61           HN       SER  61   8.971  -0.290   6.525
  484    HA   SER  61           HA       SER  61  10.002   1.075   8.883
  485   1HB   SER  61           HB2      SER  61   8.979  -1.621   8.222
  486   2HB   SER  61           HB1      SER  61  10.188  -1.568   9.501
  487    HG   SER  61           HG       SER  61   8.885  -0.303  10.691
  488    H    HIS  62           HN       HIS  62  11.267  -1.688   6.962
  489    HA   HIS  62           HA       HIS  62  13.946  -1.152   8.080
  490   1HB   HIS  62           HB2      HIS  62  12.693  -3.482   7.447
  491   2HB   HIS  62           HB1      HIS  62  13.646  -3.218   5.986
  492    HD1  HIS  62           HD1      HIS  62  14.103  -5.262   8.584
  493    HD2  HIS  62           HD2      HIS  62  16.349  -1.940   7.443
  494    HE1  HIS  62           HE1      HIS  62  16.399  -5.562   9.610
  495    H    HIS  63           HN       HIS  63  12.397  -1.224   4.855
  496    HA   HIS  63           HA       HIS  63  14.657  -0.645   3.287
  497   1HB   HIS  63           HB2      HIS  63  11.908   0.545   2.834
  498   2HB   HIS  63           HB1      HIS  63  13.141   0.219   1.617
  499    HD1  HIS  63           HD1      HIS  63  13.637  -2.601   3.481
  500    HD2  HIS  63           HD2      HIS  63  10.367  -1.418   1.180
  501    HE1  HIS  63           HE1      HIS  63  12.352  -4.709   2.925
  502    H    GLU  64           HN       GLU  64  12.684   1.570   5.225
  503    HA   GLU  64           HA       GLU  64  13.875   3.989   4.235
  504   1HB   GLU  64           HB2      GLU  64  11.765   3.936   5.539
  505   2HB   GLU  64           HB1      GLU  64  12.676   3.436   6.964
  506   1HG   GLU  64           HG2      GLU  64  14.096   5.567   6.558
  507   2HG   GLU  64           HG1      GLU  64  12.772   6.076   5.511
  508    H    LYS  65           HN       LYS  65  14.718   1.799   6.911
  509    HA   LYS  65           HA       LYS  65  17.167   3.423   7.406
  510   1HB   LYS  65           HB2      LYS  65  15.601   1.448   9.033
  511   2HB   LYS  65           HB1      LYS  65  17.307   1.709   9.396
  512   1HG   LYS  65           HG2      LYS  65  16.934   4.080   9.728
  513   2HG   LYS  65           HG1      LYS  65  15.261   3.935   9.190
  514   1HD   LYS  65           HD2      LYS  65  15.523   2.027  11.226
  515   2HD   LYS  65           HD1      LYS  65  16.385   3.445  11.823
  516   1HE   LYS  65           HE2      LYS  65  14.320   4.173  12.440
  517   2HE   LYS  65           HE1      LYS  65  14.147   4.594  10.735
  518   1HZ   LYS  65           HZ3      LYS  65  13.379   2.169  10.493
  519   2HZ   LYS  65           HZ2      LYS  65  13.128   2.231  12.173
  520   3HZ   LYS  65           HZ1      LYS  65  12.296   3.300  11.146
  521    H    ASP  66           HN       ASP  66  17.069   1.813   5.034
  522    HA   ASP  66           HA       ASP  66  19.236  -0.124   5.713
  523   1HB   ASP  66           HB2      ASP  66  16.880  -1.161   5.181
  524   2HB   ASP  66           HB1      ASP  66  17.286  -0.760   3.513
  525    H    THR  67           HN       THR  67  20.836  -0.344   4.075
  526    HA   THR  67           HA       THR  67  20.956   1.966   2.245
  527    HB   THR  67           HB       THR  67  23.112  -0.103   2.342
  528    HG1  THR  67           HG1      THR  67  23.217   0.087   4.418
  529   1HG2  THR  67          HG21      THR  67  22.952   2.913   2.191
  530   2HG2  THR  67          HG23      THR  67  24.474   2.038   2.357
  531   3HG2  THR  67          HG22      THR  67  23.471   1.801   0.925
  532    NH1  ARG  68           NH2      ARG  68  21.265  -6.500  -1.908
  533    NH2  ARG  68           NH1      ARG  68  19.543  -7.771  -2.623
  534    H    ARG  68           HN       ARG  68  20.305  -1.451   2.111
  535    HA   ARG  68           HA       ARG  68  21.067  -2.103  -0.511
  536   1HB   ARG  68           HB2      ARG  68  19.619  -3.352   1.473
  537   2HB   ARG  68           HB1      ARG  68  18.404  -3.110   0.218
  538   1HG   ARG  68           HG2      ARG  68  21.130  -4.324  -0.298
  539   2HG   ARG  68           HG1      ARG  68  19.677  -5.276   0.005
  540   1HD   ARG  68           HD2      ARG  68  18.809  -3.544  -1.933
  541   2HD   ARG  68           HD1      ARG  68  20.485  -3.788  -2.416
  542    HE   ARG  68           HE       ARG  68  18.351  -5.645  -2.782
  543   1HH1  ARG  68          HH21      ARG  68  21.665  -5.610  -1.704
  544   2HH1  ARG  68          HH22      ARG  68  21.825  -7.325  -1.824
  545   1HH2  ARG  68          HH11      ARG  68  18.606  -7.854  -2.961
  546   2HH2  ARG  68          HH12      ARG  68  20.120  -8.584  -2.546
  547    H    CYS  69           HN       CYS  69  17.954  -0.667   0.540
  548    HA   CYS  69           HA       CYS  69  17.093  -0.310  -2.225
  549   1HB   CYS  69           HB2      CYS  69  15.578  -0.630  -0.171
  550   2HB   CYS  69           HB1      CYS  69  15.905   1.065   0.188
  551    H    LEU  70           HN       LEU  70  18.808   1.618   0.150
  552    HA   LEU  70           HA       LEU  70  18.351   4.166  -1.149
  553   1HB   LEU  70           HB2      LEU  70  20.475   3.229   0.793
  554   2HB   LEU  70           HB1      LEU  70  20.355   4.890   0.218
  555    HG   LEU  70           HG       LEU  70  18.126   3.386   1.618
  556   1HD1  LEU  70          HD12      LEU  70  20.404   4.296   2.807
  557   2HD1  LEU  70          HD11      LEU  70  19.399   5.743   2.879
  558   3HD1  LEU  70          HD13      LEU  70  18.835   4.240   3.610
  559   1HD2  LEU  70          HD22      LEU  70  18.449   6.182   0.528
  560   2HD2  LEU  70          HD21      LEU  70  17.129   5.043   0.259
  561   3HD2  LEU  70          HD23      LEU  70  17.302   5.838   1.823
  562    H    GLY  71           HN       GLY  71  21.575   2.703  -0.770
  563   1HA   GLY  71           HA2      GLY  71  22.701   1.894  -2.909
  564   2HA   GLY  71           HA1      GLY  71  22.078   3.376  -3.640
  565    H    ALA  72           HN       ALA  72  24.245   4.104  -4.104
  566    HA   ALA  72           HA       ALA  72  25.647   5.136  -1.674
  567   1HB   ALA  72           HB1      ALA  72  26.767   3.119  -2.807
  568   2HB   ALA  72           HB3      ALA  72  27.098   4.206  -4.156
  569   3HB   ALA  72           HB2      ALA  72  27.772   4.547  -2.562
  570    H    THR  73           HN       THR  73  23.820   6.698  -3.064
  571    HA   THR  73           HA       THR  73  25.641   8.707  -4.284
  572    HB   THR  73           HB       THR  73  22.995   7.872  -5.513
  573    HG1  THR  73           HG1      THR  73  24.244   6.943  -7.084
  574   1HG2  THR  73          HG23      THR  73  24.880  10.121  -5.912
  575   2HG2  THR  73          HG22      THR  73  24.312   9.333  -7.384
  576   3HG2  THR  73          HG21      THR  73  23.152  10.026  -6.250
  577    H    ALA  74           HN       ALA  74  24.903  10.869  -4.003
  578    HA   ALA  74           HA       ALA  74  23.146  11.249  -1.710
  579   1HB   ALA  74           HB3      ALA  74  25.171  12.675  -2.256
  580   2HB   ALA  74           HB2      ALA  74  24.233  13.372  -3.578
  581   3HB   ALA  74           HB1      ALA  74  23.700  13.585  -1.910
  582    H    GLN  75           HN       GLN  75  22.953  12.009  -5.192
  583    HA   GLN  75           HA       GLN  75  20.442  13.301  -5.190
  584   1HB   GLN  75           HB2      GLN  75  22.153  12.793  -7.136
  585   2HB   GLN  75           HB1      GLN  75  21.136  11.373  -7.385
  586   1HG   GLN  75           HG2      GLN  75  19.537  12.618  -8.367
  587   2HG   GLN  75           HG1      GLN  75  19.496  13.724  -6.994
  588   1HE2  GLN  75          HE22      GLN  75  22.164  14.605 -10.011
  589   2HE2  GLN  75          HE21      GLN  75  21.868  12.979  -9.628
  590    H    GLN  76           HN       GLN  76  21.193   9.825  -5.408
  591    HA   GLN  76           HA       GLN  76  18.562   8.855  -5.743
  592   1HB   GLN  76           HB2      GLN  76  21.125   7.781  -4.746
  593   2HB   GLN  76           HB1      GLN  76  19.696   6.961  -4.120
  594   1HG   GLN  76           HG2      GLN  76  19.541   7.531  -6.998
  595   2HG   GLN  76           HG1      GLN  76  20.875   6.461  -6.571
  596   1HE2  GLN  76          HE22      GLN  76  17.813   4.367  -7.093
  597   2HE2  GLN  76          HE21      GLN  76  18.693   5.447  -8.062
  598    H    PHE  77           HN       PHE  77  20.283   9.832  -2.807
  599    HA   PHE  77           HA       PHE  77  18.398   8.943  -0.886
  600   1HB   PHE  77           HB2      PHE  77  20.712  10.602  -0.917
  601   2HB   PHE  77           HB1      PHE  77  19.434  11.503  -0.100
  602    HD1  PHE  77           HD1      PHE  77  20.951   8.074  -0.217
  603    HD2  PHE  77           HD2      PHE  77  18.991  11.073   2.150
  604    HE1  PHE  77           HE1      PHE  77  21.243   6.668   1.805
  605    HE2  PHE  77           HE2      PHE  77  19.284   9.669   4.173
  606    HZ   PHE  77           HZ       PHE  77  20.409   7.466   4.000
  607    H    HIS  78           HN       HIS  78  18.495  11.929  -2.808
  608    HA   HIS  78           HA       HIS  78  16.298  13.247  -1.569
  609   1HB   HIS  78           HB2      HIS  78  17.904  14.265  -3.234
  610   2HB   HIS  78           HB1      HIS  78  17.040  13.394  -4.502
  611    HD1  HIS  78           HD1      HIS  78  15.709  15.190  -5.655
  612    HD2  HIS  78           HD2      HIS  78  15.384  15.428  -1.505
  613    HE1  HIS  78           HE1      HIS  78  13.976  16.973  -5.172
  614    NH1  ARG  79           NH2      ARG  79  11.084  10.226  -9.540
  615    NH2  ARG  79           NH1      ARG  79   9.961  11.400  -7.974
  616    H    ARG  79           HN       ARG  79  16.319  11.308  -4.574
  617    HA   ARG  79           HA       ARG  79  13.497  11.288  -4.936
  618   1HB   ARG  79           HB2      ARG  79  15.770   9.581  -5.873
  619   2HB   ARG  79           HB1      ARG  79  14.127   8.980  -6.104
  620   1HG   ARG  79           HG2      ARG  79  14.328  11.789  -6.828
  621   2HG   ARG  79           HG1      ARG  79  15.476  10.810  -7.743
  622   1HD   ARG  79           HD2      ARG  79  13.622  10.530  -9.084
  623   2HD   ARG  79           HD1      ARG  79  13.349   9.202  -7.957
  624    HE   ARG  79           HE       ARG  79  12.095  11.376  -6.768
  625   1HH1  ARG  79          HH21      ARG  79  11.919   9.792  -9.874
  626   2HH1  ARG  79          HH22      ARG  79  10.252  10.189 -10.094
  627   1HH2  ARG  79          HH11      ARG  79   9.936  11.873  -7.093
  628   2HH2  ARG  79          HH12      ARG  79   9.138  11.355  -8.540
  629    H    HIS  80           HN       HIS  80  15.470   9.537  -2.664
  630    HA   HIS  80           HA       HIS  80  13.488   7.438  -2.214
  631   1HB   HIS  80           HB2      HIS  80  16.174   7.709  -1.635
  632   2HB   HIS  80           HB1      HIS  80  15.415   7.923  -0.057
  633    HD1  HIS  80           HD1      HIS  80  14.041   5.919   0.897
  634    HD2  HIS  80           HD2      HIS  80  15.880   5.115  -2.757
  635    HE1  HIS  80           HE1      HIS  80  13.881   3.415   0.552
  636    H    LYS  81           HN       LYS  81  14.287  10.566  -0.817
  637    HA   LYS  81           HA       LYS  81  12.838  10.358   1.614
  638   1HB   LYS  81           HB2      LYS  81  13.379  12.727  -0.194
  639   2HB   LYS  81           HB1      LYS  81  12.615  12.876   1.389
  640   1HG   LYS  81           HG2      LYS  81  14.768  11.351   2.038
  641   2HG   LYS  81           HG1      LYS  81  15.438  12.283   0.699
  642   1HD   LYS  81           HD2      LYS  81  15.486  14.190   1.915
  643   2HD   LYS  81           HD1      LYS  81  13.854  13.929   2.530
  644   1HE   LYS  81           HE2      LYS  81  15.749  13.899   4.262
  645   2HE   LYS  81           HE1      LYS  81  14.630  12.536   4.297
  646   1HZ   LYS  81           HZ2      LYS  81  16.939  12.270   2.551
  647   2HZ   LYS  81           HZ1      LYS  81  17.259  12.248   4.220
  648   3HZ   LYS  81           HZ3      LYS  81  16.190  11.116   3.548
  649    H    GLN  82           HN       GLN  82  11.763  11.154  -1.665
  650    HA   GLN  82           HA       GLN  82   9.088  11.914  -0.977
  651   1HB   GLN  82           HB2      GLN  82  10.387  10.871  -3.490
  652   2HB   GLN  82           HB1      GLN  82   8.647  11.153  -3.422
  653   1HG   GLN  82           HG2      GLN  82   9.722  13.455  -2.293
  654   2HG   GLN  82           HG1      GLN  82  10.830  13.085  -3.614
  655   1HE2  GLN  82          HE22      GLN  82   6.880  13.678  -4.633
  656   2HE2  GLN  82          HE21      GLN  82   7.240  12.909  -3.162
  657    H    LEU  83           HN       LEU  83  10.598   8.788  -1.593
  658    HA   LEU  83           HA       LEU  83   8.147   7.272  -1.737
  659   1HB   LEU  83           HB2      LEU  83  10.186   6.322  -2.623
  660   2HB   LEU  83           HB1      LEU  83  11.005   6.496  -1.074
  661    HG   LEU  83           HG       LEU  83   9.332   4.889  -0.082
  662   1HD1  LEU  83          HD11      LEU  83   8.304   5.099  -2.855
  663   2HD1  LEU  83          HD13      LEU  83   8.355   3.471  -2.179
  664   3HD1  LEU  83          HD12      LEU  83   7.443   4.739  -1.358
  665   1HD2  LEU  83          HD23      LEU  83  11.637   4.369  -1.408
  666   2HD2  LEU  83          HD22      LEU  83  10.665   3.115  -0.638
  667   3HD2  LEU  83          HD21      LEU  83  10.511   3.410  -2.370
  668    H    ILE  84           HN       ILE  84  10.400   7.968   0.944
  669    HA   ILE  84           HA       ILE  84   9.051   6.347   2.875
  670    HB   ILE  84           HB       ILE  84  10.573   8.871   3.537
  671   1HG1  ILE  84          HG12      ILE  84  12.081   7.847   2.050
  672   2HG1  ILE  84          HG11      ILE  84  12.559   7.174   3.606
  673   1HG2  ILE  84          HG22      ILE  84  10.179   6.190   4.896
  674   2HG2  ILE  84          HG21      ILE  84  11.285   7.436   5.473
  675   3HG2  ILE  84          HG23      ILE  84   9.550   7.750   5.428
  676   1HD1  ILE  84          HD13      ILE  84  10.768   5.319   2.978
  677   2HD1  ILE  84          HD12      ILE  84  11.119   5.856   1.335
  678   3HD1  ILE  84          HD11      ILE  84  12.415   5.233   2.354
  679    NH1  ARG  85           NH2      ARG  85   7.095  15.032   1.792
  680    NH2  ARG  85           NH1      ARG  85   7.978  16.733   2.986
  681    H    ARG  85           HN       ARG  85   8.582   9.718   1.889
  682    HA   ARG  85           HA       ARG  85   6.748  10.369   4.017
  683   1HB   ARG  85           HB2      ARG  85   7.673  11.604   1.504
  684   2HB   ARG  85           HB1      ARG  85   6.028  12.035   1.965
  685   1HG   ARG  85           HG2      ARG  85   6.825  13.452   3.517
  686   2HG   ARG  85           HG1      ARG  85   7.643  12.116   4.322
  687   1HD   ARG  85           HD2      ARG  85   9.655  12.764   3.542
  688   2HD   ARG  85           HD1      ARG  85   9.053  12.934   1.898
  689    HE   ARG  85           HE       ARG  85   9.613  15.068   3.705
  690   1HH1  ARG  85          HH21      ARG  85   7.112  14.084   1.482
  691   2HH1  ARG  85          HH22      ARG  85   6.394  15.655   1.443
  692   1HH2  ARG  85          HH11      ARG  85   8.677  17.088   3.606
  693   2HH2  ARG  85          HH12      ARG  85   7.278  17.346   2.619
  694    H    PHE  86           HN       PHE  86   6.264   9.293   0.660
  695    HA   PHE  86           HA       PHE  86   3.404   9.357   0.713
  696   1HB   PHE  86           HB2      PHE  86   5.495   8.432  -1.071
  697   2HB   PHE  86           HB1      PHE  86   4.153   7.290  -1.030
  698    HD1  PHE  86           HD2      PHE  86   1.769   8.772  -0.731
  699    HD2  PHE  86           HD1      PHE  86   5.321   9.896  -2.867
  700    HE1  PHE  86           HE2      PHE  86   0.431  10.288  -2.161
  701    HE2  PHE  86           HE1      PHE  86   3.983  11.413  -4.299
  702    HZ   PHE  86           HZ       PHE  86   1.534  11.611  -3.946
  703    H    LEU  87           HN       LEU  87   5.714   6.983   1.865
  704    HA   LEU  87           HA       LEU  87   3.781   4.827   2.059
  705   1HB   LEU  87           HB2      LEU  87   6.580   5.289   3.029
  706   2HB   LEU  87           HB1      LEU  87   5.644   3.950   3.700
  707    HG   LEU  87           HG       LEU  87   5.791   4.373   0.723
  708   1HD1  LEU  87          HD12      LEU  87   8.119   4.267   1.644
  709   2HD1  LEU  87          HD11      LEU  87   7.719   2.709   2.366
  710   3HD1  LEU  87          HD13      LEU  87   7.714   2.894   0.614
  711   1HD2  LEU  87          HD22      LEU  87   4.697   2.430   2.594
  712   2HD2  LEU  87          HD21      LEU  87   4.387   2.612   0.867
  713   3HD2  LEU  87          HD23      LEU  87   5.766   1.662   1.419
  714    H    LYS  88           HN       LYS  88   5.323   6.900   4.568
  715    HA   LYS  88           HA       LYS  88   3.798   5.925   6.741
  716   1HB   LYS  88           HB2      LYS  88   4.819   8.747   6.289
  717   2HB   LYS  88           HB1      LYS  88   4.288   8.091   7.838
  718   1HG   LYS  88           HG2      LYS  88   6.048   6.197   7.294
  719   2HG   LYS  88           HG1      LYS  88   6.745   7.433   6.246
  720   1HD   LYS  88           HD2      LYS  88   7.850   7.913   8.225
  721   2HD   LYS  88           HD1      LYS  88   6.437   8.954   8.399
  722   1HE   LYS  88           HE2      LYS  88   5.316   6.970   9.583
  723   2HE   LYS  88           HE1      LYS  88   6.925   6.251   9.663
  724   1HZ   LYS  88           HZ3      LYS  88   7.231   8.855  10.497
  725   2HZ   LYS  88           HZ2      LYS  88   5.805   8.321  11.250
  726   3HZ   LYS  88           HZ1      LYS  88   7.257   7.466  11.470
  727    NH1  ARG  89           NH2      ARG  89  -1.291  13.901   1.462
  728    NH2  ARG  89           NH1      ARG  89  -2.879  12.930   0.183
  729    H    ARG  89           HN       ARG  89   2.945   8.206   4.204
  730    HA   ARG  89           HA       ARG  89   0.551   9.190   5.501
  731   1HB   ARG  89           HB2      ARG  89   1.493  10.536   3.756
  732   2HB   ARG  89           HB1      ARG  89   1.484   9.187   2.621
  733   1HG   ARG  89           HG2      ARG  89  -0.782   9.354   2.225
  734   2HG   ARG  89           HG1      ARG  89  -1.123   9.985   3.836
  735   1HD   ARG  89           HD2      ARG  89  -0.572  12.162   3.253
  736   2HD   ARG  89           HD1      ARG  89   0.519  11.652   1.965
  737    HE   ARG  89           HE       ARG  89  -1.997  10.834   1.107
  738   1HH1  ARG  89          HH21      ARG  89  -0.535  13.840   2.110
  739   2HH1  ARG  89          HH22      ARG  89  -1.590  14.797   1.134
  740   1HH2  ARG  89          HH11      ARG  89  -3.345  12.112  -0.153
  741   2HH2  ARG  89          HH12      ARG  89  -3.165  13.835  -0.136
  742    H    LEU  90           HN       LEU  90   1.177   6.653   3.085
  743    HA   LEU  90           HA       LEU  90  -1.586   5.906   2.768
  744   1HB   LEU  90           HB2      LEU  90   0.885   5.164   1.627
  745   2HB   LEU  90           HB1      LEU  90   0.224   3.689   2.334
  746    HG   LEU  90           HG       LEU  90  -1.269   5.548   0.461
  747   1HD1  LEU  90          HD13      LEU  90   0.704   3.777  -0.220
  748   2HD1  LEU  90          HD12      LEU  90  -0.730   2.755  -0.317
  749   3HD1  LEU  90          HD11      LEU  90  -0.631   4.230  -1.279
  750   1HD2  LEU  90          HD22      LEU  90  -2.690   4.360   2.125
  751   2HD2  LEU  90          HD21      LEU  90  -2.987   3.801   0.479
  752   3HD2  LEU  90          HD23      LEU  90  -2.010   2.827   1.578
  753    H    ASP  91           HN       ASP  91   0.741   5.238   5.260
  754    HA   ASP  91           HA       ASP  91  -0.237   2.720   6.159
  755   1HB   ASP  91           HB2      ASP  91   1.707   3.208   7.265
  756   2HB   ASP  91           HB1      ASP  91   1.353   4.936   7.343
  757    NH1  ARG  92           NH2      ARG  92  -6.534   9.858   8.614
  758    NH2  ARG  92           NH1      ARG  92  -5.126  11.494   9.279
  759    H    ARG  92           HN       ARG  92  -1.049   5.992   7.401
  760    HA   ARG  92           HA       ARG  92  -3.221   4.910   9.008
  761   1HB   ARG  92           HB2      ARG  92  -1.777   7.084   9.360
  762   2HB   ARG  92           HB1      ARG  92  -3.004   7.823   8.332
  763   1HG   ARG  92           HG2      ARG  92  -4.053   6.084  10.483
  764   2HG   ARG  92           HG1      ARG  92  -3.257   7.559  11.034
  765   1HD   ARG  92           HD2      ARG  92  -5.314   7.605   8.826
  766   2HD   ARG  92           HD1      ARG  92  -5.781   7.708  10.524
  767    HE   ARG  92           HE       ARG  92  -3.840   9.656  10.272
  768   1HH1  ARG  92          HH21      ARG  92  -6.793   8.896   8.568
  769   2HH1  ARG  92          HH22      ARG  92  -7.112  10.548   8.179
  770   1HH2  ARG  92          HH11      ARG  92  -4.294  11.788   9.750
  771   2HH2  ARG  92          HH12      ARG  92  -5.717  12.170   8.840
  772    H    ASN  93           HN       ASN  93  -2.938   6.136   5.747
  773    HA   ASN  93           HA       ASN  93  -5.795   6.715   5.511
  774   1HB   ASN  93           HB2      ASN  93  -3.438   6.733   3.675
  775   2HB   ASN  93           HB1      ASN  93  -5.048   6.630   2.960
  776   1HD2  ASN  93          HD22      ASN  93  -4.784  10.212   3.165
  777   2HD2  ASN  93          HD21      ASN  93  -4.511   8.895   2.130
  778    H    LEU  94           HN       LEU  94  -3.875   3.848   5.284
  779    HA   LEU  94           HA       LEU  94  -5.778   2.484   3.502
  780   1HB   LEU  94           HB2      LEU  94  -3.127   2.088   4.019
  781   2HB   LEU  94           HB1      LEU  94  -3.852   0.852   5.043
  782    HG   LEU  94           HG       LEU  94  -5.177   0.071   3.071
  783   1HD1  LEU  94          HD13      LEU  94  -4.264   2.529   1.992
  784   2HD1  LEU  94          HD12      LEU  94  -3.525   1.246   1.034
  785   3HD1  LEU  94          HD11      LEU  94  -5.278   1.321   1.205
  786   1HD2  LEU  94          HD21      LEU  94  -2.252  -0.051   3.374
  787   2HD2  LEU  94          HD23      LEU  94  -3.412  -1.358   3.136
  788   3HD2  LEU  94          HD22      LEU  94  -2.814  -0.444   1.750
  789    CH2  TRP  95           CH2      TRP  95  -6.987   2.242  13.657
  790    H    TRP  95           HN       TRP  95  -4.693   1.954   6.890
  791    HA   TRP  95           HA       TRP  95  -7.129   0.353   7.357
  792   1HB   TRP  95           HB2      TRP  95  -6.033  -0.564   9.128
  793   2HB   TRP  95           HB1      TRP  95  -4.615   0.044   8.274
  794    HD1  TRP  95           HD1      TRP  95  -3.345   2.049   9.272
  795    HE1  TRP  95           HE1      TRP  95  -3.467   3.296  11.534
  796    HE3  TRP  95           HE3      TRP  95  -7.745   0.205  11.028
  797    HZ2  TRP  95           HZ2      TRP  95  -5.226   3.475  13.794
  798    HZ3  TRP  95           HZ3      TRP  95  -8.632   0.917  13.232
  799    HH2  TRP  95           HH2      TRP  95  -7.378   2.549  14.615
  800    H    GLY  96           HN       GLY  96  -5.982   3.570   7.950
  801   1HA   GLY  96           HA2      GLY  96  -7.440   4.319  10.239
  802   2HA   GLY  96           HA1      GLY  96  -7.117   5.416   8.898
  803    H    LEU  97           HN       LEU  97  -8.535   4.270   6.843
  804    HA   LEU  97           HA       LEU  97 -11.287   4.925   7.588
  805   1HB   LEU  97           HB2      LEU  97 -10.173   5.473   5.353
  806   2HB   LEU  97           HB1      LEU  97 -10.329   3.761   4.962
  807    HG   LEU  97           HG       LEU  97 -12.854   4.459   5.911
  808   1HD1  LEU  97          HD13      LEU  97 -11.809   6.870   5.534
  809   2HD1  LEU  97          HD12      LEU  97 -12.190   6.524   3.847
  810   3HD1  LEU  97          HD11      LEU  97 -13.471   6.526   5.058
  811   1HD2  LEU  97          HD21      LEU  97 -11.571   3.898   3.278
  812   2HD2  LEU  97          HD23      LEU  97 -12.880   3.043   4.093
  813   3HD2  LEU  97          HD22      LEU  97 -13.208   4.554   3.243
  814    H    ALA  98           HN       ALA  98  -9.372   2.038   7.298
  815    HA   ALA  98           HA       ALA  98 -11.339   0.109   6.703
  816   1HB   ALA  98           HB3      ALA  98  -8.898  -0.361   6.845
  817   2HB   ALA  98           HB2      ALA  98  -8.978  -0.167   8.595
  818   3HB   ALA  98           HB1      ALA  98  -9.840  -1.492   7.815
  819    H    GLY  99           HN       GLY  99 -10.070   0.739   9.988
  820   1HA   GLY  99           HA2      GLY  99 -11.991   1.472  11.599
  821   2HA   GLY  99           HA1      GLY  99 -12.768  -0.005  11.037
  822    H    LEU 100           HN       LEU 100 -10.754  -1.856  11.051
  823    HA   LEU 100           HA       LEU 100 -10.226  -2.105  13.950
  824   1HB   LEU 100           HB2      LEU 100  -9.592  -4.115  11.777
  825   2HB   LEU 100           HB1      LEU 100  -9.767  -4.417  13.507
  826    HG   LEU 100           HG       LEU 100 -12.169  -3.249  12.940
  827   1HD1  LEU 100          HD12      LEU 100 -11.053  -4.389  10.442
  828   2HD1  LEU 100          HD11      LEU 100 -12.710  -4.859  10.820
  829   3HD1  LEU 100          HD13      LEU 100 -12.292  -3.154  10.663
  830   1HD2  LEU 100          HD23      LEU 100 -11.437  -5.525  14.048
  831   2HD2  LEU 100          HD22      LEU 100 -13.069  -5.357  13.398
  832   3HD2  LEU 100          HD21      LEU 100 -11.829  -6.198  12.465
  833    H    ASN 101           HN       ASN 101  -8.176  -2.085  14.850
  834    HA   ASN 101           HA       ASN 101  -6.062  -0.846  13.292
  835   1HB   ASN 101           HB2      ASN 101  -6.603  -1.444  16.092
  836   2HB   ASN 101           HB1      ASN 101  -4.921  -1.765  15.667
  837   1HD2  ASN 101          HD22      ASN 101  -6.059   2.026  16.157
  838   2HD2  ASN 101          HD21      ASN 101  -6.951   0.690  16.705
  839    H    SER 102           HN       SER 102  -5.620  -3.718  15.351
  840    HA   SER 102           HA       SER 102  -3.618  -4.751  13.488
  841   1HB   SER 102           HB2      SER 102  -3.180  -6.401  15.146
  842   2HB   SER 102           HB1      SER 102  -3.561  -4.934  16.043
  843    HG   SER 102           HG       SER 102  -5.522  -5.738  16.538
  844    H    CYS 103           HN       CYS 103  -3.807  -6.581  12.178
  845    HA   CYS 103           HA       CYS 103  -6.396  -8.022  12.182
  846   1HB   CYS 103           HB2      CYS 103  -6.201  -7.865   9.558
  847   2HB   CYS 103           HB1      CYS 103  -6.937  -6.541  10.460
  848    HA   PRO 104           HA       PRO 104  -3.860 -11.549  11.613
  849   1HB   PRO 104           HB2      PRO 104  -5.608 -12.875   9.768
  850   2HB   PRO 104           HB1      PRO 104  -5.478 -13.132  11.514
  851   1HG   PRO 104           HG2      PRO 104  -7.626 -11.848  10.077
  852   2HG   PRO 104           HG1      PRO 104  -7.490 -12.112  11.822
  853   1HD   PRO 104           HD2      PRO 104  -7.205  -9.625  10.377
  854   2HD   PRO 104           HD1      PRO 104  -7.101  -9.891  12.129
  855    H    VAL 105           HN       VAL 105  -2.057 -10.916  10.387
  856    HA   VAL 105           HA       VAL 105  -2.400 -10.817   7.422
  857    HB   VAL 105           HB       VAL 105  -0.158  -9.681   7.442
  858   1HG1  VAL 105          HG12      VAL 105  -2.655  -8.649   8.638
  859   2HG1  VAL 105          HG11      VAL 105  -1.217  -7.697   9.008
  860   3HG1  VAL 105          HG13      VAL 105  -1.675  -7.989   7.330
  861   1HG2  VAL 105          HG23      VAL 105   0.397 -10.747   9.745
  862   2HG2  VAL 105          HG22      VAL 105   0.895  -9.076   9.477
  863   3HG2  VAL 105          HG21      VAL 105  -0.548  -9.424  10.429
  864    H    LYS 106           HN       LYS 106  -2.488 -13.347   8.198
  865    HA   LYS 106           HA       LYS 106   0.257 -14.374   7.620
  866   1HB   LYS 106           HB2      LYS 106  -1.689 -15.416   9.698
  867   2HB   LYS 106           HB1      LYS 106  -0.247 -16.287   9.173
  868   1HG   LYS 106           HG2      LYS 106   0.572 -13.635   9.770
  869   2HG   LYS 106           HG1      LYS 106  -0.449 -14.170  11.106
  870   1HD   LYS 106           HD2      LYS 106   0.973 -15.904  11.685
  871   2HD   LYS 106           HD1      LYS 106   1.600 -16.073  10.045
  872   1HE   LYS 106           HE2      LYS 106   2.145 -13.560  11.603
  873   2HE   LYS 106           HE1      LYS 106   3.127 -14.999  11.881
  874   1HZ   LYS 106           HZ2      LYS 106   3.266 -15.015   9.308
  875   2HZ   LYS 106           HZ1      LYS 106   2.866 -13.371   9.450
  876   3HZ   LYS 106           HZ3      LYS 106   4.266 -13.967  10.197
  877    H    GLU 107           HN       GLU 107  -1.752 -13.986   5.682
  878    HA   GLU 107           HA       GLU 107  -2.539 -16.818   5.115
  879   1HB   GLU 107           HB2      GLU 107  -4.399 -15.020   5.566
  880   2HB   GLU 107           HB1      GLU 107  -4.005 -14.469   3.937
  881   1HG   GLU 107           HG2      GLU 107  -5.520 -16.045   3.295
  882   2HG   GLU 107           HG1      GLU 107  -4.178 -17.164   3.539
  883    H    ALA 108           HN       ALA 108  -0.072 -16.106   4.387
  884    HA   ALA 108           HA       ALA 108  -0.090 -16.495   1.559
  885   1HB   ALA 108           HB2      ALA 108  -0.366 -13.784   2.346
  886   2HB   ALA 108           HB1      ALA 108   1.286 -13.981   1.764
  887   3HB   ALA 108           HB3      ALA 108  -0.071 -14.410   0.724
  888    H    ASP 109           HN       ASP 109   2.031 -16.905   0.794
  889    HA   ASP 109           HA       ASP 109   3.971 -17.421   2.965
  890   1HB   ASP 109           HB2      ASP 109   3.865 -18.255   0.055
  891   2HB   ASP 109           HB1      ASP 109   5.225 -18.625   1.118
  892    H    GLN 110           HN       GLN 110   4.735 -16.507  -0.392
  893    HA   GLN 110           HA       GLN 110   5.810 -13.918   0.456
  894   1HB   GLN 110           HB2      GLN 110   7.495 -16.127   0.693
  895   2HB   GLN 110           HB1      GLN 110   7.953 -15.406  -0.849
  896   1HG   GLN 110           HG2      GLN 110   8.757 -13.503   0.127
  897   2HG   GLN 110           HG1      GLN 110   7.518 -13.499   1.380
  898   1HE2  GLN 110          HE22      GLN 110   9.458 -15.382   3.685
  899   2HE2  GLN 110          HE21      GLN 110   7.908 -14.798   3.319
  900    H    SER 111           HN       SER 111   4.632 -12.946  -1.194
  901    HA   SER 111           HA       SER 111   5.158 -13.897  -3.978
  902   1HB   SER 111           HB2      SER 111   2.864 -12.600  -2.634
  903   2HB   SER 111           HB1      SER 111   3.247 -11.952  -4.226
  904    HG   SER 111           HG       SER 111   2.406 -13.690  -5.030
  905    H    THR 112           HN       THR 112   6.376 -12.600  -5.321
  906    HA   THR 112           HA       THR 112   8.016 -10.544  -4.380
  907    HB   THR 112           HB       THR 112   8.164  -9.829  -6.816
  908    HG1  THR 112           HG1      THR 112   5.872 -10.726  -7.053
  909   1HG2  THR 112          HG21      THR 112   8.568 -12.621  -5.802
  910   2HG2  THR 112          HG23      THR 112   8.881 -12.277  -7.505
  911   3HG2  THR 112          HG22      THR 112   9.771 -11.411  -6.251
  912    H    LEU 113           HN       LEU 113   7.831  -8.316  -4.186
  913    HA   LEU 113           HA       LEU 113   5.229  -7.221  -3.750
  914   1HB   LEU 113           HB2      LEU 113   7.413  -6.393  -2.758
  915   2HB   LEU 113           HB1      LEU 113   7.728  -5.619  -4.311
  916    HG   LEU 113           HG       LEU 113   5.028  -5.061  -3.425
  917   1HD1  LEU 113          HD12      LEU 113   7.273  -4.683  -1.481
  918   2HD1  LEU 113          HD11      LEU 113   6.048  -3.419  -1.602
  919   3HD1  LEU 113          HD13      LEU 113   5.578  -5.064  -1.174
  920   1HD2  LEU 113          HD22      LEU 113   7.497  -3.536  -4.221
  921   2HD2  LEU 113          HD21      LEU 113   5.949  -3.653  -5.058
  922   3HD2  LEU 113          HD23      LEU 113   6.088  -2.678  -3.595
  923    H    GLU 114           HN       GLU 114   6.952  -7.688  -6.696
  924    HA   GLU 114           HA       GLU 114   5.907  -5.413  -8.122
  925   1HB   GLU 114           HB2      GLU 114   7.693  -7.496  -8.662
  926   2HB   GLU 114           HB1      GLU 114   6.359  -7.754  -9.787
  927   1HG   GLU 114           HG2      GLU 114   6.653  -5.680 -10.822
  928   2HG   GLU 114           HG1      GLU 114   7.475  -4.990  -9.421
  929    H    ASN 115           HN       ASN 115   4.806  -8.769  -7.702
  930    HA   ASN 115           HA       ASN 115   2.425  -8.336  -9.356
  931   1HB   ASN 115           HB2      ASN 115   2.238 -10.590  -9.282
  932   2HB   ASN 115           HB1      ASN 115   3.810 -10.581  -8.481
  933   1HD2  ASN 115          HD22      ASN 115   0.566 -11.740  -6.408
  934   2HD2  ASN 115          HD21      ASN 115   0.541 -11.484  -8.085
  935    H    PHE 116           HN       PHE 116   3.283  -7.780  -6.041
  936    HA   PHE 116           HA       PHE 116   0.552  -7.951  -5.019
  937   1HB   PHE 116           HB2      PHE 116   2.162  -8.273  -3.336
  938   2HB   PHE 116           HB1      PHE 116   3.184  -6.966  -3.934
  939    HD1  PHE 116           HD1      PHE 116  -0.426  -7.288  -2.932
  940    HD2  PHE 116           HD2      PHE 116   3.271  -5.148  -2.492
  941    HE1  PHE 116           HE1      PHE 116  -1.525  -5.713  -1.360
  942    HE2  PHE 116           HE2      PHE 116   2.175  -3.573  -0.925
  943    HZ   PHE 116           HZ       PHE 116  -0.222  -3.853  -0.356
  944    H    LEU 117           HN       LEU 117   2.715  -5.428  -6.212
  945    HA   LEU 117           HA       LEU 117   0.906  -3.241  -5.588
  946   1HB   LEU 117           HB2      LEU 117   3.559  -3.547  -6.665
  947   2HB   LEU 117           HB1      LEU 117   2.613  -2.518  -7.742
  948    HG   LEU 117           HG       LEU 117   3.721  -1.181  -5.995
  949   1HD1  LEU 117          HD11      LEU 117   0.958  -1.186  -6.639
  950   2HD1  LEU 117          HD13      LEU 117   1.081  -0.831  -4.916
  951   3HD1  LEU 117          HD12      LEU 117   1.934   0.175  -6.087
  952   1HD2  LEU 117          HD22      LEU 117   2.740  -3.349  -4.324
  953   2HD2  LEU 117          HD21      LEU 117   3.945  -2.118  -3.952
  954   3HD2  LEU 117          HD23      LEU 117   2.234  -1.783  -3.690
  955    H    GLU 118           HN       GLU 118   1.522  -5.349  -8.350
  956    HA   GLU 118           HA       GLU 118  -0.078  -3.934 -10.256
  957   1HB   GLU 118           HB2      GLU 118   1.131  -5.576 -11.330
  958   2HB   GLU 118           HB1      GLU 118   1.007  -6.696  -9.974
  959   1HG   GLU 118           HG2      GLU 118  -1.124  -7.434 -10.612
  960   2HG   GLU 118           HG1      GLU 118  -1.437  -5.995 -11.585
  961    NH1  ARG 119           NH2      ARG 119  -5.691 -11.904  -7.994
  962    NH2  ARG 119           NH1      ARG 119  -4.126 -13.423  -8.581
  963    H    ARG 119           HN       ARG 119  -0.845  -6.642  -8.081
  964    HA   ARG 119           HA       ARG 119  -3.665  -6.698  -8.705
  965   1HB   ARG 119           HB2      ARG 119  -2.053  -7.731  -6.353
  966   2HB   ARG 119           HB1      ARG 119  -3.788  -7.996  -6.520
  967   1HG   ARG 119           HG2      ARG 119  -2.267  -8.642  -8.948
  968   2HG   ARG 119           HG1      ARG 119  -1.836  -9.639  -7.558
  969   1HD   ARG 119           HD2      ARG 119  -4.476  -9.753  -7.262
  970   2HD   ARG 119           HD1      ARG 119  -4.451  -9.416  -8.993
  971    HE   ARG 119           HE       ARG 119  -2.631 -11.480  -8.695
  972   1HH1  ARG 119          HH21      ARG 119  -5.966 -10.963  -7.805
  973   2HH1  ARG 119          HH22      ARG 119  -6.363 -12.640  -7.922
  974   1HH2  ARG 119          HH11      ARG 119  -3.187 -13.648  -8.843
  975   2HH2  ARG 119          HH12      ARG 119  -4.811 -14.148  -8.506
  976    H    LEU 120           HN       LEU 120  -1.748  -4.573  -6.740
  977    HA   LEU 120           HA       LEU 120  -3.881  -3.860  -4.900
  978   1HB   LEU 120           HB2      LEU 120  -1.129  -3.331  -5.115
  979   2HB   LEU 120           HB1      LEU 120  -1.915  -1.762  -5.294
  980    HG   LEU 120           HG       LEU 120  -2.602  -3.710  -3.079
  981   1HD1  LEU 120          HD11      LEU 120  -0.236  -2.996  -2.906
  982   2HD1  LEU 120          HD13      LEU 120  -0.744  -1.312  -3.001
  983   3HD1  LEU 120          HD12      LEU 120  -1.216  -2.297  -1.618
  984   1HD2  LEU 120          HD22      LEU 120  -3.933  -1.483  -4.046
  985   2HD2  LEU 120          HD21      LEU 120  -4.114  -2.150  -2.423
  986   3HD2  LEU 120          HD23      LEU 120  -2.989  -0.822  -2.711
  987    H    LYS 121           HN       LYS 121  -2.519  -2.362  -7.843
  988    HA   LYS 121           HA       LYS 121  -4.336  -0.129  -7.893
  989   1HB   LYS 121           HB2      LYS 121  -2.096  -0.675  -9.252
  990   2HB   LYS 121           HB1      LYS 121  -3.262  -1.266 -10.435
  991   1HG   LYS 121           HG2      LYS 121  -4.417   1.099  -9.745
  992   2HG   LYS 121           HG1      LYS 121  -2.710   1.507  -9.557
  993   1HD   LYS 121           HD2      LYS 121  -3.088   1.975 -11.823
  994   2HD   LYS 121           HD1      LYS 121  -2.432   0.339 -11.877
  995   1HE   LYS 121           HE2      LYS 121  -5.213   0.047 -11.480
  996   2HE   LYS 121           HE1      LYS 121  -5.026   1.274 -12.732
  997   1HZ   LYS 121           HZ2      LYS 121  -3.208  -0.537 -13.484
  998   2HZ   LYS 121           HZ1      LYS 121  -4.389  -1.547 -12.797
  999   3HZ   LYS 121           HZ3      LYS 121  -4.805  -0.498 -14.064
 1000    H    THR 122           HN       THR 122  -4.462  -3.391  -9.163
 1001    HA   THR 122           HA       THR 122  -6.786  -2.971 -10.820
 1002    HB   THR 122           HB       THR 122  -6.771  -5.677  -9.984
 1003    HG1  THR 122           HG1      THR 122  -4.323  -5.688 -10.778
 1004   1HG2  THR 122          HG22      THR 122  -7.118  -4.595 -12.271
 1005   2HG2  THR 122          HG21      THR 122  -5.361  -4.510 -12.389
 1006   3HG2  THR 122          HG23      THR 122  -6.160  -6.076 -12.260
 1007    H    ILE 123           HN       ILE 123  -6.394  -4.319  -7.560
 1008    HA   ILE 123           HA       ILE 123  -9.121  -4.843  -7.029
 1009    HB   ILE 123           HB       ILE 123  -6.843  -4.066  -5.198
 1010   1HG1  ILE 123          HG12      ILE 123  -7.106  -6.322  -6.590
 1011   2HG1  ILE 123          HG11      ILE 123  -6.519  -6.346  -4.926
 1012   1HG2  ILE 123          HG21      ILE 123  -9.711  -4.795  -4.588
 1013   2HG2  ILE 123          HG23      ILE 123  -8.418  -5.079  -3.424
 1014   3HG2  ILE 123          HG22      ILE 123  -8.769  -3.439  -3.966
 1015   1HD1  ILE 123          HD13      ILE 123  -9.465  -6.551  -5.530
 1016   2HD1  ILE 123          HD12      ILE 123  -8.432  -7.981  -5.556
 1017   3HD1  ILE 123          HD11      ILE 123  -8.604  -7.043  -4.073
 1018    H    MET 124           HN       MET 124  -7.239  -1.855  -6.549
 1019    HA   MET 124           HA       MET 124  -9.307  -0.350  -5.296
 1020   1HB   MET 124           HB2      MET 124  -7.117   0.641  -7.148
 1021   2HB   MET 124           HB1      MET 124  -8.088   1.652  -6.078
 1022   1HG   MET 124           HG2      MET 124  -6.473  -0.678  -5.037
 1023   2HG   MET 124           HG1      MET 124  -5.785   0.937  -5.196
 1024   1HE   MET 124           HE3      MET 124  -5.396   2.061  -3.567
 1025   2HE   MET 124           HE2      MET 124  -6.775   3.150  -3.446
 1026   3HE   MET 124           HE1      MET 124  -6.222   2.281  -2.018
 1027    NH1  ARG 125           NH2      ARG 125  -9.201   0.505 -15.973
 1028    NH2  ARG 125           NH1      ARG 125  -8.066   2.448 -16.145
 1029    H    ARG 125           HN       ARG 125  -8.371  -0.426  -8.745
 1030    HA   ARG 125           HA       ARG 125 -10.629   1.111  -9.615
 1031   1HB   ARG 125           HB2      ARG 125  -8.324   0.078 -10.787
 1032   2HB   ARG 125           HB1      ARG 125  -9.636  -0.765 -11.613
 1033   1HG   ARG 125           HG2      ARG 125 -10.585   1.821 -11.491
 1034   2HG   ARG 125           HG1      ARG 125  -8.857   2.064 -11.751
 1035   1HD   ARG 125           HD2      ARG 125  -9.491  -0.031 -13.467
 1036   2HD   ARG 125           HD1      ARG 125 -10.878   1.050 -13.598
 1037    HE   ARG 125           HE       ARG 125  -8.698   2.745 -13.791
 1038   1HH1  ARG 125          HH21      ARG 125  -9.740  -0.148 -15.443
 1039   2HH1  ARG 125          HH22      ARG 125  -8.990   0.308 -16.931
 1040   1HH2  ARG 125          HH11      ARG 125  -7.730   3.299 -15.740
 1041   2HH2  ARG 125          HH12      ARG 125  -7.861   2.235 -17.101
 1042    H    GLU 126           HN       GLU 126 -10.537  -2.119  -8.486
 1043    HA   GLU 126           HA       GLU 126 -12.665  -3.095 -10.236
 1044   1HB   GLU 126           HB2      GLU 126 -10.946  -4.200  -8.129
 1045   2HB   GLU 126           HB1      GLU 126 -12.596  -4.823  -8.092
 1046   1HG   GLU 126           HG2      GLU 126 -12.379  -5.236 -10.589
 1047   2HG   GLU 126           HG1      GLU 126 -10.660  -4.882 -10.416
 1048    H    LYS 127           HN       LYS 127 -12.529  -2.514  -6.685
 1049    HA   LYS 127           HA       LYS 127 -15.483  -2.459  -6.649
 1050   1HB   LYS 127           HB2      LYS 127 -13.323  -2.646  -4.603
 1051   2HB   LYS 127           HB1      LYS 127 -14.870  -1.964  -4.100
 1052   1HG   LYS 127           HG2      LYS 127 -15.234  -4.235  -3.723
 1053   2HG   LYS 127           HG1      LYS 127 -15.870  -4.049  -5.359
 1054   1HD   LYS 127           HD2      LYS 127 -13.451  -4.609  -6.126
 1055   2HD   LYS 127           HD1      LYS 127 -13.240  -5.233  -4.488
 1056   1HE   LYS 127           HE2      LYS 127 -15.594  -6.067  -6.179
 1057   2HE   LYS 127           HE1      LYS 127 -14.041  -6.894  -6.305
 1058   1HZ   LYS 127           HZ3      LYS 127 -14.116  -7.318  -3.928
 1059   2HZ   LYS 127           HZ2      LYS 127 -15.615  -6.527  -3.813
 1060   3HZ   LYS 127           HZ1      LYS 127 -15.478  -7.973  -4.697
 1061    OH   TYR 128           OH       TYR 128  -9.769   1.423  -1.696
 1062    H    TYR 128           HN       TYR 128 -13.082  -0.124  -7.136
 1063    HA   TYR 128           HA       TYR 128 -14.531   1.994  -5.673
 1064   1HB   TYR 128           HB2      TYR 128 -12.029   2.055  -7.380
 1065   2HB   TYR 128           HB1      TYR 128 -12.740   3.480  -6.649
 1066    HD1  TYR 128           HD1      TYR 128 -12.256  -0.004  -5.218
 1067    HD2  TYR 128           HD2      TYR 128 -11.310   4.181  -4.974
 1068    HE1  TYR 128           HE1      TYR 128 -11.022  -0.409  -3.126
 1069    HE2  TYR 128           HE2      TYR 128 -10.064   3.763  -2.877
 1070    HH   TYR 128           HH       TYR 128  -9.803   2.224  -1.169
 1071    H    SER 129           HN       SER 129 -15.248   0.453  -8.447
 1072    HA   SER 129           HA       SER 129 -15.541   2.699 -10.275
 1073   1HB   SER 129           HB2      SER 129 -16.141   1.117 -11.804
 1074   2HB   SER 129           HB1      SER 129 -15.503  -0.006 -10.606
 1075    HG   SER 129           HG       SER 129 -17.639  -0.138  -9.754
 1076    H    LYS 130           HN       LYS 130 -17.469   1.308  -7.728
 1077    HA   LYS 130           HA       LYS 130 -20.037   2.237  -8.595
 1078   1HB   LYS 130           HB2      LYS 130 -19.145   0.694  -6.531
 1079   2HB   LYS 130           HB1      LYS 130 -19.531   2.194  -5.685
 1080   1HG   LYS 130           HG2      LYS 130 -21.689   1.908  -7.377
 1081   2HG   LYS 130           HG1      LYS 130 -21.331   0.236  -6.942
 1082   1HD   LYS 130           HD2      LYS 130 -21.193   2.048  -4.646
 1083   2HD   LYS 130           HD1      LYS 130 -22.786   2.023  -5.400
 1084   1HE   LYS 130           HE2      LYS 130 -22.782   0.267  -3.769
 1085   2HE   LYS 130           HE1      LYS 130 -22.645  -0.515  -5.343
 1086   1HZ   LYS 130           HZ2      LYS 130 -20.070   0.106  -4.477
 1087   2HZ   LYS 130           HZ1      LYS 130 -20.869  -0.634  -3.174
 1088   3HZ   LYS 130           HZ3      LYS 130 -20.765  -1.432  -4.666
 1089    H    CYS 131           HN       CYS 131 -17.300   3.991  -7.437
 1090    HA   CYS 131           HA       CYS 131 -19.058   6.280  -6.676
 1091   1HB   CYS 131           HB2      CYS 131 -16.103   5.853  -6.146
 1092   2HB   CYS 131           HB1      CYS 131 -17.068   7.210  -5.566
 1093    H    SER 132           HN       SER 132 -15.808   5.962  -8.157
 1094    HA   SER 132           HA       SER 132 -15.845   8.394  -9.562
 1095   1HB   SER 132           HB2      SER 132 -13.815   7.063  -9.396
 1096   2HB   SER 132           HB1      SER 132 -14.551   5.761 -10.327
 1097    HG   SER 132           HG       SER 132 -13.403   8.101 -11.156
 1098    H    SER 133           HN       SER 133 -16.278   8.847 -11.836
 1099    HA   SER 133           HA       SER 133 -17.939   6.889 -13.302
 1100   1HB   SER 133           HB2      SER 133 -19.314   8.536 -11.713
 1101   2HB   SER 133           HB1      SER 133 -19.075   9.645 -13.059
 1102    HG   SER 133           HG       SER 133 -20.480   8.540 -14.157
   
  Start of MODEL          15
 Raw file had 1102 H/Q atoms
  Start of MODEL   15
    1   1H    GLU   1           HT3      GLU   1 -16.394  15.312  11.023
    2   2H    GLU   1           HT2      GLU   1 -17.677  15.414   9.917
    3   3H    GLU   1           HT1      GLU   1 -16.257  16.311   9.660
    4    HA   GLU   1           HA       GLU   1 -16.757  17.870  11.236
    5   1HB   GLU   1           HB2      GLU   1 -18.843  17.095   9.488
    6   2HB   GLU   1           HB1      GLU   1 -19.603  17.429  11.044
    7   1HG   GLU   1           HG2      GLU   1 -18.395  19.610  11.126
    8   2HG   GLU   1           HG1      GLU   1 -17.756  19.282   9.514
    9    H    ALA   2           HN       ALA   2 -19.376  15.509  11.850
   10    HA   ALA   2           HA       ALA   2 -18.467  15.276  14.656
   11   1HB   ALA   2           HB2      ALA   2 -21.060  16.532  13.776
   12   2HB   ALA   2           HB1      ALA   2 -20.956  15.690  15.324
   13   3HB   ALA   2           HB3      ALA   2 -19.926  17.084  15.008
   14    H    GLU   3           HN       GLU   3 -21.069  14.401  12.351
   15    HA   GLU   3           HA       GLU   3 -20.705  11.572  13.202
   16   1HB   GLU   3           HB2      GLU   3 -23.176  11.265  13.238
   17   2HB   GLU   3           HB1      GLU   3 -22.628  12.389  14.481
   18   1HG   GLU   3           HG2      GLU   3 -23.977  13.977  13.636
   19   2HG   GLU   3           HG1      GLU   3 -23.104  13.893  12.104
   20    H    ALA   4           HN       ALA   4 -19.543  11.767  11.021
   21    HA   ALA   4           HA       ALA   4 -21.374  10.827   8.934
   22   1HB   ALA   4           HB1      ALA   4 -21.116  13.485   8.946
   23   2HB   ALA   4           HB3      ALA   4 -19.645  13.092   8.054
   24   3HB   ALA   4           HB2      ALA   4 -21.215  12.572   7.441
   25    H    HIS   5           HN       HIS   5 -19.719  10.913   6.738
   26    HA   HIS   5           HA       HIS   5 -17.022  10.039   7.495
   27   1HB   HIS   5           HB2      HIS   5 -17.917   7.897   5.907
   28   2HB   HIS   5           HB1      HIS   5 -17.525   7.841   7.626
   29    HD1  HIS   5           HD1      HIS   5 -19.487   7.959   9.314
   30    HD2  HIS   5           HD2      HIS   5 -20.712   8.019   5.330
   31    HE1  HIS   5           HE1      HIS   5 -21.992   7.599   9.332
   32    H    LYS   6           HN       LYS   6 -15.631  10.394   5.789
   33    HA   LYS   6           HA       LYS   6 -16.881  11.338   3.261
   34   1HB   LYS   6           HB2      LYS   6 -14.421  11.979   4.741
   35   2HB   LYS   6           HB1      LYS   6 -14.179  11.797   3.003
   36   1HG   LYS   6           HG2      LYS   6 -14.753  14.088   3.315
   37   2HG   LYS   6           HG1      LYS   6 -16.223  13.320   2.715
   38   1HD   LYS   6           HD2      LYS   6 -15.903  13.263   5.653
   39   2HD   LYS   6           HD1      LYS   6 -16.120  14.872   4.964
   40   1HE   LYS   6           HE2      LYS   6 -17.975  13.198   3.638
   41   2HE   LYS   6           HE1      LYS   6 -18.085  12.790   5.350
   42   1HZ   LYS   6           HZ2      LYS   6 -17.938  15.622   4.675
   43   2HZ   LYS   6           HZ1      LYS   6 -19.384  14.821   4.289
   44   3HZ   LYS   6           HZ3      LYS   6 -18.828  14.838   5.890
   45    H    CYS   7           HN       CYS   7 -17.377   9.150   2.576
   46    HA   CYS   7           HA       CYS   7 -15.116   7.325   2.070
   47   1HB   CYS   7           HB2      CYS   7 -17.173   6.341   2.872
   48   2HB   CYS   7           HB1      CYS   7 -18.096   7.106   1.583
   49    H    ASP   8           HN       ASP   8 -16.851   9.764   0.324
   50    HA   ASP   8           HA       ASP   8 -16.201   8.582  -2.298
   51   1HB   ASP   8           HB2      ASP   8 -18.323   9.719  -2.127
   52   2HB   ASP   8           HB1      ASP   8 -17.543  11.176  -1.511
   53    H    ILE   9           HN       ILE   9 -15.105  11.309  -0.300
   54    HA   ILE   9           HA       ILE   9 -13.226  12.133  -2.420
   55    HB   ILE   9           HB       ILE   9 -13.309  13.236   0.380
   56   1HG1  ILE   9          HG12      ILE   9 -15.635  13.204  -0.478
   57   2HG1  ILE   9          HG11      ILE   9 -15.012  14.846  -0.370
   58   1HG2  ILE   9          HG21      ILE   9 -11.531  13.813  -1.405
   59   2HG2  ILE   9          HG23      ILE   9 -12.822  14.695  -2.217
   60   3HG2  ILE   9          HG22      ILE   9 -12.333  15.152  -0.586
   61   1HD1  ILE   9          HD11      ILE   9 -14.496  13.547  -2.963
   62   2HD1  ILE   9          HD13      ILE   9 -16.205  13.774  -2.598
   63   3HD1  ILE   9          HD12      ILE   9 -15.118  15.161  -2.614
   64    H    THR  10           HN       THR  10 -12.899  11.136   1.020
   65    HA   THR  10           HA       THR  10 -10.108  11.021   1.136
   66    HB   THR  10           HB       THR  10 -12.132   9.196   2.453
   67    HG1  THR  10           HG1      THR  10 -11.798  11.655   2.791
   68   1HG2  THR  10          HG23      THR  10  -9.201   9.178   2.439
   69   2HG2  THR  10          HG22      THR  10  -9.889   9.282   4.060
   70   3HG2  THR  10          HG21      THR  10 -10.329   7.943   2.999
   71    H    LEU  11           HN       LEU  11 -12.314   8.526  -0.143
   72    HA   LEU  11           HA       LEU  11 -10.189   6.603  -0.549
   73   1HB   LEU  11           HB2      LEU  11 -13.001   6.596  -0.700
   74   2HB   LEU  11           HB1      LEU  11 -12.439   6.200  -2.324
   75    HG   LEU  11           HG       LEU  11 -11.043   4.393  -1.440
   76   1HD1  LEU  11          HD12      LEU  11 -11.372   5.827   1.011
   77   2HD1  LEU  11          HD11      LEU  11 -12.031   4.206   1.238
   78   3HD1  LEU  11          HD13      LEU  11 -10.363   4.412   0.703
   79   1HD2  LEU  11          HD23      LEU  11 -13.734   4.312  -1.683
   80   2HD2  LEU  11          HD22      LEU  11 -12.777   2.909  -1.209
   81   3HD2  LEU  11          HD21      LEU  11 -13.583   3.883   0.021
   82    H    GLN  12           HN       GLN  12 -11.559   9.177  -2.539
   83    HA   GLN  12           HA       GLN  12 -10.432   8.295  -5.038
   84   1HB   GLN  12           HB2      GLN  12 -11.814  10.621  -4.030
   85   2HB   GLN  12           HB1      GLN  12 -10.417  11.136  -4.970
   86   1HG   GLN  12           HG2      GLN  12 -12.605   9.247  -5.889
   87   2HG   GLN  12           HG1      GLN  12 -12.347  10.898  -6.445
   88   1HE2  GLN  12          HE22      GLN  12  -9.052   9.663  -7.902
   89   2HE2  GLN  12          HE21      GLN  12  -9.395  10.680  -6.590
   90    H    GLU  13           HN       GLU  13  -9.288  10.735  -2.705
   91    HA   GLU  13           HA       GLU  13  -6.757  11.194  -3.912
   92   1HB   GLU  13           HB2      GLU  13  -8.028  11.685  -1.294
   93   2HB   GLU  13           HB1      GLU  13  -6.271  11.542  -1.233
   94   1HG   GLU  13           HG2      GLU  13  -6.474  13.798  -1.713
   95   2HG   GLU  13           HG1      GLU  13  -6.405  13.140  -3.349
   96    H    ILE  14           HN       ILE  14  -7.915   8.644  -1.786
   97    HA   ILE  14           HA       ILE  14  -5.360   7.579  -1.022
   98    HB   ILE  14           HB       ILE  14  -8.179   6.765  -0.876
   99   1HG1  ILE  14          HG12      ILE  14  -6.031   5.750   0.936
  100   2HG1  ILE  14          HG11      ILE  14  -6.323   7.491   0.905
  101   1HG2  ILE  14          HG22      ILE  14  -6.012   4.671  -1.266
  102   2HG2  ILE  14          HG21      ILE  14  -7.574   4.332  -0.520
  103   3HG2  ILE  14          HG23      ILE  14  -7.499   4.863  -2.198
  104   1HD1  ILE  14          HD13      ILE  14  -8.880   6.381   0.971
  105   2HD1  ILE  14          HD12      ILE  14  -7.950   5.369   2.073
  106   3HD1  ILE  14          HD11      ILE  14  -8.032   7.111   2.334
  107    H    ILE  15           HN       ILE  15  -7.492   6.986  -3.778
  108    HA   ILE  15           HA       ILE  15  -6.062   4.750  -4.840
  109    HB   ILE  15           HB       ILE  15  -8.170   6.607  -5.725
  110   1HG1  ILE  15          HG12      ILE  15  -8.054   3.851  -6.756
  111   2HG1  ILE  15          HG11      ILE  15  -7.949   3.951  -4.998
  112   1HG2  ILE  15          HG21      ILE  15  -6.258   5.326  -7.682
  113   2HG2  ILE  15          HG23      ILE  15  -7.903   5.791  -8.120
  114   3HG2  ILE  15          HG22      ILE  15  -6.750   7.017  -7.594
  115   1HD1  ILE  15          HD11      ILE  15  -9.961   5.782  -5.756
  116   2HD1  ILE  15          HD13      ILE  15 -10.253   4.320  -6.698
  117   3HD1  ILE  15          HD12      ILE  15 -10.177   4.235  -4.939
  118    H    LYS  16           HN       LYS  16  -5.919   8.231  -5.646
  119    HA   LYS  16           HA       LYS  16  -3.910   8.066  -7.628
  120   1HB   LYS  16           HB2      LYS  16  -4.851  10.169  -5.739
  121   2HB   LYS  16           HB1      LYS  16  -3.279  10.422  -6.494
  122   1HG   LYS  16           HG2      LYS  16  -4.228  10.938  -8.467
  123   2HG   LYS  16           HG1      LYS  16  -5.199   9.468  -8.442
  124   1HD   LYS  16           HD2      LYS  16  -6.985  10.834  -8.173
  125   2HD   LYS  16           HD1      LYS  16  -6.421  11.045  -6.517
  126   1HE   LYS  16           HE2      LYS  16  -5.985  13.214  -6.918
  127   2HE   LYS  16           HE1      LYS  16  -4.895  12.770  -8.232
  128   1HZ   LYS  16           HZ1      LYS  16  -7.847  12.995  -8.468
  129   2HZ   LYS  16           HZ3      LYS  16  -6.736  14.172  -8.979
  130   3HZ   LYS  16           HZ2      LYS  16  -6.761  12.646  -9.728
  131    H    THR  17           HN       THR  17  -3.633   8.218  -4.102
  132    HA   THR  17           HA       THR  17  -0.779   8.440  -4.010
  133    HB   THR  17           HB       THR  17  -2.543   7.069  -1.960
  134    HG1  THR  17           HG1      THR  17  -2.571   9.244  -1.060
  135   1HG2  THR  17          HG21      THR  17   0.134   8.460  -1.867
  136   2HG2  THR  17          HG23      THR  17  -0.791   8.063  -0.422
  137   3HG2  THR  17          HG22      THR  17  -0.211   6.777  -1.482
  138    H    LEU  18           HN       LEU  18  -2.956   5.641  -4.144
  139    HA   LEU  18           HA       LEU  18  -0.953   3.657  -3.735
  140   1HB   LEU  18           HB2      LEU  18  -3.514   3.353  -3.721
  141   2HB   LEU  18           HB1      LEU  18  -3.405   3.295  -5.474
  142    HG   LEU  18           HG       LEU  18  -3.400   1.039  -4.295
  143   1HD1  LEU  18          HD11      LEU  18  -2.166   1.861  -6.587
  144   2HD1  LEU  18          HD13      LEU  18  -0.826   1.113  -5.720
  145   3HD1  LEU  18          HD12      LEU  18  -2.279   0.181  -6.064
  146   1HD2  LEU  18          HD21      LEU  18  -1.702   2.036  -2.545
  147   2HD2  LEU  18          HD23      LEU  18  -1.603   0.339  -3.008
  148   3HD2  LEU  18          HD22      LEU  18  -0.499   1.517  -3.723
  149    H    ASN  19           HN       ASN  19  -1.985   5.468  -6.565
  150    HA   ASN  19           HA       ASN  19  -0.428   3.822  -8.415
  151   1HB   ASN  19           HB2      ASN  19  -2.415   4.933  -9.260
  152   2HB   ASN  19           HB1      ASN  19  -1.797   6.504  -8.751
  153   1HD2  ASN  19          HD22      ASN  19   0.075   6.950 -11.704
  154   2HD2  ASN  19          HD21      ASN  19  -0.577   7.639 -10.296
  155    H    SER  20           HN       SER  20   0.212   6.518  -6.326
  156    HA   SER  20           HA       SER  20   2.474   7.536  -7.863
  157   1HB   SER  20           HB2      SER  20   2.910   8.926  -5.911
  158   2HB   SER  20           HB1      SER  20   1.177   8.931  -6.236
  159    HG   SER  20           HG       SER  20   1.996   8.510  -3.985
  160    H    LEU  21           HN       LEU  21   1.998   5.138  -5.323
  161    HA   LEU  21           HA       LEU  21   4.794   4.882  -4.630
  162   1HB   LEU  21           HB2      LEU  21   2.533   2.873  -4.358
  163   2HB   LEU  21           HB1      LEU  21   4.125   2.725  -3.606
  164    HG   LEU  21           HG       LEU  21   2.648   5.270  -3.147
  165   1HD1  LEU  21          HD12      LEU  21   1.681   2.581  -2.336
  166   2HD1  LEU  21          HD11      LEU  21   1.713   3.806  -1.067
  167   3HD1  LEU  21          HD13      LEU  21   0.784   4.086  -2.541
  168   1HD2  LEU  21          HD22      LEU  21   4.987   4.430  -2.258
  169   2HD2  LEU  21          HD21      LEU  21   3.901   5.299  -1.175
  170   3HD2  LEU  21          HD23      LEU  21   4.004   3.541  -1.094
  171    H    THR  22           HN       THR  22   3.070   3.938  -7.452
  172    HA   THR  22           HA       THR  22   4.842   1.653  -7.996
  173    HB   THR  22           HB       THR  22   2.420   1.674  -8.673
  174    HG1  THR  22           HG1      THR  22   2.880   0.683 -10.617
  175   1HG2  THR  22          HG21      THR  22   3.156   4.168  -9.788
  176   2HG2  THR  22          HG23      THR  22   2.812   3.098 -11.146
  177   3HG2  THR  22          HG22      THR  22   1.592   3.362  -9.900
  178    H    GLU  23           HN       GLU  23   5.302   4.955  -8.227
  179    HA   GLU  23           HA       GLU  23   6.398   5.283 -10.834
  180   1HB   GLU  23           HB2      GLU  23   6.063   7.182  -9.287
  181   2HB   GLU  23           HB1      GLU  23   7.312   6.539  -8.221
  182   1HG   GLU  23           HG2      GLU  23   8.694   7.909  -9.413
  183   2HG   GLU  23           HG1      GLU  23   8.654   6.615 -10.610
  184    H    GLN  24           HN       GLN  24   7.737   3.977  -7.845
  185    HA   GLN  24           HA       GLN  24  10.189   3.128  -9.323
  186   1HB   GLN  24           HB2      GLN  24   9.624   3.936  -6.548
  187   2HB   GLN  24           HB1      GLN  24  10.568   2.453  -6.665
  188   1HG   GLN  24           HG2      GLN  24  11.389   4.647  -8.482
  189   2HG   GLN  24           HG1      GLN  24  11.681   4.919  -6.763
  190   1HE2  GLN  24          HE22      GLN  24  14.546   2.892  -6.854
  191   2HE2  GLN  24          HE21      GLN  24  13.765   4.264  -6.228
  192    H    LYS  25           HN       LYS  25   8.368   1.647 -10.264
  193    HA   LYS  25           HA       LYS  25   7.525  -0.574  -8.553
  194   1HB   LYS  25           HB2      LYS  25   6.174  -1.230 -10.350
  195   2HB   LYS  25           HB1      LYS  25   6.255   0.522 -10.555
  196   1HG   LYS  25           HG2      LYS  25   8.402  -0.050 -11.985
  197   2HG   LYS  25           HG1      LYS  25   7.639  -1.632 -12.120
  198   1HD   LYS  25           HD2      LYS  25   5.704   0.479 -12.579
  199   2HD   LYS  25           HD1      LYS  25   7.079   0.640 -13.673
  200   1HE   LYS  25           HE2      LYS  25   5.231  -0.851 -14.536
  201   2HE   LYS  25           HE1      LYS  25   6.816  -1.624 -14.455
  202   1HZ   LYS  25           HZ2      LYS  25   5.196  -1.816 -12.057
  203   2HZ   LYS  25           HZ1      LYS  25   4.608  -2.673 -13.402
  204   3HZ   LYS  25           HZ3      LYS  25   6.167  -2.986 -12.815
  205    H    THR  26           HN       THR  26  10.526  -0.102  -9.576
  206    HA   THR  26           HA       THR  26  10.842  -2.983 -10.292
  207    HB   THR  26           HB       THR  26  12.810  -2.138 -11.765
  208    HG1  THR  26           HG1      THR  26  11.180   0.133 -11.998
  209   1HG2  THR  26          HG23      THR  26  10.024  -2.580 -12.245
  210   2HG2  THR  26          HG22      THR  26  10.576  -1.285 -13.309
  211   3HG2  THR  26          HG21      THR  26  11.380  -2.854 -13.338
  212    H    LEU  27           HN       LEU  27  12.999  -0.195  -9.679
  213    HA   LEU  27           HA       LEU  27  15.004  -1.773  -8.412
  214   1HB   LEU  27           HB2      LEU  27  14.798   0.839  -9.232
  215   2HB   LEU  27           HB1      LEU  27  14.807   1.009  -7.477
  216    HG   LEU  27           HG       LEU  27  16.836  -0.622  -9.026
  217   1HD1  LEU  27          HD11      LEU  27  16.620   2.138  -8.991
  218   2HD1  LEU  27          HD13      LEU  27  17.748   1.813  -7.674
  219   3HD1  LEU  27          HD12      LEU  27  18.101   1.234  -9.302
  220   1HD2  LEU  27          HD21      LEU  27  16.338   0.037  -6.149
  221   2HD2  LEU  27          HD23      LEU  27  16.915  -1.467  -6.867
  222   3HD2  LEU  27          HD22      LEU  27  18.010  -0.097  -6.690
  223    H    CYS  28           HN       CYS  28  12.490   0.294  -6.870
  224    HA   CYS  28           HA       CYS  28  13.284  -0.718  -4.244
  225   1HB   CYS  28           HB2      CYS  28  11.989   1.561  -5.069
  226   2HB   CYS  28           HB1      CYS  28  10.669   0.603  -4.397
  227    H    THR  29           HN       THR  29  11.328  -1.989  -6.712
  228    HA   THR  29           HA       THR  29   9.515  -3.358  -4.821
  229    HB   THR  29           HB       THR  29   8.576  -4.388  -6.897
  230    HG1  THR  29           HG1      THR  29  10.413  -4.359  -8.178
  231   1HG2  THR  29          HG21      THR  29   7.834  -2.175  -5.937
  232   2HG2  THR  29          HG23      THR  29   8.895  -1.389  -7.105
  233   3HG2  THR  29          HG22      THR  29   7.532  -2.358  -7.665
  234    H    GLU  30           HN       GLU  30  12.647  -3.785  -5.498
  235    HA   GLU  30           HA       GLU  30  12.711  -6.631  -6.110
  236   1HB   GLU  30           HB2      GLU  30  15.113  -6.392  -5.822
  237   2HB   GLU  30           HB1      GLU  30  14.520  -4.995  -6.725
  238   1HG   GLU  30           HG2      GLU  30  14.413  -3.700  -4.605
  239   2HG   GLU  30           HG1      GLU  30  15.090  -5.079  -3.745
  240    H    LEU  31           HN       LEU  31  11.841  -4.970  -3.340
  241    HA   LEU  31           HA       LEU  31  13.084  -6.889  -1.473
  242   1HB   LEU  31           HB2      LEU  31  11.282  -4.558  -0.776
  243   2HB   LEU  31           HB1      LEU  31  12.421  -5.398   0.276
  244    HG   LEU  31           HG       LEU  31  13.910  -4.482  -1.961
  245   1HD1  LEU  31          HD13      LEU  31  11.653  -2.815  -1.578
  246   2HD1  LEU  31          HD12      LEU  31  13.016  -1.965  -0.856
  247   3HD1  LEU  31          HD11      LEU  31  13.084  -2.467  -2.544
  248   1HD2  LEU  31          HD22      LEU  31  13.715  -3.946   0.974
  249   2HD2  LEU  31          HD21      LEU  31  15.070  -4.570   0.034
  250   3HD2  LEU  31          HD23      LEU  31  14.694  -2.848  -0.001
  251    H    THR  32           HN       THR  32  11.839  -8.659  -2.192
  252    HA   THR  32           HA       THR  32   9.190  -9.086  -2.637
  253    HB   THR  32           HB       THR  32   9.489 -11.292  -1.327
  254    HG1  THR  32           HG1      THR  32  11.075 -10.637   0.090
  255   1HG2  THR  32          HG22      THR  32  10.912 -10.258  -3.703
  256   2HG2  THR  32          HG21      THR  32  11.591 -11.732  -3.011
  257   3HG2  THR  32          HG23      THR  32   9.905 -11.697  -3.530
  258    H    VAL  33           HN       VAL  33   7.273  -9.304  -1.475
  259    HA   VAL  33           HA       VAL  33   7.322  -8.712   1.450
  260    HB   VAL  33           HB       VAL  33   5.365  -7.246   1.166
  261   1HG1  VAL  33          HG11      VAL  33   7.943  -6.678  -0.171
  262   2HG1  VAL  33          HG13      VAL  33   6.619  -5.585  -0.564
  263   3HG1  VAL  33          HG12      VAL  33   7.121  -5.801   1.113
  264   1HG2  VAL  33          HG23      VAL  33   5.736  -7.917  -1.764
  265   2HG2  VAL  33          HG22      VAL  33   4.317  -8.234  -0.767
  266   3HG2  VAL  33          HG21      VAL  33   4.741  -6.577  -1.197
  267    H    THR  34           HN       THR  34   4.304  -8.825   1.425
  268    HA   THR  34           HA       THR  34   4.067 -11.765   0.965
  269    HB   THR  34           HB       THR  34   3.403 -10.070   3.215
  270    HG1  THR  34           HG1      THR  34   3.764 -11.920   4.163
  271   1HG2  THR  34          HG22      THR  34   1.133 -11.704   2.037
  272   2HG2  THR  34          HG21      THR  34   1.153 -11.054   3.671
  273   3HG2  THR  34          HG23      THR  34   1.150  -9.958   2.291
  274    H    ASP  35           HN       ASP  35   2.348 -12.522  -0.221
  275    HA   ASP  35           HA       ASP  35   0.732 -10.501  -1.669
  276   1HB   ASP  35           HB2      ASP  35   1.892 -12.847  -2.512
  277   2HB   ASP  35           HB1      ASP  35   0.248 -13.380  -2.167
  278    H    ILE  36           HN       ILE  36  -1.576 -10.426  -1.390
  279    HA   ILE  36           HA       ILE  36  -2.621 -12.226   0.753
  280    HB   ILE  36           HB       ILE  36  -3.623 -10.440   1.917
  281   1HG1  ILE  36          HG12      ILE  36  -2.956  -8.652  -0.450
  282   2HG1  ILE  36          HG11      ILE  36  -4.565  -9.258  -0.067
  283   1HG2  ILE  36          HG22      ILE  36  -1.075 -10.580   1.992
  284   2HG2  ILE  36          HG21      ILE  36  -1.059  -9.211   0.881
  285   3HG2  ILE  36          HG23      ILE  36  -1.770  -9.034   2.485
  286   1HD1  ILE  36          HD11      ILE  36  -2.895  -7.552   1.794
  287   2HD1  ILE  36          HD13      ILE  36  -4.204  -6.946   0.778
  288   3HD1  ILE  36          HD12      ILE  36  -4.549  -8.096   2.070
  289    H    PHE  37           HN       PHE  37  -2.910 -12.110  -2.285
  290    HA   PHE  37           HA       PHE  37  -5.900 -11.974  -2.310
  291   1HB   PHE  37           HB2      PHE  37  -4.190 -11.694  -4.778
  292   2HB   PHE  37           HB1      PHE  37  -5.869 -11.208  -4.541
  293    HD1  PHE  37           HD2      PHE  37  -6.066  -9.600  -2.273
  294    HD2  PHE  37           HD1      PHE  37  -2.717  -9.906  -4.942
  295    HE1  PHE  37           HE2      PHE  37  -5.318  -7.335  -1.594
  296    HE2  PHE  37           HE1      PHE  37  -1.972  -7.641  -4.266
  297    HZ   PHE  37           HZ       PHE  37  -3.271  -6.353  -2.592
  298    H    ALA  38           HN       ALA  38  -3.817 -14.250  -1.830
  299    HA   ALA  38           HA       ALA  38  -4.316 -16.042  -4.102
  300   1HB   ALA  38           HB1      ALA  38  -2.257 -15.930  -2.404
  301   2HB   ALA  38           HB3      ALA  38  -3.267 -17.052  -1.493
  302   3HB   ALA  38           HB2      ALA  38  -2.762 -17.455  -3.134
  303    H    ALA  39           HN       ALA  39  -5.790 -15.340  -1.019
  304    HA   ALA  39           HA       ALA  39  -7.662 -17.616  -1.498
  305   1HB   ALA  39           HB2      ALA  39  -5.889 -17.526   0.595
  306   2HB   ALA  39           HB1      ALA  39  -7.321 -16.798   1.317
  307   3HB   ALA  39           HB3      ALA  39  -7.410 -18.415   0.615
  308    H    SER  40           HN       SER  40  -8.561 -15.499  -2.621
  309    HA   SER  40           HA       SER  40  -9.930 -13.678  -0.756
  310   1HB   SER  40           HB2      SER  40 -10.164 -13.916  -3.772
  311   2HB   SER  40           HB1      SER  40 -10.782 -12.594  -2.786
  312    HG   SER  40           HG       SER  40  -8.058 -13.393  -2.953
  313    H    LYS  41           HN       LYS  41 -11.596 -14.705   0.324
  314    HA   LYS  41           HA       LYS  41 -13.505 -16.281  -1.354
  315   1HB   LYS  41           HB2      LYS  41 -12.158 -17.370   0.615
  316   2HB   LYS  41           HB1      LYS  41 -13.336 -16.543   1.636
  317   1HG   LYS  41           HG2      LYS  41 -14.515 -17.960  -0.661
  318   2HG   LYS  41           HG1      LYS  41 -13.722 -19.014   0.509
  319   1HD   LYS  41           HD2      LYS  41 -15.436 -18.773   1.941
  320   2HD   LYS  41           HD1      LYS  41 -15.236 -17.020   1.921
  321   1HE   LYS  41           HE2      LYS  41 -16.832 -16.715   0.278
  322   2HE   LYS  41           HE1      LYS  41 -16.551 -18.304  -0.435
  323   1HZ   LYS  41           HZ3      LYS  41 -17.787 -17.917   2.232
  324   2HZ   LYS  41           HZ2      LYS  41 -18.691 -18.054   0.802
  325   3HZ   LYS  41           HZ1      LYS  41 -17.717 -19.346   1.321
  326    H    ASP  42           HN       ASP  42 -13.237 -13.949   1.316
  327    HA   ASP  42           HA       ASP  42 -15.758 -12.696   0.487
  328   1HB   ASP  42           HB2      ASP  42 -16.209 -14.686   2.178
  329   2HB   ASP  42           HB1      ASP  42 -15.633 -13.523   3.372
  330    H    THR  43           HN       THR  43 -13.675 -11.288   0.196
  331    HA   THR  43           HA       THR  43 -13.130  -9.837   2.751
  332    HB   THR  43           HB       THR  43 -11.011  -9.115   1.674
  333    HG1  THR  43           HG1      THR  43 -11.813 -10.910  -0.369
  334   1HG2  THR  43          HG21      THR  43 -11.749 -11.954   2.144
  335   2HG2  THR  43          HG23      THR  43 -10.200 -11.660   1.356
  336   3HG2  THR  43          HG22      THR  43 -10.527 -10.960   2.941
  337    H    THR  44           HN       THR  44 -14.018  -7.854   2.874
  338    HA   THR  44           HA       THR  44 -14.982  -6.544   0.408
  339    HB   THR  44           HB       THR  44 -16.418  -6.652   2.469
  340    HG1  THR  44           HG1      THR  44 -17.181  -4.661   2.145
  341   1HG2  THR  44          HG21      THR  44 -14.304  -4.786   3.572
  342   2HG2  THR  44          HG23      THR  44 -15.856  -5.121   4.335
  343   3HG2  THR  44          HG22      THR  44 -14.668  -6.411   4.153
  344    H    GLU  45           HN       GLU  45 -14.550  -3.898   0.673
  345    HA   GLU  45           HA       GLU  45 -11.719  -3.686   0.206
  346   1HB   GLU  45           HB2      GLU  45 -12.094  -1.446  -0.338
  347   2HB   GLU  45           HB1      GLU  45 -13.649  -2.192  -0.696
  348   1HG   GLU  45           HG2      GLU  45 -14.299  -1.570   1.725
  349   2HG   GLU  45           HG1      GLU  45 -12.886  -0.514   1.693
  350    H    LYS  46           HN       LYS  46 -13.729  -2.950   3.033
  351    HA   LYS  46           HA       LYS  46 -11.741  -1.527   4.509
  352   1HB   LYS  46           HB2      LYS  46 -13.522  -1.322   5.859
  353   2HB   LYS  46           HB1      LYS  46 -14.374  -2.587   4.980
  354   1HG   LYS  46           HG2      LYS  46 -13.184  -4.294   6.381
  355   2HG   LYS  46           HG1      LYS  46 -12.460  -2.978   7.306
  356   1HD   LYS  46           HD2      LYS  46 -15.405  -3.668   7.072
  357   2HD   LYS  46           HD1      LYS  46 -14.404  -3.744   8.519
  358   1HE   LYS  46           HE2      LYS  46 -14.124  -1.302   8.479
  359   2HE   LYS  46           HE1      LYS  46 -15.089  -1.200   7.007
  360   1HZ   LYS  46           HZ2      LYS  46 -16.257  -2.589   9.295
  361   2HZ   LYS  46           HZ1      LYS  46 -16.148  -0.894   9.380
  362   3HZ   LYS  46           HZ3      LYS  46 -17.004  -1.626   8.110
  363    H    GLU  47           HN       GLU  47 -12.450  -4.984   4.248
  364    HA   GLU  47           HA       GLU  47 -10.543  -5.843   6.222
  365   1HB   GLU  47           HB2      GLU  47 -12.465  -7.028   4.533
  366   2HB   GLU  47           HB1      GLU  47 -10.926  -7.775   4.107
  367   1HG   GLU  47           HG2      GLU  47 -10.554  -8.076   6.628
  368   2HG   GLU  47           HG1      GLU  47 -12.263  -7.680   6.813
  369    H    THR  48           HN       THR  48 -10.369  -5.736   2.648
  370    HA   THR  48           HA       THR  48  -7.681  -6.658   2.461
  371    HB   THR  48           HB       THR  48  -9.052  -4.747   0.562
  372    HG1  THR  48           HG1      THR  48  -9.759  -6.688  -0.437
  373   1HG2  THR  48          HG23      THR  48  -6.548  -6.240   0.574
  374   2HG2  THR  48          HG22      THR  48  -7.551  -6.637  -0.822
  375   3HG2  THR  48          HG21      THR  48  -7.087  -4.964  -0.518
  376    H    PHE  49           HN       PHE  49  -8.936  -3.501   3.305
  377    HA   PHE  49           HA       PHE  49  -6.461  -2.102   2.672
  378   1HB   PHE  49           HB2      PHE  49  -8.909  -1.334   4.267
  379   2HB   PHE  49           HB1      PHE  49  -7.510  -0.276   4.136
  380    HD1  PHE  49           HD2      PHE  49  -6.716  -0.873   1.250
  381    HD2  PHE  49           HD1      PHE  49 -10.547  -0.121   3.057
  382    HE1  PHE  49           HE2      PHE  49  -7.588  -0.067  -0.908
  383    HE2  PHE  49           HE1      PHE  49 -11.404   0.696   0.881
  384    HZ   PHE  49           HZ       PHE  49  -9.923   0.723  -1.102
  385    H    CYS  50           HN       CYS  50  -7.886  -3.503   5.621
  386    HA   CYS  50           HA       CYS  50  -5.828  -2.501   7.373
  387   1HB   CYS  50           HB2      CYS  50  -7.329  -3.337   8.837
  388   2HB   CYS  50           HB1      CYS  50  -8.118  -4.269   7.568
  389    NH1  ARG  51           NH2      ARG  51  -7.758 -11.506   3.547
  390    NH2  ARG  51           NH1      ARG  51  -7.664 -12.691   5.468
  391    H    ARG  51           HN       ARG  51  -6.143  -5.559   5.545
  392    HA   ARG  51           HA       ARG  51  -3.792  -6.798   6.614
  393   1HB   ARG  51           HB2      ARG  51  -5.199  -7.100   3.946
  394   2HB   ARG  51           HB1      ARG  51  -3.798  -8.069   4.394
  395   1HG   ARG  51           HG2      ARG  51  -4.974  -8.983   6.313
  396   2HG   ARG  51           HG1      ARG  51  -6.344  -7.908   6.031
  397   1HD   ARG  51           HD2      ARG  51  -7.039  -9.068   4.128
  398   2HD   ARG  51           HD1      ARG  51  -5.438  -9.736   3.827
  399    HE   ARG  51           HE       ARG  51  -6.217 -10.867   6.245
  400   1HH1  ARG  51          HH21      ARG  51  -7.502 -10.714   2.997
  401   2HH1  ARG  51          HH22      ARG  51  -8.354 -12.210   3.156
  402   1HH2  ARG  51          HH11      ARG  51  -7.330 -12.806   6.404
  403   2HH2  ARG  51          HH12      ARG  51  -8.259 -13.386   5.061
  404    H    ALA  52           HN       ALA  52  -4.174  -5.170   3.443
  405    HA   ALA  52           HA       ALA  52  -1.408  -5.072   2.846
  406   1HB   ALA  52           HB2      ALA  52  -3.829  -4.069   1.719
  407   2HB   ALA  52           HB1      ALA  52  -2.663  -2.748   1.775
  408   3HB   ALA  52           HB3      ALA  52  -2.255  -4.249   0.943
  409    H    ALA  53           HN       ALA  53  -3.229  -3.189   5.140
  410    HA   ALA  53           HA       ALA  53  -1.430  -0.908   5.131
  411   1HB   ALA  53           HB3      ALA  53  -3.822  -1.725   6.559
  412   2HB   ALA  53           HB2      ALA  53  -2.618  -1.083   7.675
  413   3HB   ALA  53           HB1      ALA  53  -3.175  -0.102   6.320
  414    H    THR  54           HN       THR  54  -1.680  -3.911   7.007
  415    HA   THR  54           HA       THR  54   0.453  -3.248   8.836
  416    HB   THR  54           HB       THR  54  -0.775  -5.887   7.994
  417    HG1  THR  54           HG1      THR  54  -1.636  -3.986   9.482
  418   1HG2  THR  54          HG23      THR  54   1.589  -5.273   9.682
  419   2HG2  THR  54          HG22      THR  54   0.424  -6.394  10.383
  420   3HG2  THR  54          HG21      THR  54   1.169  -6.758   8.828
  421    H    VAL  55           HN       VAL  55   0.319  -5.030   5.754
  422    HA   VAL  55           HA       VAL  55   3.105  -5.764   5.764
  423    HB   VAL  55           HB       VAL  55   1.236  -5.366   3.402
  424   1HG1  VAL  55          HG11      VAL  55   4.023  -6.332   3.728
  425   2HG1  VAL  55          HG13      VAL  55   2.987  -7.337   2.713
  426   3HG1  VAL  55          HG12      VAL  55   3.232  -5.637   2.314
  427   1HG2  VAL  55          HG23      VAL  55   1.329  -7.341   5.523
  428   2HG2  VAL  55          HG22      VAL  55   0.171  -7.192   4.201
  429   3HG2  VAL  55          HG21      VAL  55   1.665  -8.100   3.966
  430    H    LEU  56           HN       LEU  56   1.343  -2.885   4.798
  431    HA   LEU  56           HA       LEU  56   3.564  -1.673   3.356
  432   1HB   LEU  56           HB2      LEU  56   0.807  -0.999   4.001
  433   2HB   LEU  56           HB1      LEU  56   1.877   0.383   4.247
  434    HG   LEU  56           HG       LEU  56   2.822   0.008   1.971
  435   1HD1  LEU  56          HD13      LEU  56   1.113  -2.370   2.215
  436   2HD1  LEU  56          HD12      LEU  56   0.908  -1.510   0.690
  437   3HD1  LEU  56          HD11      LEU  56   2.504  -2.088   1.167
  438   1HD2  LEU  56          HD23      LEU  56  -0.128   0.497   2.369
  439   2HD2  LEU  56          HD22      LEU  56   1.146   1.669   2.033
  440   3HD2  LEU  56          HD21      LEU  56   0.590   0.583   0.761
  441    NH1  ARG  57           NH2      ARG  57   2.170  -0.631  14.063
  442    NH2  ARG  57           NH1      ARG  57   4.222  -1.437  14.544
  443    H    ARG  57           HN       ARG  57   2.486  -1.794   6.695
  444    HA   ARG  57           HA       ARG  57   4.046   0.457   7.612
  445   1HB   ARG  57           HB2      ARG  57   2.102  -0.775   8.813
  446   2HB   ARG  57           HB1      ARG  57   3.338  -1.930   9.315
  447   1HG   ARG  57           HG2      ARG  57   4.655  -0.080  10.302
  448   2HG   ARG  57           HG1      ARG  57   3.391   1.059   9.826
  449   1HD   ARG  57           HD2      ARG  57   2.333   0.601  11.761
  450   2HD   ARG  57           HD1      ARG  57   2.063  -1.034  11.165
  451    HE   ARG  57           HE       ARG  57   4.665  -1.064  12.163
  452   1HH1  ARG  57          HH21      ARG  57   1.507  -0.262  13.415
  453   2HH1  ARG  57          HH22      ARG  57   1.911  -0.751  15.022
  454   1HH2  ARG  57          HH11      ARG  57   5.146  -1.690  14.258
  455   2HH2  ARG  57          HH12      ARG  57   3.945  -1.551  15.498
  456    H    GLN  58           HN       GLN  58   4.620  -3.036   7.351
  457    HA   GLN  58           HA       GLN  58   7.235  -2.970   8.578
  458   1HB   GLN  58           HB2      GLN  58   6.067  -4.953   6.598
  459   2HB   GLN  58           HB1      GLN  58   7.499  -5.218   7.594
  460   1HG   GLN  58           HG2      GLN  58   5.508  -4.384   9.392
  461   2HG   GLN  58           HG1      GLN  58   4.701  -5.515   8.305
  462   1HE2  GLN  58          HE22      GLN  58   7.962  -6.937  10.388
  463   2HE2  GLN  58          HE21      GLN  58   7.960  -5.322   9.864
  464    H    PHE  59           HN       PHE  59   6.015  -2.489   5.318
  465    HA   PHE  59           HA       PHE  59   8.510  -2.630   3.924
  466   1HB   PHE  59           HB2      PHE  59   6.321  -2.635   2.781
  467   2HB   PHE  59           HB1      PHE  59   6.036  -0.978   3.311
  468    HD1  PHE  59           HD1      PHE  59   8.121  -3.144   1.154
  469    HD2  PHE  59           HD2      PHE  59   7.136   0.892   2.248
  470    HE1  PHE  59           HE1      PHE  59   9.373  -2.306  -0.814
  471    HE2  PHE  59           HE2      PHE  59   8.388   1.731   0.281
  472    HZ   PHE  59           HZ       PHE  59   9.507   0.133  -1.250
  473    OH   TYR  60           OH       TYR  60   6.579   5.371  10.496
  474    H    TYR  60           HN       TYR  60   6.781   0.098   5.437
  475    HA   TYR  60           HA       TYR  60   9.069   1.875   4.873
  476   1HB   TYR  60           HB2      TYR  60   7.423   3.406   4.754
  477   2HB   TYR  60           HB1      TYR  60   6.251   2.198   5.264
  478    HD1  TYR  60           HD1      TYR  60   8.452   4.936   6.374
  479    HD2  TYR  60           HD2      TYR  60   5.561   2.007   7.598
  480    HE1  TYR  60           HE1      TYR  60   8.184   6.111   8.537
  481    HE2  TYR  60           HE2      TYR  60   5.296   3.178   9.765
  482    HH   TYR  60           HH       TYR  60   7.456   5.509  10.862
  483    H    SER  61           HN       SER  61   8.434  -0.364   7.233
  484    HA   SER  61           HA       SER  61   9.344   1.260   9.502
  485   1HB   SER  61           HB2      SER  61   7.718  -0.521   9.895
  486   2HB   SER  61           HB1      SER  61   8.829  -1.712   9.222
  487    HG   SER  61           HG       SER  61   9.183  -1.805  11.366
  488    H    HIS  62           HN       HIS  62  10.590  -1.795   8.090
  489    HA   HIS  62           HA       HIS  62  13.282  -1.062   9.062
  490   1HB   HIS  62           HB2      HIS  62  11.891  -3.548   8.325
  491   2HB   HIS  62           HB1      HIS  62  13.577  -3.481   7.808
  492    HD1  HIS  62           HD1      HIS  62  15.265  -4.058   9.557
  493    HD2  HIS  62           HD2      HIS  62  11.647  -2.858  11.253
  494    HE1  HIS  62           HE1      HIS  62  15.515  -4.351  12.062
  495    H    HIS  63           HN       HIS  63  11.703  -1.775   5.932
  496    HA   HIS  63           HA       HIS  63  14.186  -1.481   4.456
  497   1HB   HIS  63           HB2      HIS  63  11.313  -1.546   3.516
  498   2HB   HIS  63           HB1      HIS  63  12.714  -1.568   2.448
  499    HD1  HIS  63           HD1      HIS  63  14.469  -3.613   2.961
  500    HD2  HIS  63           HD2      HIS  63  10.585  -4.068   4.408
  501    HE1  HIS  63           HE1      HIS  63  14.185  -6.071   3.493
  502    H    GLU  64           HN       GLU  64  12.463   0.927   5.953
  503    HA   GLU  64           HA       GLU  64  12.608   2.844   3.723
  504   1HB   GLU  64           HB2      GLU  64  11.220   4.114   4.966
  505   2HB   GLU  64           HB1      GLU  64  11.086   2.716   6.027
  506   1HG   GLU  64           HG2      GLU  64  13.123   3.577   7.265
  507   2HG   GLU  64           HG1      GLU  64  12.985   5.056   6.309
  508    H    LYS  65           HN       LYS  65  14.799   1.596   6.015
  509    HA   LYS  65           HA       LYS  65  16.643   3.863   5.452
  510   1HB   LYS  65           HB2      LYS  65  15.515   3.962   7.779
  511   2HB   LYS  65           HB1      LYS  65  16.515   2.561   8.172
  512   1HG   LYS  65           HG2      LYS  65  18.257   4.381   6.928
  513   2HG   LYS  65           HG1      LYS  65  17.269   5.356   8.019
  514   1HD   LYS  65           HD2      LYS  65  17.787   3.839   9.876
  515   2HD   LYS  65           HD1      LYS  65  18.736   2.819   8.793
  516   1HE   LYS  65           HE2      LYS  65  20.534   4.122   9.133
  517   2HE   LYS  65           HE1      LYS  65  19.649   5.512   8.501
  518   1HZ   LYS  65           HZ3      LYS  65  18.683   5.835  10.701
  519   2HZ   LYS  65           HZ2      LYS  65  19.586   4.526  11.300
  520   3HZ   LYS  65           HZ1      LYS  65  20.376   5.925  10.751
  521    H    ASP  66           HN       ASP  66  16.902   1.646   3.962
  522    HA   ASP  66           HA       ASP  66  19.269   0.297   5.183
  523   1HB   ASP  66           HB2      ASP  66  16.803  -0.956   4.078
  524   2HB   ASP  66           HB1      ASP  66  18.337  -1.712   3.644
  525    H    THR  67           HN       THR  67  20.611  -0.787   3.435
  526    HA   THR  67           HA       THR  67  21.026   1.103   1.235
  527    HB   THR  67           HB       THR  67  22.462  -1.526   1.503
  528    HG1  THR  67           HG1      THR  67  23.701  -0.674   3.106
  529   1HG2  THR  67          HG22      THR  67  23.110   1.259   0.533
  530   2HG2  THR  67          HG21      THR  67  24.368   0.065   0.850
  531   3HG2  THR  67          HG23      THR  67  23.142  -0.251  -0.379
  532    NH1  ARG  68           NH2      ARG  68  17.708  -7.507   1.407
  533    NH2  ARG  68           NH1      ARG  68  19.235  -8.687   0.234
  534    H    ARG  68           HN       ARG  68  19.231  -1.801   1.676
  535    HA   ARG  68           HA       ARG  68  19.436  -3.118  -0.777
  536   1HB   ARG  68           HB2      ARG  68  17.573  -3.027   1.410
  537   2HB   ARG  68           HB1      ARG  68  16.677  -3.051  -0.109
  538   1HG   ARG  68           HG2      ARG  68  17.068  -5.341   0.520
  539   2HG   ARG  68           HG1      ARG  68  18.134  -4.983  -0.835
  540   1HD   ARG  68           HD2      ARG  68  19.941  -4.447   0.845
  541   2HD   ARG  68           HD1      ARG  68  18.881  -5.072   2.104
  542    HE   ARG  68           HE       ARG  68  20.509  -6.604   0.269
  543   1HH1  ARG  68          HH21      ARG  68  17.420  -6.666   1.860
  544   2HH1  ARG  68          HH22      ARG  68  17.128  -8.321   1.457
  545   1HH2  ARG  68          HH11      ARG  68  20.124  -8.745  -0.224
  546   2HH2  ARG  68          HH12      ARG  68  18.650  -9.494   0.295
  547    H    CYS  69           HN       CYS  69  16.872  -0.697  -0.059
  548    HA   CYS  69           HA       CYS  69  16.563  -0.298  -2.974
  549   1HB   CYS  69           HB2      CYS  69  14.538  -0.503  -1.548
  550   2HB   CYS  69           HB1      CYS  69  15.010   0.970  -0.699
  551    H    LEU  70           HN       LEU  70  18.019   1.345  -0.271
  552    HA   LEU  70           HA       LEU  70  17.935   4.018  -1.143
  553   1HB   LEU  70           HB2      LEU  70  18.881   3.774   0.961
  554   2HB   LEU  70           HB1      LEU  70  19.891   2.425   0.462
  555    HG   LEU  70           HG       LEU  70  21.376   3.899  -0.752
  556   1HD1  LEU  70          HD13      LEU  70  19.072   5.654  -0.654
  557   2HD1  LEU  70          HD12      LEU  70  20.497   6.490  -0.038
  558   3HD1  LEU  70          HD11      LEU  70  20.519   5.787  -1.655
  559   1HD2  LEU  70          HD23      LEU  70  20.659   5.026   1.968
  560   2HD2  LEU  70          HD22      LEU  70  21.791   3.711   1.652
  561   3HD2  LEU  70          HD21      LEU  70  22.164   5.347   1.109
  562    H    GLY  71           HN       GLY  71  20.778   1.873  -1.729
  563   1HA   GLY  71           HA2      GLY  71  21.490   1.602  -4.127
  564   2HA   GLY  71           HA1      GLY  71  21.065   3.300  -4.347
  565    H    ALA  72           HN       ALA  72  23.029   4.262  -4.761
  566    HA   ALA  72           HA       ALA  72  24.958   4.357  -2.550
  567   1HB   ALA  72           HB3      ALA  72  25.336   2.441  -4.558
  568   2HB   ALA  72           HB2      ALA  72  26.426   3.761  -4.984
  569   3HB   ALA  72           HB1      ALA  72  26.541   3.000  -3.398
  570    H    THR  73           HN       THR  73  23.223   6.186  -4.239
  571    HA   THR  73           HA       THR  73  25.395   8.119  -4.876
  572    HB   THR  73           HB       THR  73  24.952   7.679  -7.079
  573    HG1  THR  73           HG1      THR  73  22.521   9.025  -6.706
  574   1HG2  THR  73          HG21      THR  73  22.183   6.810  -6.211
  575   2HG2  THR  73          HG23      THR  73  22.783   6.739  -7.868
  576   3HG2  THR  73          HG22      THR  73  23.533   5.749  -6.616
  577    H    ALA  74           HN       ALA  74  24.556  10.379  -4.950
  578    HA   ALA  74           HA       ALA  74  22.771  10.872  -2.728
  579   1HB   ALA  74           HB3      ALA  74  24.712  12.328  -4.107
  580   2HB   ALA  74           HB2      ALA  74  23.203  13.157  -4.490
  581   3HB   ALA  74           HB1      ALA  74  23.685  12.938  -2.807
  582    H    GLN  75           HN       GLN  75  22.454  10.984  -6.250
  583    HA   GLN  75           HA       GLN  75  19.950  12.299  -6.427
  584   1HB   GLN  75           HB2      GLN  75  21.345  10.250  -8.140
  585   2HB   GLN  75           HB1      GLN  75  19.705  10.765  -8.536
  586   1HG   GLN  75           HG2      GLN  75  21.355  13.065  -7.919
  587   2HG   GLN  75           HG1      GLN  75  22.105  12.098  -9.190
  588   1HE2  GLN  75          HE22      GLN  75  19.960  13.713 -11.486
  589   2HE2  GLN  75          HE21      GLN  75  21.558  13.379 -11.025
  590    H    GLN  76           HN       GLN  76  20.568   8.759  -6.298
  591    HA   GLN  76           HA       GLN  76  17.788   8.065  -6.070
  592   1HB   GLN  76           HB2      GLN  76  20.000   6.623  -6.566
  593   2HB   GLN  76           HB1      GLN  76  19.843   6.289  -4.841
  594   1HG   GLN  76           HG2      GLN  76  18.556   4.587  -5.842
  595   2HG   GLN  76           HG1      GLN  76  17.352   5.790  -5.380
  596   1HE2  GLN  76          HE22      GLN  76  16.202   5.730  -8.718
  597   2HE2  GLN  76          HE21      GLN  76  15.828   5.507  -7.078
  598    H    PHE  77           HN       PHE  77  20.142   9.153  -3.728
  599    HA   PHE  77           HA       PHE  77  19.031   8.091  -1.345
  600   1HB   PHE  77           HB2      PHE  77  21.121   9.745  -1.900
  601   2HB   PHE  77           HB1      PHE  77  19.974  10.900  -1.229
  602    HD1  PHE  77           HD2      PHE  77  18.520   9.087   0.684
  603    HD2  PHE  77           HD1      PHE  77  22.708   9.556  -0.141
  604    HE1  PHE  77           HE2      PHE  77  19.060   8.305   2.976
  605    HE2  PHE  77           HE1      PHE  77  23.249   8.775   2.149
  606    HZ   PHE  77           HZ       PHE  77  21.425   8.151   3.708
  607    H    HIS  78           HN       HIS  78  18.340  11.239  -2.901
  608    HA   HIS  78           HA       HIS  78  16.158  11.832  -1.088
  609   1HB   HIS  78           HB2      HIS  78  17.414  13.609  -2.237
  610   2HB   HIS  78           HB1      HIS  78  16.858  13.004  -3.796
  611    HD1  HIS  78           HD1      HIS  78  15.717  14.885  -0.765
  612    HD2  HIS  78           HD2      HIS  78  14.109  13.549  -4.373
  613    HE1  HIS  78           HE1      HIS  78  13.479  16.045  -1.025
  614    NH1  ARG  79           NH2      ARG  79  16.334  11.810  -9.504
  615    NH2  ARG  79           NH1      ARG  79  15.175  13.438  -8.457
  616    H    ARG  79           HN       ARG  79  16.416  10.377  -4.291
  617    HA   ARG  79           HA       ARG  79  13.717  10.408  -5.090
  618   1HB   ARG  79           HB2      ARG  79  16.033   9.315  -6.060
  619   2HB   ARG  79           HB1      ARG  79  15.142   7.870  -5.587
  620   1HG   ARG  79           HG2      ARG  79  13.935   8.058  -7.475
  621   2HG   ARG  79           HG1      ARG  79  13.275   9.571  -6.858
  622   1HD   ARG  79           HD2      ARG  79  16.000   9.619  -8.086
  623   2HD   ARG  79           HD1      ARG  79  14.606   9.506  -9.156
  624    HE   ARG  79           HE       ARG  79  14.007  11.577  -7.369
  625   1HH1  ARG  79          HH21      ARG  79  16.528  10.846  -9.670
  626   2HH1  ARG  79          HH22      ARG  79  16.849  12.510  -9.998
  627   1HH2  ARG  79          HH11      ARG  79  14.467  13.724  -7.812
  628   2HH2  ARG  79          HH12      ARG  79  15.708  14.123  -8.953
  629    H    HIS  80           HN       HIS  80  15.344   8.299  -2.773
  630    HA   HIS  80           HA       HIS  80  12.898   6.684  -2.404
  631   1HB   HIS  80           HB2      HIS  80  14.970   5.465  -2.353
  632   2HB   HIS  80           HB1      HIS  80  15.678   6.594  -1.203
  633    HD1  HIS  80           HD1      HIS  80  12.591   4.322  -1.295
  634    HD2  HIS  80           HD2      HIS  80  15.565   5.587   1.347
  635    HE1  HIS  80           HE1      HIS  80  12.203   3.073   0.880
  636    H    LYS  81           HN       LYS  81  14.679   9.271  -0.828
  637    HA   LYS  81           HA       LYS  81  13.581   9.194   1.770
  638   1HB   LYS  81           HB2      LYS  81  15.277  10.865   0.459
  639   2HB   LYS  81           HB1      LYS  81  13.836  11.878   0.536
  640   1HG   LYS  81           HG2      LYS  81  13.719  11.592   2.959
  641   2HG   LYS  81           HG1      LYS  81  15.089  10.483   2.920
  642   1HD   LYS  81           HD2      LYS  81  15.999  12.750   1.554
  643   2HD   LYS  81           HD1      LYS  81  15.082  13.397   2.914
  644   1HE   LYS  81           HE2      LYS  81  16.388  12.074   4.488
  645   2HE   LYS  81           HE1      LYS  81  17.235  11.277   3.162
  646   1HZ   LYS  81           HZ2      LYS  81  17.276  14.215   3.551
  647   2HZ   LYS  81           HZ1      LYS  81  18.435  13.184   4.244
  648   3HZ   LYS  81           HZ3      LYS  81  18.287  13.279   2.556
  649    H    GLN  82           HN       GLN  82  12.102  10.205  -1.250
  650    HA   GLN  82           HA       GLN  82   9.821  11.481   0.102
  651   1HB   GLN  82           HB2      GLN  82  10.677  11.025  -2.728
  652   2HB   GLN  82           HB1      GLN  82   8.960  11.282  -2.418
  653   1HG   GLN  82           HG2      GLN  82   9.323  13.425  -1.495
  654   2HG   GLN  82           HG1      GLN  82  11.049  13.125  -1.263
  655   1HE2  GLN  82          HE22      GLN  82  10.084  15.020  -4.545
  656   2HE2  GLN  82          HE21      GLN  82   9.284  15.091  -3.049
  657    H    LEU  83           HN       LEU  83  10.479   8.483  -1.695
  658    HA   LEU  83           HA       LEU  83   7.906   7.377  -1.838
  659   1HB   LEU  83           HB2      LEU  83  10.288   6.442  -2.541
  660   2HB   LEU  83           HB1      LEU  83  10.192   5.629  -0.979
  661    HG   LEU  83           HG       LEU  83   7.755   5.458  -2.664
  662   1HD1  LEU  83          HD13      LEU  83   9.864   5.193  -4.184
  663   2HD1  LEU  83          HD12      LEU  83  10.082   3.662  -3.335
  664   3HD1  LEU  83          HD11      LEU  83   8.610   3.956  -4.261
  665   1HD2  LEU  83          HD22      LEU  83   8.481   4.303  -0.372
  666   2HD2  LEU  83          HD21      LEU  83   7.490   3.442  -1.551
  667   3HD2  LEU  83          HD23      LEU  83   9.226   3.141  -1.469
  668    H    ILE  84           HN       ILE  84  10.071   7.626   0.930
  669    HA   ILE  84           HA       ILE  84   8.615   5.865   2.664
  670    HB   ILE  84           HB       ILE  84  10.276   8.257   3.512
  671   1HG1  ILE  84          HG12      ILE  84  11.620   6.973   1.972
  672   2HG1  ILE  84          HG11      ILE  84  12.127   6.518   3.598
  673   1HG2  ILE  84          HG23      ILE  84   9.127   5.837   4.798
  674   2HG2  ILE  84          HG22      ILE  84  10.757   6.292   5.291
  675   3HG2  ILE  84          HG21      ILE  84   9.425   7.433   5.485
  676   1HD1  ILE  84          HD13      ILE  84  10.141   4.729   3.238
  677   2HD1  ILE  84          HD12      ILE  84  10.655   4.931   1.563
  678   3HD1  ILE  84          HD11      ILE  84  11.812   4.402   2.783
  679    NH1  ARG  85           NH2      ARG  85  11.224  12.874   4.462
  680    NH2  ARG  85           NH1      ARG  85  11.231  11.224   6.001
  681    H    ARG  85           HN       ARG  85   8.519   9.442   2.374
  682    HA   ARG  85           HA       ARG  85   6.542   9.859   4.354
  683   1HB   ARG  85           HB2      ARG  85   7.798  11.417   2.292
  684   2HB   ARG  85           HB1      ARG  85   6.064  11.735   2.281
  685   1HG   ARG  85           HG2      ARG  85   6.354  13.078   4.065
  686   2HG   ARG  85           HG1      ARG  85   6.823  11.664   5.007
  687   1HD   ARG  85           HD2      ARG  85   8.925  12.762   3.233
  688   2HD   ARG  85           HD1      ARG  85   8.458  13.792   4.586
  689    HE   ARG  85           HE       ARG  85   8.797  11.261   5.699
  690   1HH1  ARG  85          HH21      ARG  85  10.738  13.486   3.842
  691   2HH1  ARG  85          HH22      ARG  85  12.220  12.923   4.526
  692   1HH2  ARG  85          HH11      ARG  85  10.741  10.562   6.568
  693   2HH2  ARG  85          HH12      ARG  85  12.228  11.287   6.054
  694    H    PHE  86           HN       PHE  86   6.180   8.969   0.946
  695    HA   PHE  86           HA       PHE  86   3.327   9.306   0.889
  696   1HB   PHE  86           HB2      PHE  86   5.394   8.291  -0.878
  697   2HB   PHE  86           HB1      PHE  86   3.974   7.248  -0.914
  698    HD1  PHE  86           HD2      PHE  86   1.743   9.063  -0.492
  699    HD2  PHE  86           HD1      PHE  86   5.328   9.640  -2.783
  700    HE1  PHE  86           HE2      PHE  86   0.564  10.711  -1.916
  701    HE2  PHE  86           HE1      PHE  86   4.149  11.287  -4.211
  702    HZ   PHE  86           HZ       PHE  86   1.767  11.827  -3.776
  703    H    LEU  87           HN       LEU  87   5.429   6.673   1.902
  704    HA   LEU  87           HA       LEU  87   3.419   4.634   1.981
  705   1HB   LEU  87           HB2      LEU  87   6.093   4.629   2.347
  706   2HB   LEU  87           HB1      LEU  87   5.569   4.570   4.031
  707    HG   LEU  87           HG       LEU  87   5.755   2.293   3.276
  708   1HD1  LEU  87          HD11      LEU  87   3.639   3.129   4.541
  709   2HD1  LEU  87          HD13      LEU  87   2.810   2.876   3.006
  710   3HD1  LEU  87          HD12      LEU  87   3.594   1.522   3.819
  711   1HD2  LEU  87          HD21      LEU  87   5.371   3.224   0.784
  712   2HD2  LEU  87          HD23      LEU  87   5.092   1.534   1.199
  713   3HD2  LEU  87          HD22      LEU  87   3.733   2.653   1.106
  714    H    LYS  88           HN       LYS  88   4.575   6.887   4.506
  715    HA   LYS  88           HA       LYS  88   2.885   5.874   6.584
  716   1HB   LYS  88           HB2      LYS  88   3.984   8.671   6.189
  717   2HB   LYS  88           HB1      LYS  88   3.295   8.049   7.689
  718   1HG   LYS  88           HG2      LYS  88   5.013   6.259   7.717
  719   2HG   LYS  88           HG1      LYS  88   5.731   6.946   6.259
  720   1HD   LYS  88           HD2      LYS  88   5.295   8.862   8.475
  721   2HD   LYS  88           HD1      LYS  88   6.511   7.620   8.779
  722   1HE   LYS  88           HE2      LYS  88   7.866   8.322   7.014
  723   2HE   LYS  88           HE1      LYS  88   6.526   9.091   6.164
  724   1HZ   LYS  88           HZ3      LYS  88   7.079  10.177   8.781
  725   2HZ   LYS  88           HZ2      LYS  88   8.327  10.402   7.650
  726   3HZ   LYS  88           HZ1      LYS  88   6.763  10.975   7.319
  727    NH1  ARG  89           NH2      ARG  89  -0.039  13.015  -0.492
  728    NH2  ARG  89           NH1      ARG  89  -1.686  14.283   0.391
  729    H    ARG  89           HN       ARG  89   2.361   8.486   4.212
  730    HA   ARG  89           HA       ARG  89  -0.132   9.404   5.202
  731   1HB   ARG  89           HB2      ARG  89   0.933  10.679   3.491
  732   2HB   ARG  89           HB1      ARG  89   1.061   9.284   2.426
  733   1HG   ARG  89           HG2      ARG  89  -1.472   9.266   2.289
  734   2HG   ARG  89           HG1      ARG  89  -1.461  10.794   3.174
  735   1HD   ARG  89           HD2      ARG  89   0.449  11.090   1.129
  736   2HD   ARG  89           HD1      ARG  89  -0.943  10.313   0.368
  737    HE   ARG  89           HE       ARG  89  -2.082  12.345   1.836
  738   1HH1  ARG  89          HH21      ARG  89   0.485  12.168  -0.528
  739   2HH1  ARG  89          HH22      ARG  89   0.185  13.764  -1.116
  740   1HH2  ARG  89          HH11      ARG  89  -2.435  14.405   1.041
  741   2HH2  ARG  89          HH12      ARG  89  -1.449  15.019  -0.242
  742    H    LEU  90           HN       LEU  90   0.569   6.875   2.811
  743    HA   LEU  90           HA       LEU  90  -2.196   6.099   2.500
  744   1HB   LEU  90           HB2      LEU  90  -0.153   5.711   0.930
  745   2HB   LEU  90           HB1      LEU  90   0.129   4.284   1.930
  746    HG   LEU  90           HG       LEU  90  -2.475   3.928   1.519
  747   1HD1  LEU  90          HD13      LEU  90  -2.725   6.028   0.232
  748   2HD1  LEU  90          HD12      LEU  90  -1.547   5.439  -0.939
  749   3HD1  LEU  90          HD11      LEU  90  -3.095   4.617  -0.760
  750   1HD2  LEU  90          HD22      LEU  90  -0.086   3.223  -0.143
  751   2HD2  LEU  90          HD21      LEU  90  -1.106   2.176   0.846
  752   3HD2  LEU  90          HD23      LEU  90  -1.686   2.753  -0.714
  753    H    ASP  91           HN       ASP  91   0.167   5.387   4.922
  754    HA   ASP  91           HA       ASP  91  -0.728   2.758   5.644
  755   1HB   ASP  91           HB2      ASP  91   1.262   4.544   6.505
  756   2HB   ASP  91           HB1      ASP  91   0.246   4.259   7.916
  757    NH1  ARG  92           NH2      ARG  92  -6.101   4.604  12.799
  758    NH2  ARG  92           NH1      ARG  92  -5.404   6.057  14.381
  759    H    ARG  92           HN       ARG  92  -1.471   5.935   7.149
  760    HA   ARG  92           HA       ARG  92  -3.605   4.655   8.735
  761   1HB   ARG  92           HB2      ARG  92  -2.203   6.288   9.859
  762   2HB   ARG  92           HB1      ARG  92  -2.560   7.498   8.630
  763   1HG   ARG  92           HG2      ARG  92  -3.916   7.916  10.619
  764   2HG   ARG  92           HG1      ARG  92  -4.960   7.427   9.288
  765   1HD   ARG  92           HD2      ARG  92  -5.716   5.689  10.495
  766   2HD   ARG  92           HD1      ARG  92  -4.069   5.079  10.689
  767    HE   ARG  92           HE       ARG  92  -4.223   7.137  12.527
  768   1HH1  ARG  92          HH21      ARG  92  -6.122   4.289  11.852
  769   2HH1  ARG  92          HH22      ARG  92  -6.613   4.104  13.498
  770   1HH2  ARG  92          HH11      ARG  92  -4.881   6.868  14.649
  771   2HH2  ARG  92          HH12      ARG  92  -5.919   5.544  15.066
  772    H    ASN  93           HN       ASN  93  -3.353   6.526   5.798
  773    HA   ASN  93           HA       ASN  93  -6.139   7.431   5.927
  774   1HB   ASN  93           HB2      ASN  93  -4.187   7.490   3.610
  775   2HB   ASN  93           HB1      ASN  93  -5.711   8.367   3.702
  776   1HD2  ASN  93          HD22      ASN  93  -4.119  10.234   6.655
  777   2HD2  ASN  93          HD21      ASN  93  -5.317   9.038   6.632
  778    H    LEU  94           HN       LEU  94  -4.382   4.793   4.349
  779    HA   LEU  94           HA       LEU  94  -6.591   4.017   2.648
  780   1HB   LEU  94           HB2      LEU  94  -4.093   3.374   2.455
  781   2HB   LEU  94           HB1      LEU  94  -4.466   2.126   3.643
  782    HG   LEU  94           HG       LEU  94  -6.461   1.568   2.044
  783   1HD1  LEU  94          HD11      LEU  94  -5.328   3.713   0.658
  784   2HD1  LEU  94          HD13      LEU  94  -4.784   2.289  -0.230
  785   3HD1  LEU  94          HD12      LEU  94  -6.508   2.568   0.019
  786   1HD2  LEU  94          HD22      LEU  94  -3.566   0.881   1.862
  787   2HD2  LEU  94          HD21      LEU  94  -4.950  -0.164   2.185
  788   3HD2  LEU  94          HD23      LEU  94  -4.594   0.347   0.534
  789    CH2  TRP  95           CH2      TRP  95  -4.963   1.418  12.365
  790    H    TRP  95           HN       TRP  95  -5.293   2.546   5.642
  791    HA   TRP  95           HA       TRP  95  -7.738   0.927   5.920
  792   1HB   TRP  95           HB2      TRP  95  -5.982  -0.381   6.561
  793   2HB   TRP  95           HB1      TRP  95  -5.019   0.992   7.092
  794    HD1  TRP  95           HD1      TRP  95  -8.062  -1.076   8.277
  795    HE1  TRP  95           HE1      TRP  95  -8.077  -1.045  10.858
  796    HE3  TRP  95           HE3      TRP  95  -4.144   2.023   9.113
  797    HZ2  TRP  95           HZ2      TRP  95  -6.586   0.159  13.003
  798    HZ3  TRP  95           HZ3      TRP  95  -3.436   2.606  11.421
  799    HH2  TRP  95           HH2      TRP  95  -4.655   1.669  13.370
  800    H    GLY  96           HN       GLY  96  -6.695   4.008   6.981
  801   1HA   GLY  96           HA2      GLY  96  -7.776   4.199   9.584
  802   2HA   GLY  96           HA1      GLY  96  -7.721   5.542   8.443
  803    H    LEU  97           HN       LEU  97  -9.391   4.107   6.459
  804    HA   LEU  97           HA       LEU  97 -11.984   4.950   7.433
  805   1HB   LEU  97           HB2      LEU  97 -10.824   4.115   4.937
  806   2HB   LEU  97           HB1      LEU  97 -12.285   3.170   5.228
  807    HG   LEU  97           HG       LEU  97 -13.467   5.355   5.745
  808   1HD1  LEU  97          HD11      LEU  97 -10.872   6.434   4.608
  809   2HD1  LEU  97          HD13      LEU  97 -12.345   7.387   4.788
  810   3HD1  LEU  97          HD12      LEU  97 -11.534   6.741   6.214
  811   1HD2  LEU  97          HD23      LEU  97 -12.609   4.256   3.195
  812   2HD2  LEU  97          HD22      LEU  97 -14.171   4.945   3.639
  813   3HD2  LEU  97          HD21      LEU  97 -12.874   5.996   3.070
  814    H    ALA  98           HN       ALA  98 -10.358   1.847   6.997
  815    HA   ALA  98           HA       ALA  98 -12.450   0.058   7.505
  816   1HB   ALA  98           HB2      ALA  98  -9.581   0.001   7.500
  817   2HB   ALA  98           HB1      ALA  98 -10.162  -0.877   8.915
  818   3HB   ALA  98           HB3      ALA  98 -10.701  -1.348   7.301
  819    H    GLY  99           HN       GLY  99 -10.145   1.252   9.950
  820   1HA   GLY  99           HA2      GLY  99 -10.560   1.871  12.199
  821   2HA   GLY  99           HA1      GLY  99 -12.287   1.680  11.887
  822    H    LEU 100           HN       LEU 100  -9.323  -0.286  12.276
  823    HA   LEU 100           HA       LEU 100 -10.910  -2.215  13.891
  824   1HB   LEU 100           HB2      LEU 100  -9.882  -2.702  11.209
  825   2HB   LEU 100           HB1      LEU 100  -9.153  -3.804  12.372
  826    HG   LEU 100           HG       LEU 100 -11.928  -3.631  12.996
  827   1HD1  LEU 100          HD13      LEU 100 -11.310  -4.070  10.062
  828   2HD1  LEU 100          HD12      LEU 100 -12.827  -4.548  10.826
  829   3HD1  LEU 100          HD11      LEU 100 -12.374  -2.845  10.753
  830   1HD2  LEU 100          HD22      LEU 100 -10.409  -5.554  13.388
  831   2HD2  LEU 100          HD21      LEU 100 -11.846  -6.039  12.488
  832   3HD2  LEU 100          HD23      LEU 100 -10.313  -5.819  11.645
  833    H    ASN 101           HN       ASN 101  -9.624  -3.298  15.464
  834    HA   ASN 101           HA       ASN 101  -6.964  -2.047  15.887
  835   1HB   ASN 101           HB2      ASN 101  -9.065  -2.896  17.610
  836   2HB   ASN 101           HB1      ASN 101  -7.664  -3.908  17.957
  837   1HD2  ASN 101          HD22      ASN 101  -6.102  -1.330  19.765
  838   2HD2  ASN 101          HD21      ASN 101  -6.325  -2.995  19.518
  839    H    SER 102           HN       SER 102  -8.419  -5.318  15.807
  840    HA   SER 102           HA       SER 102  -5.727  -6.518  15.680
  841   1HB   SER 102           HB2      SER 102  -8.525  -7.642  15.825
  842   2HB   SER 102           HB1      SER 102  -7.128  -8.672  15.517
  843    HG   SER 102           HG       SER 102  -6.751  -6.909  17.571
  844    H    CYS 103           HN       CYS 103  -4.892  -7.590  13.864
  845    HA   CYS 103           HA       CYS 103  -6.500  -7.682  11.381
  846   1HB   CYS 103           HB2      CYS 103  -4.175  -5.870  11.862
  847   2HB   CYS 103           HB1      CYS 103  -4.293  -6.649  10.286
  848    HA   PRO 104           HA       PRO 104  -3.794 -11.342  11.929
  849   1HB   PRO 104           HB2      PRO 104  -5.553 -12.930  10.402
  850   2HB   PRO 104           HB1      PRO 104  -5.476 -12.850  12.168
  851   1HG   PRO 104           HG2      PRO 104  -7.531 -11.780  10.387
  852   2HG   PRO 104           HG1      PRO 104  -7.556 -11.912  12.152
  853   1HD   PRO 104           HD2      PRO 104  -7.179  -9.535  10.588
  854   2HD   PRO 104           HD1      PRO 104  -7.121  -9.686  12.356
  855    H    VAL 105           HN       VAL 105  -2.285 -10.218  10.374
  856    HA   VAL 105           HA       VAL 105  -2.826 -10.952   7.532
  857    HB   VAL 105           HB       VAL 105  -0.474  -9.275   8.337
  858   1HG1  VAL 105          HG11      VAL 105  -2.390  -9.360   5.988
  859   2HG1  VAL 105          HG13      VAL 105  -1.070  -8.201   6.151
  860   3HG1  VAL 105          HG12      VAL 105  -0.719  -9.923   6.002
  861   1HG2  VAL 105          HG22      VAL 105  -3.372  -8.572   8.556
  862   2HG2  VAL 105          HG21      VAL 105  -2.005  -7.985   9.502
  863   3HG2  VAL 105          HG23      VAL 105  -2.287  -7.356   7.879
  864    H    LYS 106           HN       LYS 106  -2.098 -12.984   7.164
  865    HA   LYS 106           HA       LYS 106   0.710 -13.598   7.274
  866   1HB   LYS 106           HB2      LYS 106  -0.211 -13.775   9.750
  867   2HB   LYS 106           HB1      LYS 106  -0.860 -15.312   9.180
  868   1HG   LYS 106           HG2      LYS 106   1.329 -15.748  10.104
  869   2HG   LYS 106           HG1      LYS 106   1.453 -15.888   8.350
  870   1HD   LYS 106           HD2      LYS 106   2.719 -13.989   8.145
  871   2HD   LYS 106           HD1      LYS 106   1.931 -13.188   9.506
  872   1HE   LYS 106           HE2      LYS 106   3.667 -13.765  10.821
  873   2HE   LYS 106           HE1      LYS 106   3.277 -15.463  10.552
  874   1HZ   LYS 106           HZ3      LYS 106   4.767 -13.979   8.501
  875   2HZ   LYS 106           HZ2      LYS 106   5.588 -14.545   9.875
  876   3HZ   LYS 106           HZ1      LYS 106   4.785 -15.637   8.851
  877    H    GLU 107           HN       GLU 107  -0.616 -13.854   5.078
  878    HA   GLU 107           HA       GLU 107  -1.330 -16.747   4.853
  879   1HB   GLU 107           HB2      GLU 107  -2.729 -14.518   3.356
  880   2HB   GLU 107           HB1      GLU 107  -3.174 -16.224   3.388
  881   1HG   GLU 107           HG2      GLU 107  -3.750 -16.081   5.746
  882   2HG   GLU 107           HG1      GLU 107  -3.170 -14.416   5.824
  883    H    ALA 108           HN       ALA 108   1.219 -15.507   4.227
  884    HA   ALA 108           HA       ALA 108   1.464 -16.534   1.529
  885   1HB   ALA 108           HB1      ALA 108   1.179 -13.633   1.964
  886   2HB   ALA 108           HB3      ALA 108   2.546 -14.100   0.955
  887   3HB   ALA 108           HB2      ALA 108   0.910 -14.584   0.504
  888    H    ASP 109           HN       ASP 109   3.619 -16.803   0.921
  889    HA   ASP 109           HA       ASP 109   5.520 -16.778   3.173
  890   1HB   ASP 109           HB2      ASP 109   5.388 -18.821   1.858
  891   2HB   ASP 109           HB1      ASP 109   5.699 -17.925   0.372
  892    H    GLN 110           HN       GLN 110   5.838 -15.889  -0.295
  893    HA   GLN 110           HA       GLN 110   6.843 -13.254   0.347
  894   1HB   GLN 110           HB2      GLN 110   8.735 -15.174   0.762
  895   2HB   GLN 110           HB1      GLN 110   9.028 -14.773  -0.929
  896   1HG   GLN 110           HG2      GLN 110  10.177 -12.977  -0.198
  897   2HG   GLN 110           HG1      GLN 110   8.630 -12.301   0.320
  898   1HE2  GLN 110          HE22      GLN 110  11.250 -13.714   3.098
  899   2HE2  GLN 110          HE21      GLN 110  11.581 -13.862   1.438
  900    H    SER 111           HN       SER 111   5.479 -12.547  -1.289
  901    HA   SER 111           HA       SER 111   5.953 -13.587  -4.035
  902   1HB   SER 111           HB2      SER 111   3.764 -12.073  -2.678
  903   2HB   SER 111           HB1      SER 111   4.072 -11.655  -4.365
  904    HG   SER 111           HG       SER 111   4.121 -14.175  -4.466
  905    H    THR 112           HN       THR 112   6.185 -11.658  -5.722
  906    HA   THR 112           HA       THR 112   8.340  -9.977  -4.635
  907    HB   THR 112           HB       THR 112   8.517  -9.170  -7.024
  908    HG1  THR 112           HG1      THR 112   6.726 -11.257  -7.618
  909   1HG2  THR 112          HG22      THR 112   8.808 -11.963  -6.064
  910   2HG2  THR 112          HG21      THR 112   8.924 -11.727  -7.808
  911   3HG2  THR 112          HG23      THR 112  10.022 -10.868  -6.724
  912    H    LEU 113           HN       LEU 113   8.294  -7.656  -4.658
  913    HA   LEU 113           HA       LEU 113   5.698  -6.548  -3.993
  914   1HB   LEU 113           HB2      LEU 113   7.698  -5.723  -2.883
  915   2HB   LEU 113           HB1      LEU 113   8.407  -5.251  -4.427
  916    HG   LEU 113           HG       LEU 113   6.672  -3.590  -4.767
  917   1HD1  LEU 113          HD13      LEU 113   5.389  -5.090  -2.566
  918   2HD1  LEU 113          HD12      LEU 113   5.238  -3.337  -2.447
  919   3HD1  LEU 113          HD11      LEU 113   4.648  -4.177  -3.882
  920   1HD2  LEU 113          HD23      LEU 113   8.663  -3.422  -2.906
  921   2HD2  LEU 113          HD22      LEU 113   7.633  -2.069  -3.373
  922   3HD2  LEU 113          HD21      LEU 113   7.253  -3.012  -1.930
  923    H    GLU 114           HN       GLU 114   7.205  -7.147  -6.983
  924    HA   GLU 114           HA       GLU 114   6.314  -4.805  -8.429
  925   1HB   GLU 114           HB2      GLU 114   6.905  -7.562  -9.539
  926   2HB   GLU 114           HB1      GLU 114   6.936  -6.035 -10.418
  927   1HG   GLU 114           HG2      GLU 114   8.913  -5.326  -9.365
  928   2HG   GLU 114           HG1      GLU 114   8.717  -6.449  -8.022
  929    H    ASN 115           HN       ASN 115   5.182  -8.195  -8.602
  930    HA   ASN 115           HA       ASN 115   2.755  -7.517  -9.986
  931   1HB   ASN 115           HB2      ASN 115   2.052  -9.838  -9.414
  932   2HB   ASN 115           HB1      ASN 115   3.686  -9.785 -10.077
  933   1HD2  ASN 115          HD22      ASN 115   3.986 -11.903  -7.080
  934   2HD2  ASN 115          HD21      ASN 115   3.318 -12.018  -8.636
  935    H    PHE 116           HN       PHE 116   3.602  -7.332  -6.616
  936    HA   PHE 116           HA       PHE 116   0.796  -7.467  -5.736
  937   1HB   PHE 116           HB2      PHE 116   2.448  -8.249  -4.158
  938   2HB   PHE 116           HB1      PHE 116   3.384  -6.762  -4.312
  939    HD1  PHE 116           HD1      PHE 116  -0.115  -7.857  -3.476
  940    HD2  PHE 116           HD2      PHE 116   3.096  -5.112  -2.690
  941    HE1  PHE 116           HE1      PHE 116  -1.441  -6.823  -1.659
  942    HE2  PHE 116           HE2      PHE 116   1.771  -4.083  -0.871
  943    HZ   PHE 116           HZ       PHE 116  -0.499  -4.935  -0.355
  944    H    LEU 117           HN       LEU 117   3.117  -5.016  -6.720
  945    HA   LEU 117           HA       LEU 117   1.572  -2.796  -5.609
  946   1HB   LEU 117           HB2      LEU 117   4.130  -3.126  -6.835
  947   2HB   LEU 117           HB1      LEU 117   3.231  -1.945  -7.791
  948    HG   LEU 117           HG       LEU 117   3.068  -1.680  -4.829
  949   1HD1  LEU 117          HD13      LEU 117   5.478  -2.155  -5.271
  950   2HD1  LEU 117          HD12      LEU 117   5.509  -0.803  -6.400
  951   3HD1  LEU 117          HD11      LEU 117   5.203  -0.516  -4.687
  952   1HD2  LEU 117          HD23      LEU 117   1.924  -0.165  -6.494
  953   2HD2  LEU 117          HD22      LEU 117   2.996   0.675  -5.373
  954   3HD2  LEU 117          HD21      LEU 117   3.523   0.359  -7.025
  955    H    GLU 118           HN       GLU 118   1.937  -4.345  -8.779
  956    HA   GLU 118           HA       GLU 118   0.095  -2.533 -10.110
  957   1HB   GLU 118           HB2      GLU 118   1.304  -3.489 -11.781
  958   2HB   GLU 118           HB1      GLU 118   1.699  -4.901 -10.806
  959   1HG   GLU 118           HG2      GLU 118  -0.294  -6.020 -11.398
  960   2HG   GLU 118           HG1      GLU 118  -1.073  -4.531 -11.944
  961    NH1  ARG 119           NH2      ARG 119  -3.673 -10.782 -10.955
  962    NH2  ARG 119           NH1      ARG 119  -5.818 -10.068 -10.972
  963    H    ARG 119           HN       ARG 119  -0.130  -5.599  -8.424
  964    HA   ARG 119           HA       ARG 119  -2.900  -6.122  -9.186
  965   1HB   ARG 119           HB2      ARG 119  -1.183  -7.856  -8.490
  966   2HB   ARG 119           HB1      ARG 119  -1.334  -7.249  -6.842
  967   1HG   ARG 119           HG2      ARG 119  -3.035  -8.691  -6.601
  968   2HG   ARG 119           HG1      ARG 119  -3.962  -7.640  -7.672
  969   1HD   ARG 119           HD2      ARG 119  -2.340  -9.168  -9.385
  970   2HD   ARG 119           HD1      ARG 119  -2.915 -10.307  -8.174
  971    HE   ARG 119           HE       ARG 119  -5.177  -8.857  -8.935
  972   1HH1  ARG 119          HH21      ARG 119  -2.763 -10.802 -10.543
  973   2HH1  ARG 119          HH22      ARG 119  -3.851 -11.307 -11.787
  974   1HH2  ARG 119          HH11      ARG 119  -6.560  -9.533 -10.567
  975   2HH2  ARG 119          HH12      ARG 119  -5.981 -10.599 -11.804
  976    H    LEU 120           HN       LEU 120  -1.290  -4.275  -6.666
  977    HA   LEU 120           HA       LEU 120  -3.637  -4.137  -4.934
  978   1HB   LEU 120           HB2      LEU 120  -0.969  -3.401  -4.628
  979   2HB   LEU 120           HB1      LEU 120  -1.807  -1.857  -4.748
  980    HG   LEU 120           HG       LEU 120  -2.652  -4.099  -2.892
  981   1HD1  LEU 120          HD12      LEU 120  -0.383  -2.544  -2.637
  982   2HD1  LEU 120          HD11      LEU 120  -1.582  -1.617  -1.733
  983   3HD1  LEU 120          HD13      LEU 120  -1.251  -3.293  -1.298
  984   1HD2  LEU 120          HD21      LEU 120  -4.022  -1.839  -3.832
  985   2HD2  LEU 120          HD23      LEU 120  -4.448  -2.805  -2.421
  986   3HD2  LEU 120          HD22      LEU 120  -3.440  -1.369  -2.239
  987    H    LYS 121           HN       LYS 121  -2.107  -2.017  -7.342
  988    HA   LYS 121           HA       LYS 121  -3.893   0.165  -7.270
  989   1HB   LYS 121           HB2      LYS 121  -1.746  -0.454  -8.782
  990   2HB   LYS 121           HB1      LYS 121  -3.020  -0.831  -9.941
  991   1HG   LYS 121           HG2      LYS 121  -3.663   1.647  -8.654
  992   2HG   LYS 121           HG1      LYS 121  -2.003   1.732  -9.246
  993   1HD   LYS 121           HD2      LYS 121  -3.193   2.375 -11.145
  994   2HD   LYS 121           HD1      LYS 121  -3.031   0.637 -11.411
  995   1HE   LYS 121           HE2      LYS 121  -5.253   0.207 -10.724
  996   2HE   LYS 121           HE1      LYS 121  -5.409   1.781  -9.945
  997   1HZ   LYS 121           HZ2      LYS 121  -4.765   1.942 -12.740
  998   2HZ   LYS 121           HZ1      LYS 121  -6.256   1.180 -12.441
  999   3HZ   LYS 121           HZ3      LYS 121  -5.972   2.747 -11.856
 1000    H    THR 122           HN       THR 122  -4.051  -2.833  -9.116
 1001    HA   THR 122           HA       THR 122  -6.491  -2.378 -10.477
 1002    HB   THR 122           HB       THR 122  -6.364  -5.146  -9.766
 1003    HG1  THR 122           HG1      THR 122  -4.090  -5.265 -10.700
 1004   1HG2  THR 122          HG22      THR 122  -7.035  -4.114 -11.940
 1005   2HG2  THR 122          HG21      THR 122  -5.342  -3.717 -12.227
 1006   3HG2  THR 122          HG23      THR 122  -5.846  -5.404 -12.126
 1007    H    ILE 123           HN       ILE 123  -5.895  -3.878  -7.327
 1008    HA   ILE 123           HA       ILE 123  -8.565  -4.538  -6.642
 1009    HB   ILE 123           HB       ILE 123  -6.167  -3.780  -4.968
 1010   1HG1  ILE 123          HG12      ILE 123  -6.671  -6.018  -6.477
 1011   2HG1  ILE 123          HG11      ILE 123  -5.620  -5.989  -5.062
 1012   1HG2  ILE 123          HG23      ILE 123  -8.896  -4.772  -4.110
 1013   2HG2  ILE 123          HG22      ILE 123  -7.464  -4.880  -3.087
 1014   3HG2  ILE 123          HG21      ILE 123  -8.072  -3.303  -3.590
 1015   1HD1  ILE 123          HD12      ILE 123  -8.597  -6.519  -4.887
 1016   2HD1  ILE 123          HD11      ILE 123  -7.399  -7.804  -5.046
 1017   3HD1  ILE 123          HD13      ILE 123  -7.387  -6.757  -3.627
 1018    H    MET 124           HN       MET 124  -6.865  -1.459  -6.412
 1019    HA   MET 124           HA       MET 124  -8.815  -0.203  -4.675
 1020   1HB   MET 124           HB2      MET 124  -6.883   1.180  -6.542
 1021   2HB   MET 124           HB1      MET 124  -7.631   1.848  -5.094
 1022   1HG   MET 124           HG2      MET 124  -6.042  -0.653  -4.762
 1023   2HG   MET 124           HG1      MET 124  -5.156   0.833  -5.080
 1024   1HE   MET 124           HE1      MET 124  -5.685   2.867  -4.232
 1025   2HE   MET 124           HE3      MET 124  -6.994   3.204  -3.092
 1026   3HE   MET 124           HE2      MET 124  -5.337   3.061  -2.516
 1027    NH1  ARG 125           NH2      ARG 125 -12.498   0.979 -14.468
 1028    NH2  ARG 125           NH1      ARG 125 -13.868   2.646 -13.798
 1029    H    ARG 125           HN       ARG 125  -8.239  -0.035  -8.188
 1030    HA   ARG 125           HA       ARG 125 -10.377   1.834  -8.643
 1031   1HB   ARG 125           HB2      ARG 125  -8.340   1.108 -10.158
 1032   2HB   ARG 125           HB1      ARG 125  -9.493  -0.076 -10.773
 1033   1HG   ARG 125           HG2      ARG 125 -10.690   2.569 -10.537
 1034   2HG   ARG 125           HG1      ARG 125  -9.276   2.585 -11.591
 1035   1HD   ARG 125           HD2      ARG 125 -10.267   1.249 -13.162
 1036   2HD   ARG 125           HD1      ARG 125 -11.140   0.304 -11.957
 1037    HE   ARG 125           HE       ARG 125 -12.349   2.804 -11.883
 1038   1HH1  ARG 125          HH21      ARG 125 -11.694   0.403 -14.330
 1039   2HH1  ARG 125          HH22      ARG 125 -13.069   0.846 -15.278
 1040   1HH2  ARG 125          HH11      ARG 125 -14.117   3.354 -13.138
 1041   2HH2  ARG 125          HH12      ARG 125 -14.430   2.503 -14.613
 1042    H    GLU 126           HN       GLU 126 -10.340  -1.648  -8.297
 1043    HA   GLU 126           HA       GLU 126 -12.999  -1.895  -9.555
 1044   1HB   GLU 126           HB2      GLU 126 -10.811  -3.605  -9.230
 1045   2HB   GLU 126           HB1      GLU 126 -12.070  -4.277  -8.191
 1046   1HG   GLU 126           HG2      GLU 126 -13.670  -4.135 -10.100
 1047   2HG   GLU 126           HG1      GLU 126 -12.346  -3.586 -11.130
 1048    H    LYS 127           HN       LYS 127 -11.639  -2.141  -6.265
 1049    HA   LYS 127           HA       LYS 127 -14.284  -2.897  -5.207
 1050   1HB   LYS 127           HB2      LYS 127 -11.545  -2.587  -4.003
 1051   2HB   LYS 127           HB1      LYS 127 -12.972  -2.817  -2.991
 1052   1HG   LYS 127           HG2      LYS 127 -13.320  -4.750  -4.914
 1053   2HG   LYS 127           HG1      LYS 127 -11.568  -4.744  -4.714
 1054   1HD   LYS 127           HD2      LYS 127 -12.278  -4.651  -2.121
 1055   2HD   LYS 127           HD1      LYS 127 -13.695  -5.486  -2.763
 1056   1HE   LYS 127           HE2      LYS 127 -10.889  -6.362  -3.463
 1057   2HE   LYS 127           HE1      LYS 127 -11.715  -6.956  -2.024
 1058   1HZ   LYS 127           HZ3      LYS 127 -13.312  -7.046  -4.416
 1059   2HZ   LYS 127           HZ2      LYS 127 -11.931  -8.036  -4.479
 1060   3HZ   LYS 127           HZ1      LYS 127 -13.066  -8.236  -3.232
 1061    OH   TYR 128           OH       TYR 128 -13.032   5.409  -9.231
 1062    H    TYR 128           HN       TYR 128 -12.315   0.039  -5.316
 1063    HA   TYR 128           HA       TYR 128 -13.722   1.353  -3.169
 1064   1HB   TYR 128           HB2      TYR 128 -12.357   3.139  -3.574
 1065   2HB   TYR 128           HB1      TYR 128 -11.443   1.920  -4.457
 1066    HD1  TYR 128           HD2      TYR 128 -12.432   1.509  -6.957
 1067    HD2  TYR 128           HD1      TYR 128 -12.732   5.142  -4.687
 1068    HE1  TYR 128           HE2      TYR 128 -12.708   2.794  -9.055
 1069    HE2  TYR 128           HE1      TYR 128 -13.016   6.430  -6.787
 1070    HH   TYR 128           HH       TYR 128 -13.305   6.301  -9.003
 1071    H    SER 129           HN       SER 129 -14.866   0.522  -6.245
 1072    HA   SER 129           HA       SER 129 -16.607   2.900  -6.471
 1073   1HB   SER 129           HB2      SER 129 -17.422   1.779  -8.547
 1074   2HB   SER 129           HB1      SER 129 -15.682   2.054  -8.549
 1075    HG   SER 129           HG       SER 129 -17.131  -0.300  -8.453
 1076    H    LYS 130           HN       LYS 130 -16.825   0.658  -4.316
 1077    HA   LYS 130           HA       LYS 130 -19.723   0.113  -4.815
 1078   1HB   LYS 130           HB2      LYS 130 -17.536  -1.708  -4.188
 1079   2HB   LYS 130           HB1      LYS 130 -18.832  -1.826  -3.001
 1080   1HG   LYS 130           HG2      LYS 130 -20.255  -1.705  -5.342
 1081   2HG   LYS 130           HG1      LYS 130 -18.821  -2.596  -5.845
 1082   1HD   LYS 130           HD2      LYS 130 -19.151  -4.165  -3.950
 1083   2HD   LYS 130           HD1      LYS 130 -20.622  -3.297  -3.507
 1084   1HE   LYS 130           HE2      LYS 130 -21.761  -3.980  -5.445
 1085   2HE   LYS 130           HE1      LYS 130 -20.267  -4.367  -6.300
 1086   1HZ   LYS 130           HZ2      LYS 130 -20.961  -5.824  -3.841
 1087   2HZ   LYS 130           HZ1      LYS 130 -21.701  -6.256  -5.308
 1088   3HZ   LYS 130           HZ3      LYS 130 -20.012  -6.327  -5.158
 1089    H    CYS 131           HN       CYS 131 -18.856   2.448  -3.505
 1090    HA   CYS 131           HA       CYS 131 -19.054   1.906  -0.608
 1091   1HB   CYS 131           HB2      CYS 131 -17.534   3.684  -1.565
 1092   2HB   CYS 131           HB1      CYS 131 -18.984   4.601  -1.977
 1093    H    SER 132           HN       SER 132 -21.307   2.366  -3.105
 1094    HA   SER 132           HA       SER 132 -23.217   3.925  -1.536
 1095   1HB   SER 132           HB2      SER 132 -24.712   3.637  -3.394
 1096   2HB   SER 132           HB1      SER 132 -23.107   3.902  -4.068
 1097    HG   SER 132           HG       SER 132 -24.564   1.493  -3.800
 1098    H    SER 133           HN       SER 133 -25.528   2.891  -1.341
 1099    HA   SER 133           HA       SER 133 -25.286   0.060  -0.421
 1100   1HB   SER 133           HB2      SER 133 -26.802   0.733   1.511
 1101   2HB   SER 133           HB1      SER 133 -25.154   1.349   1.601
 1102    HG   SER 133           HG       SER 133 -27.556   2.670   1.158
   
  Start of MODEL          16
 Raw file had 1102 H/Q atoms
  Start of MODEL   16
    1   1H    GLU   1           HT1      GLU   1 -18.750  21.514   1.239
    2   2H    GLU   1           HT3      GLU   1 -17.778  20.819   2.444
    3   3H    GLU   1           HT2      GLU   1 -17.101  21.915   1.336
    4    HA   GLU   1           HA       GLU   1 -17.335  20.403  -0.458
    5   1HB   GLU   1           HB2      GLU   1 -15.909  19.725   1.988
    6   2HB   GLU   1           HB1      GLU   1 -16.335  18.279   1.070
    7   1HG   GLU   1           HG2      GLU   1 -15.458  19.663  -0.983
    8   2HG   GLU   1           HG1      GLU   1 -14.616  20.602   0.251
    9    H    ALA   2           HN       ALA   2 -17.740  17.897  -0.839
   10    HA   ALA   2           HA       ALA   2 -20.560  17.456  -0.392
   11   1HB   ALA   2           HB3      ALA   2 -18.337  15.756  -1.529
   12   2HB   ALA   2           HB2      ALA   2 -19.977  15.135  -1.345
   13   3HB   ALA   2           HB1      ALA   2 -19.673  16.525  -2.388
   14    H    GLU   3           HN       GLU   3 -20.915  17.361   1.865
   15    HA   GLU   3           HA       GLU   3 -19.371  15.631   3.604
   16   1HB   GLU   3           HB2      GLU   3 -20.727  17.672   4.311
   17   2HB   GLU   3           HB1      GLU   3 -22.167  16.675   4.109
   18   1HG   GLU   3           HG2      GLU   3 -21.003  14.982   5.660
   19   2HG   GLU   3           HG1      GLU   3 -19.892  16.294   6.057
   20    H    ALA   4           HN       ALA   4 -19.588  13.448   3.794
   21    HA   ALA   4           HA       ALA   4 -22.161  12.129   3.659
   22   1HB   ALA   4           HB3      ALA   4 -21.417  12.657   1.196
   23   2HB   ALA   4           HB2      ALA   4 -20.314  11.303   1.438
   24   3HB   ALA   4           HB1      ALA   4 -22.055  11.061   1.585
   25    H    HIS   5           HN       HIS   5 -21.237   9.550   2.929
   26    HA   HIS   5           HA       HIS   5 -19.857   8.799   5.366
   27   1HB   HIS   5           HB2      HIS   5 -21.571   7.460   3.857
   28   2HB   HIS   5           HB1      HIS   5 -20.104   6.938   3.027
   29    HD1  HIS   5           HD1      HIS   5 -21.897   6.695   6.318
   30    HD2  HIS   5           HD2      HIS   5 -18.396   5.258   4.569
   31    HE1  HIS   5           HE1      HIS   5 -21.008   4.899   7.866
   32    H    LYS   6           HN       LYS   6 -17.735   7.904   5.534
   33    HA   LYS   6           HA       LYS   6 -15.861   8.932   3.489
   34   1HB   LYS   6           HB2      LYS   6 -15.453   7.708   6.232
   35   2HB   LYS   6           HB1      LYS   6 -14.125   8.183   5.172
   36   1HG   LYS   6           HG2      LYS   6 -14.454  10.405   5.544
   37   2HG   LYS   6           HG1      LYS   6 -16.210  10.243   5.544
   38   1HD   LYS   6           HD2      LYS   6 -16.234   9.480   7.812
   39   2HD   LYS   6           HD1      LYS   6 -14.484   9.257   7.824
   40   1HE   LYS   6           HE2      LYS   6 -15.294  11.361   8.984
   41   2HE   LYS   6           HE1      LYS   6 -14.099  11.627   7.713
   42   1HZ   LYS   6           HZ3      LYS   6 -16.937  11.662   6.990
   43   2HZ   LYS   6           HZ2      LYS   6 -16.299  13.010   7.803
   44   3HZ   LYS   6           HZ1      LYS   6 -15.640  12.520   6.315
   45    H    CYS   7           HN       CYS   7 -16.934   7.140   2.053
   46    HA   CYS   7           HA       CYS   7 -15.385   4.604   2.425
   47   1HB   CYS   7           HB2      CYS   7 -17.698   4.051   2.661
   48   2HB   CYS   7           HB1      CYS   7 -18.155   5.076   1.301
   49    H    ASP   8           HN       ASP   8 -17.010   6.524  -0.131
   50    HA   ASP   8           HA       ASP   8 -15.056   5.530  -2.103
   51   1HB   ASP   8           HB2      ASP   8 -17.498   5.791  -2.645
   52   2HB   ASP   8           HB1      ASP   8 -17.296   7.536  -2.481
   53    H    ILE   9           HN       ILE   9 -15.715   8.435  -0.249
   54    HA   ILE   9           HA       ILE   9 -14.080  10.215  -1.820
   55    HB   ILE   9           HB       ILE   9 -14.702  10.409   1.141
   56   1HG1  ILE   9          HG12      ILE   9 -16.790  10.106  -0.072
   57   2HG1  ILE   9          HG11      ILE   9 -16.640  11.807   0.366
   58   1HG2  ILE   9          HG21      ILE   9 -13.056  11.959  -0.435
   59   2HG2  ILE   9          HG23      ILE   9 -14.591  12.824  -0.532
   60   3HG2  ILE   9          HG22      ILE   9 -13.853  12.509   1.039
   61   1HD1  ILE   9          HD11      ILE   9 -15.430  11.924  -2.015
   62   2HD1  ILE   9          HD13      ILE   9 -16.447  10.516  -2.319
   63   3HD1  ILE   9          HD12      ILE   9 -17.183  12.052  -1.863
   64    H    THR  10           HN       THR  10 -13.426   8.546   1.287
   65    HA   THR  10           HA       THR  10 -10.692   9.318   1.451
   66    HB   THR  10           HB       THR  10 -11.816   6.707   2.483
   67    HG1  THR  10           HG1      THR  10 -13.218   8.140   3.271
   68   1HG2  THR  10          HG21      THR  10  -9.635   8.583   3.432
   69   2HG2  THR  10          HG23      THR  10 -10.188   7.164   4.320
   70   3HG2  THR  10          HG22      THR  10  -9.410   6.973   2.749
   71    H    LEU  11           HN       LEU  11 -12.220   6.495  -0.100
   72    HA   LEU  11           HA       LEU  11  -9.725   5.232  -0.816
   73   1HB   LEU  11           HB2      LEU  11 -12.571   4.809  -1.343
   74   2HB   LEU  11           HB1      LEU  11 -11.557   4.447  -2.738
   75    HG   LEU  11           HG       LEU  11 -10.540   3.444  -0.162
   76   1HD1  LEU  11          HD11      LEU  11 -13.252   3.077  -0.648
   77   2HD1  LEU  11          HD13      LEU  11 -12.514   1.604  -1.279
   78   3HD1  LEU  11          HD12      LEU  11 -12.249   2.073   0.399
   79   1HD2  LEU  11          HD23      LEU  11 -10.311   2.930  -2.984
   80   2HD2  LEU  11          HD22      LEU  11  -9.320   2.301  -1.668
   81   3HD2  LEU  11          HD21      LEU  11 -10.782   1.446  -2.157
   82    H    GLN  12           HN       GLN  12 -11.572   7.852  -2.209
   83    HA   GLN  12           HA       GLN  12 -10.467   7.668  -4.867
   84   1HB   GLN  12           HB2      GLN  12 -12.086   9.602  -3.330
   85   2HB   GLN  12           HB1      GLN  12 -11.082  10.312  -4.595
   86   1HG   GLN  12           HG2      GLN  12 -12.056   8.228  -5.977
   87   2HG   GLN  12           HG1      GLN  12 -13.383   8.434  -4.833
   88   1HE2  GLN  12          HE22      GLN  12 -14.132  10.681  -7.689
   89   2HE2  GLN  12          HE21      GLN  12 -14.031   9.006  -7.438
   90    H    GLU  13           HN       GLU  13  -9.750   9.984  -2.234
   91    HA   GLU  13           HA       GLU  13  -7.426  11.063  -3.481
   92   1HB   GLU  13           HB2      GLU  13  -6.789  11.741  -1.114
   93   2HB   GLU  13           HB1      GLU  13  -8.380  12.277  -1.650
   94   1HG   GLU  13           HG2      GLU  13  -8.778   9.718  -0.525
   95   2HG   GLU  13           HG1      GLU  13  -7.698  10.565   0.578
   96    H    ILE  14           HN       ILE  14  -7.869   8.235  -1.429
   97    HA   ILE  14           HA       ILE  14  -5.051   7.739  -1.022
   98    HB   ILE  14           HB       ILE  14  -7.598   6.383  -0.435
   99   1HG1  ILE  14          HG12      ILE  14  -6.070   5.695   1.567
  100   2HG1  ILE  14          HG11      ILE  14  -4.927   6.848   0.876
  101   1HG2  ILE  14          HG23      ILE  14  -5.091   4.809  -1.068
  102   2HG2  ILE  14          HG22      ILE  14  -6.393   4.179  -0.058
  103   3HG2  ILE  14          HG21      ILE  14  -6.706   4.592  -1.742
  104   1HD1  ILE  14          HD11      ILE  14  -7.325   8.234   0.813
  105   2HD1  ILE  14          HD13      ILE  14  -7.421   7.343   2.331
  106   3HD1  ILE  14          HD12      ILE  14  -6.064   8.429   2.032
  107    H    ILE  15           HN       ILE  15  -7.328   6.972  -3.573
  108    HA   ILE  15           HA       ILE  15  -5.743   4.884  -4.799
  109    HB   ILE  15           HB       ILE  15  -8.105   6.531  -5.560
  110   1HG1  ILE  15          HG12      ILE  15  -7.410   3.588  -5.903
  111   2HG1  ILE  15          HG11      ILE  15  -8.280   4.263  -4.525
  112   1HG2  ILE  15          HG22      ILE  15  -6.193   5.267  -7.531
  113   2HG2  ILE  15          HG21      ILE  15  -7.893   5.531  -7.918
  114   3HG2  ILE  15          HG23      ILE  15  -6.849   6.904  -7.547
  115   1HD1  ILE  15          HD12      ILE  15  -9.975   5.176  -6.179
  116   2HD1  ILE  15          HD11      ILE  15  -9.174   4.207  -7.416
  117   3HD1  ILE  15          HD13      ILE  15  -9.940   3.418  -6.037
  118    H    LYS  16           HN       LYS  16  -6.079   8.384  -5.343
  119    HA   LYS  16           HA       LYS  16  -4.291   8.613  -7.533
  120   1HB   LYS  16           HB2      LYS  16  -5.636  10.385  -5.751
  121   2HB   LYS  16           HB1      LYS  16  -3.932  10.839  -5.745
  122   1HG   LYS  16           HG2      LYS  16  -4.044  11.662  -7.848
  123   2HG   LYS  16           HG1      LYS  16  -4.917  10.246  -8.436
  124   1HD   LYS  16           HD2      LYS  16  -6.283  12.305  -8.631
  125   2HD   LYS  16           HD1      LYS  16  -7.017  11.138  -7.530
  126   1HE   LYS  16           HE2      LYS  16  -6.010  12.346  -5.608
  127   2HE   LYS  16           HE1      LYS  16  -5.343  13.536  -6.725
  128   1HZ   LYS  16           HZ1      LYS  16  -8.056  13.244  -7.303
  129   2HZ   LYS  16           HZ3      LYS  16  -7.920  13.430  -5.623
  130   3HZ   LYS  16           HZ2      LYS  16  -7.262  14.603  -6.661
  131    H    THR  17           HN       THR  17  -3.640   8.928  -4.041
  132    HA   THR  17           HA       THR  17  -0.827   9.220  -4.189
  133    HB   THR  17           HB       THR  17  -2.189   7.575  -2.054
  134    HG1  THR  17           HG1      THR  17  -3.412   9.228  -1.705
  135   1HG2  THR  17          HG22      THR  17   0.392   8.753  -2.438
  136   2HG2  THR  17          HG21      THR  17  -0.398   9.568  -1.088
  137   3HG2  THR  17          HG23      THR  17  -0.189   7.817  -1.061
  138    H    LEU  18           HN       LEU  18  -2.880   6.368  -4.433
  139    HA   LEU  18           HA       LEU  18  -0.976   4.323  -4.136
  140   1HB   LEU  18           HB2      LEU  18  -3.591   4.334  -4.766
  141   2HB   LEU  18           HB1      LEU  18  -2.921   4.032  -6.367
  142    HG   LEU  18           HG       LEU  18  -2.682   2.354  -3.877
  143   1HD1  LEU  18          HD12      LEU  18  -4.404   2.105  -5.843
  144   2HD1  LEU  18          HD11      LEU  18  -3.035   1.411  -6.708
  145   3HD1  LEU  18          HD13      LEU  18  -3.599   0.669  -5.212
  146   1HD2  LEU  18          HD21      LEU  18  -0.802   2.435  -6.251
  147   2HD2  LEU  18          HD23      LEU  18  -0.384   2.511  -4.538
  148   3HD2  LEU  18          HD22      LEU  18  -0.977   1.007  -5.235
  149    H    ASN  19           HN       ASN  19  -1.984   5.896  -7.191
  150    HA   ASN  19           HA       ASN  19  -0.020   4.682  -8.846
  151   1HB   ASN  19           HB2      ASN  19  -1.757   7.094  -9.016
  152   2HB   ASN  19           HB1      ASN  19  -0.366   7.046 -10.098
  153   1HD2  ASN  19          HD22      ASN  19  -3.537   5.066 -11.276
  154   2HD2  ASN  19          HD21      ASN  19  -3.513   6.453 -10.296
  155    H    SER  20           HN       SER  20   0.204   7.408  -6.640
  156    HA   SER  20           HA       SER  20   2.608   8.556  -7.690
  157   1HB   SER  20           HB2      SER  20   1.627   8.490  -4.823
  158   2HB   SER  20           HB1      SER  20   2.871   9.564  -5.454
  159    HG   SER  20           HG       SER  20   1.321  10.466  -6.824
  160    H    LEU  21           HN       LEU  21   2.077   5.975  -5.290
  161    HA   LEU  21           HA       LEU  21   4.882   5.639  -4.691
  162   1HB   LEU  21           HB2      LEU  21   2.429   3.936  -4.261
  163   2HB   LEU  21           HB1      LEU  21   4.036   3.328  -3.868
  164    HG   LEU  21           HG       LEU  21   4.248   5.679  -2.647
  165   1HD1  LEU  21          HD12      LEU  21   1.271   5.105  -2.702
  166   2HD1  LEU  21          HD11      LEU  21   2.043   6.242  -1.595
  167   3HD1  LEU  21          HD13      LEU  21   2.080   6.540  -3.333
  168   1HD2  LEU  21          HD23      LEU  21   2.956   3.117  -1.740
  169   2HD2  LEU  21          HD22      LEU  21   4.552   3.754  -1.349
  170   3HD2  LEU  21          HD21      LEU  21   3.116   4.469  -0.618
  171    H    THR  22           HN       THR  22   3.001   4.726  -7.426
  172    HA   THR  22           HA       THR  22   4.593   2.369  -8.089
  173    HB   THR  22           HB       THR  22   3.113   3.689 -10.271
  174    HG1  THR  22           HG1      THR  22   1.104   3.028  -9.248
  175   1HG2  THR  22          HG21      THR  22   3.373   0.966  -9.026
  176   2HG2  THR  22          HG23      THR  22   2.057   1.300 -10.152
  177   3HG2  THR  22          HG22      THR  22   3.733   1.471 -10.677
  178    H    GLU  23           HN       GLU  23   4.904   5.792  -8.610
  179    HA   GLU  23           HA       GLU  23   6.369   5.873 -11.011
  180   1HB   GLU  23           HB2      GLU  23   5.740   7.678  -8.976
  181   2HB   GLU  23           HB1      GLU  23   7.504   7.647  -9.000
  182   1HG   GLU  23           HG2      GLU  23   7.073   9.252 -10.629
  183   2HG   GLU  23           HG1      GLU  23   7.169   7.792 -11.614
  184    H    GLN  24           HN       GLN  24   7.551   5.228  -7.716
  185    HA   GLN  24           HA       GLN  24  10.119   4.282  -8.949
  186   1HB   GLN  24           HB2      GLN  24   9.800   5.293  -6.115
  187   2HB   GLN  24           HB1      GLN  24  11.296   5.038  -7.014
  188   1HG   GLN  24           HG2      GLN  24  10.307   6.785  -8.681
  189   2HG   GLN  24           HG1      GLN  24   9.251   7.222  -7.338
  190   1HE2  GLN  24          HE22      GLN  24  11.992   9.436  -6.609
  191   2HE2  GLN  24          HE21      GLN  24  10.507   9.350  -7.427
  192    H    LYS  25           HN       LYS  25   8.034   2.497  -8.814
  193    HA   LYS  25           HA       LYS  25   8.887   0.757  -6.545
  194   1HB   LYS  25           HB2      LYS  25   6.253   1.711  -7.166
  195   2HB   LYS  25           HB1      LYS  25   6.291  -0.036  -7.394
  196   1HG   LYS  25           HG2      LYS  25   5.717   0.613  -5.047
  197   2HG   LYS  25           HG1      LYS  25   7.183  -0.357  -5.148
  198   1HD   LYS  25           HD2      LYS  25   8.589   1.516  -4.787
  199   2HD   LYS  25           HD1      LYS  25   7.296   2.659  -5.136
  200   1HE   LYS  25           HE2      LYS  25   6.727   0.786  -2.926
  201   2HE   LYS  25           HE1      LYS  25   8.050   1.909  -2.615
  202   1HZ   LYS  25           HZ3      LYS  25   6.013   3.359  -3.822
  203   2HZ   LYS  25           HZ2      LYS  25   5.279   2.407  -2.622
  204   3HZ   LYS  25           HZ1      LYS  25   6.547   3.462  -2.217
  205    H    THR  26           HN       THR  26  10.458   0.196  -8.264
  206    HA   THR  26           HA       THR  26   9.466  -2.148  -9.785
  207    HB   THR  26           HB       THR  26  11.162  -1.265 -11.633
  208    HG1  THR  26           HG1      THR  26  11.830   0.624 -10.920
  209   1HG2  THR  26          HG22      THR  26   8.366  -1.279 -11.301
  210   2HG2  THR  26          HG21      THR  26   8.758   0.307 -11.964
  211   3HG2  THR  26          HG23      THR  26   9.254  -1.153 -12.819
  212    H    LEU  27           HN       LEU  27  12.268  -0.166  -8.866
  213    HA   LEU  27           HA       LEU  27  14.042  -2.520  -8.810
  214   1HB   LEU  27           HB2      LEU  27  14.538   0.049  -9.421
  215   2HB   LEU  27           HB1      LEU  27  14.829   0.143  -7.686
  216    HG   LEU  27           HG       LEU  27  16.927  -0.380  -8.820
  217   1HD1  LEU  27          HD12      LEU  27  16.104  -1.598  -6.635
  218   2HD1  LEU  27          HD11      LEU  27  16.074  -3.021  -7.677
  219   3HD1  LEU  27          HD13      LEU  27  17.580  -2.137  -7.435
  220   1HD2  LEU  27          HD22      LEU  27  15.433  -1.622 -10.692
  221   2HD2  LEU  27          HD21      LEU  27  17.148  -1.966 -10.470
  222   3HD2  LEU  27          HD23      LEU  27  15.937  -3.029  -9.755
  223    H    CYS  28           HN       CYS  28  12.325  -0.371  -6.604
  224    HA   CYS  28           HA       CYS  28  13.542  -1.561  -4.220
  225   1HB   CYS  28           HB2      CYS  28  12.179   0.811  -4.757
  226   2HB   CYS  28           HB1      CYS  28  11.042  -0.120  -3.781
  227    H    THR  29           HN       THR  29  10.775  -2.181  -6.253
  228    HA   THR  29           HA       THR  29   9.237  -3.656  -4.305
  229    HB   THR  29           HB       THR  29   7.986  -4.496  -6.253
  230    HG1  THR  29           HG1      THR  29   9.676  -3.024  -7.925
  231   1HG2  THR  29          HG23      THR  29   8.762  -1.573  -6.307
  232   2HG2  THR  29          HG22      THR  29   7.424  -2.240  -7.244
  233   3HG2  THR  29          HG21      THR  29   7.383  -2.301  -5.484
  234    H    GLU  30           HN       GLU  30  12.184  -4.380  -5.824
  235    HA   GLU  30           HA       GLU  30  11.927  -7.173  -6.301
  236   1HB   GLU  30           HB2      GLU  30  14.346  -7.191  -6.298
  237   2HB   GLU  30           HB1      GLU  30  13.819  -5.678  -7.036
  238   1HG   GLU  30           HG2      GLU  30  14.098  -4.540  -4.843
  239   2HG   GLU  30           HG1      GLU  30  14.720  -6.045  -4.164
  240    H    LEU  31           HN       LEU  31  11.870  -5.458  -3.320
  241    HA   LEU  31           HA       LEU  31  12.924  -7.680  -1.728
  242   1HB   LEU  31           HB2      LEU  31  11.563  -5.121  -0.822
  243   2HB   LEU  31           HB1      LEU  31  12.476  -6.238   0.192
  244    HG   LEU  31           HG       LEU  31  13.903  -5.215  -2.199
  245   1HD1  LEU  31          HD13      LEU  31  13.188  -3.461   0.169
  246   2HD1  LEU  31          HD12      LEU  31  14.477  -3.094  -0.976
  247   3HD1  LEU  31          HD11      LEU  31  12.803  -3.161  -1.527
  248   1HD2  LEU  31          HD21      LEU  31  14.513  -5.750   0.715
  249   2HD2  LEU  31          HD23      LEU  31  15.121  -6.613  -0.698
  250   3HD2  LEU  31          HD22      LEU  31  15.678  -4.975  -0.358
  251    H    THR  32           HN       THR  32  11.389  -9.223  -2.447
  252    HA   THR  32           HA       THR  32   8.706  -9.398  -2.623
  253    HB   THR  32           HB       THR  32   8.952 -11.632  -1.223
  254    HG1  THR  32           HG1      THR  32  10.854 -11.880  -0.412
  255   1HG2  THR  32          HG23      THR  32   9.865 -10.797  -3.894
  256   2HG2  THR  32          HG22      THR  32  10.618 -12.282  -3.311
  257   3HG2  THR  32          HG21      THR  32   8.861 -12.169  -3.426
  258    H    VAL  33           HN       VAL  33   6.857  -9.398  -1.326
  259    HA   VAL  33           HA       VAL  33   7.273  -8.753   1.560
  260    HB   VAL  33           HB       VAL  33   5.121  -7.340   1.245
  261   1HG1  VAL  33          HG13      VAL  33   7.393  -6.422   1.645
  262   2HG1  VAL  33          HG12      VAL  33   7.703  -6.472  -0.090
  263   3HG1  VAL  33          HG11      VAL  33   6.456  -5.403   0.553
  264   1HG2  VAL  33          HG21      VAL  33   5.021  -8.420  -1.201
  265   2HG2  VAL  33          HG23      VAL  33   4.448  -6.780  -0.901
  266   3HG2  VAL  33          HG22      VAL  33   6.052  -7.041  -1.584
  267    H    THR  34           HN       THR  34   3.947  -8.800   0.645
  268    HA   THR  34           HA       THR  34   3.750 -11.699   1.288
  269    HB   THR  34           HB       THR  34   3.071  -9.537   3.032
  270    HG1  THR  34           HG1      THR  34   2.868 -12.335   3.004
  271   1HG2  THR  34          HG21      THR  34   0.906  -9.433   1.845
  272   2HG2  THR  34          HG23      THR  34   0.678 -11.163   2.119
  273   3HG2  THR  34          HG22      THR  34   0.706 -10.049   3.484
  274    H    ASP  35           HN       ASP  35   1.692 -12.639   0.594
  275    HA   ASP  35           HA       ASP  35   0.461 -11.082  -1.640
  276   1HB   ASP  35           HB2      ASP  35   1.615 -13.515  -1.814
  277   2HB   ASP  35           HB1      ASP  35  -0.022 -14.008  -1.381
  278    H    ILE  36           HN       ILE  36  -1.316 -10.069  -0.737
  279    HA   ILE  36           HA       ILE  36  -3.027 -11.631   1.119
  280    HB   ILE  36           HB       ILE  36  -3.955  -9.573   1.818
  281   1HG1  ILE  36          HG12      ILE  36  -2.893  -8.499  -0.808
  282   2HG1  ILE  36          HG11      ILE  36  -4.572  -8.579  -0.275
  283   1HG2  ILE  36          HG23      ILE  36  -1.332  -9.976   2.070
  284   2HG2  ILE  36          HG22      ILE  36  -1.256  -8.523   1.072
  285   3HG2  ILE  36          HG21      ILE  36  -2.085  -8.481   2.629
  286   1HD1  ILE  36          HD11      ILE  36  -3.421  -7.128   1.749
  287   2HD1  ILE  36          HD13      ILE  36  -2.502  -6.578   0.347
  288   3HD1  ILE  36          HD12      ILE  36  -4.259  -6.425   0.365
  289    H    PHE  37           HN       PHE  37  -2.867 -11.949  -1.931
  290    HA   PHE  37           HA       PHE  37  -5.803 -11.639  -2.409
  291   1HB   PHE  37           HB2      PHE  37  -3.625 -11.373  -4.506
  292   2HB   PHE  37           HB1      PHE  37  -5.354 -11.120  -4.741
  293    HD1  PHE  37           HD2      PHE  37  -6.466  -9.348  -3.122
  294    HD2  PHE  37           HD1      PHE  37  -2.273  -9.530  -4.033
  295    HE1  PHE  37           HE2      PHE  37  -6.215  -6.978  -2.436
  296    HE2  PHE  37           HE1      PHE  37  -2.021  -7.160  -3.347
  297    HZ   PHE  37           HZ       PHE  37  -3.992  -5.884  -2.549
  298    H    ALA  38           HN       ALA  38  -4.465 -13.951  -1.337
  299    HA   ALA  38           HA       ALA  38  -4.425 -15.821  -3.657
  300   1HB   ALA  38           HB2      ALA  38  -2.878 -15.618  -1.269
  301   2HB   ALA  38           HB1      ALA  38  -3.782 -17.131  -1.197
  302   3HB   ALA  38           HB3      ALA  38  -2.722 -16.802  -2.567
  303    H    ALA  39           HN       ALA  39  -6.198 -15.058  -0.724
  304    HA   ALA  39           HA       ALA  39  -8.193 -17.123  -1.523
  305   1HB   ALA  39           HB2      ALA  39  -6.817 -18.065   0.310
  306   2HB   ALA  39           HB1      ALA  39  -7.219 -16.672   1.314
  307   3HB   ALA  39           HB3      ALA  39  -8.483 -17.798   0.823
  308    H    SER  40           HN       SER  40  -9.834 -15.748  -2.120
  309    HA   SER  40           HA       SER  40 -10.580 -13.580  -0.199
  310   1HB   SER  40           HB2      SER  40 -10.100 -13.358  -2.890
  311   2HB   SER  40           HB1      SER  40 -11.846 -13.593  -2.868
  312    HG   SER  40           HG       SER  40 -11.247 -11.385  -2.652
  313    H    LYS  41           HN       LYS  41 -12.036 -14.591   1.173
  314    HA   LYS  41           HA       LYS  41 -14.341 -15.975  -0.145
  315   1HB   LYS  41           HB2      LYS  41 -12.865 -16.603   2.412
  316   2HB   LYS  41           HB1      LYS  41 -14.508 -17.185   2.132
  317   1HG   LYS  41           HG2      LYS  41 -12.376 -17.606   0.049
  318   2HG   LYS  41           HG1      LYS  41 -12.508 -18.705   1.422
  319   1HD   LYS  41           HD2      LYS  41 -15.051 -18.770   0.780
  320   2HD   LYS  41           HD1      LYS  41 -14.481 -18.197  -0.787
  321   1HE   LYS  41           HE2      LYS  41 -12.913 -20.431   0.326
  322   2HE   LYS  41           HE1      LYS  41 -14.586 -20.836  -0.051
  323   1HZ   LYS  41           HZ1      LYS  41 -13.292 -19.244  -2.067
  324   2HZ   LYS  41           HZ3      LYS  41 -12.566 -20.760  -1.838
  325   3HZ   LYS  41           HZ2      LYS  41 -14.216 -20.661  -2.228
  326    H    ASP  42           HN       ASP  42 -13.479 -14.368   2.954
  327    HA   ASP  42           HA       ASP  42 -16.145 -13.018   2.805
  328   1HB   ASP  42           HB2      ASP  42 -15.394 -13.196   5.524
  329   2HB   ASP  42           HB1      ASP  42 -16.712 -14.050   4.721
  330    H    THR  43           HN       THR  43 -13.400 -12.090   2.020
  331    HA   THR  43           HA       THR  43 -12.970  -9.951   4.050
  332    HB   THR  43           HB       THR  43 -10.926  -9.520   2.444
  333    HG1  THR  43           HG1      THR  43 -10.440 -11.145   1.144
  334   1HG2  THR  43          HG23      THR  43 -11.393 -11.222   4.717
  335   2HG2  THR  43          HG22      THR  43 -10.163 -11.948   3.683
  336   3HG2  THR  43          HG21      THR  43  -9.942 -10.311   4.301
  337    H    THR  44           HN       THR  44 -13.776  -7.954   3.623
  338    HA   THR  44           HA       THR  44 -14.853  -7.417   0.923
  339    HB   THR  44           HB       THR  44 -15.060  -5.315   2.987
  340    HG1  THR  44           HG1      THR  44 -16.850  -6.807   3.849
  341   1HG2  THR  44          HG23      THR  44 -16.406  -6.164   0.662
  342   2HG2  THR  44          HG22      THR  44 -17.529  -6.436   1.994
  343   3HG2  THR  44          HG21      THR  44 -16.853  -4.829   1.724
  344    H    GLU  45           HN       GLU  45 -14.599  -4.587   0.946
  345    HA   GLU  45           HA       GLU  45 -11.877  -4.353  -0.052
  346   1HB   GLU  45           HB2      GLU  45 -12.501  -2.070  -0.627
  347   2HB   GLU  45           HB1      GLU  45 -13.823  -3.150  -1.064
  348   1HG   GLU  45           HG2      GLU  45 -14.860  -2.617   1.193
  349   2HG   GLU  45           HG1      GLU  45 -13.644  -1.352   1.362
  350    H    LYS  46           HN       LYS  46 -13.653  -3.117   2.775
  351    HA   LYS  46           HA       LYS  46 -11.523  -1.511   3.809
  352   1HB   LYS  46           HB2      LYS  46 -12.777  -1.443   5.845
  353   2HB   LYS  46           HB1      LYS  46 -13.970  -1.518   4.548
  354   1HG   LYS  46           HG2      LYS  46 -13.973  -4.044   4.855
  355   2HG   LYS  46           HG1      LYS  46 -13.038  -3.780   6.328
  356   1HD   LYS  46           HD2      LYS  46 -14.796  -2.633   7.387
  357   2HD   LYS  46           HD1      LYS  46 -15.615  -2.293   5.863
  358   1HE   LYS  46           HE2      LYS  46 -15.749  -4.921   5.696
  359   2HE   LYS  46           HE1      LYS  46 -15.545  -4.839   7.446
  360   1HZ   LYS  46           HZ3      LYS  46 -17.416  -2.906   6.704
  361   2HZ   LYS  46           HZ2      LYS  46 -17.859  -4.356   5.938
  362   3HZ   LYS  46           HZ1      LYS  46 -17.670  -4.306   7.626
  363    H    GLU  47           HN       GLU  47 -12.280  -4.946   4.096
  364    HA   GLU  47           HA       GLU  47 -10.303  -5.461   6.157
  365   1HB   GLU  47           HB2      GLU  47 -11.863  -7.213   4.255
  366   2HB   GLU  47           HB1      GLU  47 -10.633  -7.883   5.326
  367   1HG   GLU  47           HG2      GLU  47 -12.361  -6.087   6.792
  368   2HG   GLU  47           HG1      GLU  47 -13.317  -7.322   5.973
  369    H    THR  48           HN       THR  48 -10.354  -5.712   2.610
  370    HA   THR  48           HA       THR  48  -7.748  -6.899   2.373
  371    HB   THR  48           HB       THR  48  -9.308  -5.187   0.415
  372    HG1  THR  48           HG1      THR  48  -9.013  -7.984   0.772
  373   1HG2  THR  48          HG22      THR  48  -6.628  -6.369   0.324
  374   2HG2  THR  48          HG21      THR  48  -7.655  -6.880  -1.016
  375   3HG2  THR  48          HG23      THR  48  -7.361  -5.164  -0.734
  376    H    PHE  49           HN       PHE  49  -8.812  -3.598   2.879
  377    HA   PHE  49           HA       PHE  49  -6.221  -2.455   2.124
  378   1HB   PHE  49           HB2      PHE  49  -8.624  -1.260   3.537
  379   2HB   PHE  49           HB1      PHE  49  -7.183  -0.346   3.090
  380    HD1  PHE  49           HD2      PHE  49  -6.496  -1.470   0.451
  381    HD2  PHE  49           HD1      PHE  49 -10.334  -0.495   2.121
  382    HE1  PHE  49           HE2      PHE  49  -7.414  -1.171  -1.829
  383    HE2  PHE  49           HE1      PHE  49 -11.250  -0.193  -0.162
  384    HZ   PHE  49           HZ       PHE  49  -9.790  -0.533  -2.138
  385    H    CYS  50           HN       CYS  50  -7.863  -3.439   5.099
  386    HA   CYS  50           HA       CYS  50  -5.904  -2.278   6.884
  387   1HB   CYS  50           HB2      CYS  50  -7.263  -3.073   8.517
  388   2HB   CYS  50           HB1      CYS  50  -8.365  -3.481   7.203
  389    NH1  ARG  51           NH2      ARG  51  -4.787 -10.833   3.831
  390    NH2  ARG  51           NH1      ARG  51  -5.492 -12.669   4.940
  391    H    ARG  51           HN       ARG  51  -6.133  -5.304   5.103
  392    HA   ARG  51           HA       ARG  51  -3.958  -6.607   6.524
  393   1HB   ARG  51           HB2      ARG  51  -5.658  -7.173   4.177
  394   2HB   ARG  51           HB1      ARG  51  -4.014  -7.800   4.049
  395   1HG   ARG  51           HG2      ARG  51  -4.389  -9.385   5.616
  396   2HG   ARG  51           HG1      ARG  51  -5.175  -8.237   6.697
  397   1HD   ARG  51           HD2      ARG  51  -7.240  -8.839   6.014
  398   2HD   ARG  51           HD1      ARG  51  -6.781  -8.833   4.316
  399    HE   ARG  51           HE       ARG  51  -7.103 -11.143   5.962
  400   1HH1  ARG  51          HH21      ARG  51  -4.867  -9.864   3.612
  401   2HH1  ARG  51          HH22      ARG  51  -4.105 -11.393   3.359
  402   1HH2  ARG  51          HH11      ARG  51  -6.116 -13.107   5.588
  403   2HH2  ARG  51          HH12      ARG  51  -4.810 -13.216   4.455
  404    H    ALA  52           HN       ALA  52  -4.234  -5.003   3.343
  405    HA   ALA  52           HA       ALA  52  -1.451  -5.106   2.713
  406   1HB   ALA  52           HB2      ALA  52  -3.748  -3.375   1.833
  407   2HB   ALA  52           HB1      ALA  52  -2.107  -2.973   1.329
  408   3HB   ALA  52           HB3      ALA  52  -2.807  -4.532   0.893
  409    H    ALA  53           HN       ALA  53  -3.229  -3.156   4.973
  410    HA   ALA  53           HA       ALA  53  -1.370  -0.944   5.085
  411   1HB   ALA  53           HB2      ALA  53  -3.720  -1.887   6.616
  412   2HB   ALA  53           HB1      ALA  53  -2.536  -0.977   7.554
  413   3HB   ALA  53           HB3      ALA  53  -3.278  -0.250   6.129
  414    H    THR  54           HN       THR  54  -1.844  -3.888   7.066
  415    HA   THR  54           HA       THR  54   0.331  -3.405   8.853
  416    HB   THR  54           HB       THR  54  -1.215  -5.815   7.988
  417    HG1  THR  54           HG1      THR  54  -1.537  -4.218   9.830
  418   1HG2  THR  54          HG23      THR  54   1.494  -5.846   9.313
  419   2HG2  THR  54          HG22      THR  54   0.321  -7.134   9.590
  420   3HG2  THR  54          HG21      THR  54   0.923  -6.825   7.961
  421    H    VAL  55           HN       VAL  55   0.188  -5.268   5.807
  422    HA   VAL  55           HA       VAL  55   2.964  -5.956   5.750
  423    HB   VAL  55           HB       VAL  55   0.941  -5.594   3.519
  424   1HG1  VAL  55          HG11      VAL  55   3.767  -6.693   3.459
  425   2HG1  VAL  55          HG13      VAL  55   2.596  -6.906   2.157
  426   3HG1  VAL  55          HG12      VAL  55   3.161  -5.289   2.580
  427   1HG2  VAL  55          HG21      VAL  55   0.698  -7.441   5.300
  428   2HG2  VAL  55          HG23      VAL  55   0.706  -7.961   3.615
  429   3HG2  VAL  55          HG22      VAL  55   2.157  -8.144   4.601
  430    H    LEU  56           HN       LEU  56   1.244  -3.012   4.982
  431    HA   LEU  56           HA       LEU  56   3.342  -1.804   3.395
  432   1HB   LEU  56           HB2      LEU  56   0.713  -1.092   4.338
  433   2HB   LEU  56           HB1      LEU  56   1.837   0.218   4.703
  434    HG   LEU  56           HG       LEU  56   2.666  -0.130   2.255
  435   1HD1  LEU  56          HD12      LEU  56   1.266  -2.260   2.055
  436   2HD1  LEU  56          HD11      LEU  56  -0.147  -1.208   1.976
  437   3HD1  LEU  56          HD13      LEU  56   1.101  -1.104   0.734
  438   1HD2  LEU  56          HD21      LEU  56   0.030   1.110   3.067
  439   2HD2  LEU  56          HD23      LEU  56   1.581   1.913   2.825
  440   3HD2  LEU  56          HD22      LEU  56   0.683   1.295   1.439
  441    NH1  ARG  57           NH2      ARG  57   5.666   0.981  12.149
  442    NH2  ARG  57           NH1      ARG  57   4.357   2.817  12.247
  443    H    ARG  57           HN       ARG  57   2.583  -2.002   6.823
  444    HA   ARG  57           HA       ARG  57   4.418   0.025   7.711
  445   1HB   ARG  57           HB2      ARG  57   2.575  -0.980   9.108
  446   2HB   ARG  57           HB1      ARG  57   3.532  -2.458   9.214
  447   1HG   ARG  57           HG2      ARG  57   5.210  -1.435  10.494
  448   2HG   ARG  57           HG1      ARG  57   4.755   0.187   9.970
  449   1HD   ARG  57           HD2      ARG  57   2.487  -0.971  11.237
  450   2HD   ARG  57           HD1      ARG  57   3.869  -1.252  12.291
  451    HE   ARG  57           HE       ARG  57   2.521   1.232  11.941
  452   1HH1  ARG  57          HH21      ARG  57   5.778  -0.006  12.078
  453   2HH1  ARG  57          HH22      ARG  57   6.471   1.561  12.285
  454   1HH2  ARG  57          HH11      ARG  57   3.450   3.240  12.242
  455   2HH2  ARG  57          HH12      ARG  57   5.171   3.380  12.390
  456    H    GLN  58           HN       GLN  58   4.701  -3.488   7.205
  457    HA   GLN  58           HA       GLN  58   7.438  -3.642   8.124
  458   1HB   GLN  58           HB2      GLN  58   5.482  -5.429   6.870
  459   2HB   GLN  58           HB1      GLN  58   7.130  -5.715   6.310
  460   1HG   GLN  58           HG2      GLN  58   6.631  -7.064   8.318
  461   2HG   GLN  58           HG1      GLN  58   7.902  -5.884   8.645
  462   1HE2  GLN  58          HE22      GLN  58   4.267  -5.507  10.486
  463   2HE2  GLN  58          HE21      GLN  58   4.465  -6.613   9.215
  464    H    PHE  59           HN       PHE  59   5.913  -2.862   5.063
  465    HA   PHE  59           HA       PHE  59   8.452  -2.966   3.585
  466   1HB   PHE  59           HB2      PHE  59   6.858  -3.443   2.032
  467   2HB   PHE  59           HB1      PHE  59   5.586  -2.656   2.959
  468    HD1  PHE  59           HD2      PHE  59   5.192  -0.216   2.748
  469    HD2  PHE  59           HD1      PHE  59   8.134  -2.240   0.356
  470    HE1  PHE  59           HE2      PHE  59   5.298   1.732   1.224
  471    HE2  PHE  59           HE1      PHE  59   8.235  -0.289  -1.165
  472    HZ   PHE  59           HZ       PHE  59   6.818   1.697  -0.732
  473    OH   TYR  60           OH       TYR  60   8.372   5.807   9.596
  474    H    TYR  60           HN       TYR  60   6.885  -0.704   5.607
  475    HA   TYR  60           HA       TYR  60   7.980   1.657   4.223
  476   1HB   TYR  60           HB2      TYR  60   6.000   2.341   5.129
  477   2HB   TYR  60           HB1      TYR  60   6.045   1.123   6.398
  478    HD1  TYR  60           HD1      TYR  60   8.107   4.110   5.375
  479    HD2  TYR  60           HD2      TYR  60   6.199   1.940   8.554
  480    HE1  TYR  60           HE1      TYR  60   8.855   5.827   6.997
  481    HE2  TYR  60           HE2      TYR  60   6.953   3.654  10.176
  482    HH   TYR  60           HH       TYR  60   9.331   5.854   9.556
  483    H    SER  61           HN       SER  61   8.235   0.345   7.554
  484    HA   SER  61           HA       SER  61  10.506   1.969   8.214
  485   1HB   SER  61           HB2      SER  61   9.103   1.047   9.966
  486   2HB   SER  61           HB1      SER  61   9.476  -0.597   9.451
  487    HG   SER  61           HG       SER  61  11.036   1.270  10.823
  488    H    HIS  62           HN       HIS  62  10.264  -1.051   6.491
  489    HA   HIS  62           HA       HIS  62  13.094  -1.708   6.994
  490   1HB   HIS  62           HB2      HIS  62  10.966  -3.296   6.503
  491   2HB   HIS  62           HB1      HIS  62  11.595  -3.133   4.863
  492    HD1  HIS  62           HD1      HIS  62  14.633  -2.802   6.107
  493    HD2  HIS  62           HD2      HIS  62  11.999  -5.998   6.585
  494    HE1  HIS  62           HE1      HIS  62  16.052  -4.818   6.691
  495    H    HIS  63           HN       HIS  63  11.110  -0.878   4.118
  496    HA   HIS  63           HA       HIS  63  13.281  -0.742   2.290
  497   1HB   HIS  63           HB2      HIS  63  10.566   0.550   2.383
  498   2HB   HIS  63           HB1      HIS  63  11.709   0.986   1.115
  499    HD1  HIS  63           HD1      HIS  63  10.554  -0.219  -0.821
  500    HD2  HIS  63           HD2      HIS  63  11.336  -2.733   2.411
  501    HE1  HIS  63           HE1      HIS  63  10.091  -2.577  -1.620
  502    H    GLU  64           HN       GLU  64  12.062   1.621   4.612
  503    HA   GLU  64           HA       GLU  64  13.656   3.817   3.586
  504   1HB   GLU  64           HB2      GLU  64  11.641   4.208   4.955
  505   2HB   GLU  64           HB1      GLU  64  12.419   3.414   6.326
  506   1HG   GLU  64           HG2      GLU  64  14.227   5.384   5.334
  507   2HG   GLU  64           HG1      GLU  64  12.645   6.148   5.501
  508    H    LYS  65           HN       LYS  65  14.185   1.222   5.894
  509    HA   LYS  65           HA       LYS  65  16.892   2.362   6.457
  510   1HB   LYS  65           HB2      LYS  65  14.922   1.430   8.224
  511   2HB   LYS  65           HB1      LYS  65  16.124   0.139   8.167
  512   1HG   LYS  65           HG2      LYS  65  17.006   1.521   9.830
  513   2HG   LYS  65           HG1      LYS  65  17.844   2.118   8.397
  514   1HD   LYS  65           HD2      LYS  65  15.918   3.795   8.159
  515   2HD   LYS  65           HD1      LYS  65  15.457   3.334   9.798
  516   1HE   LYS  65           HE2      LYS  65  16.930   4.900  10.497
  517   2HE   LYS  65           HE1      LYS  65  18.190   3.766  10.009
  518   1HZ   LYS  65           HZ1      LYS  65  17.007   5.460   7.942
  519   2HZ   LYS  65           HZ3      LYS  65  18.068   6.195   9.042
  520   3HZ   LYS  65           HZ2      LYS  65  18.599   4.888   8.097
  521    H    ASP  66           HN       ASP  66  16.358   0.947   4.033
  522    HA   ASP  66           HA       ASP  66  17.846  -1.602   4.536
  523   1HB   ASP  66           HB2      ASP  66  15.575  -0.925   2.733
  524   2HB   ASP  66           HB1      ASP  66  16.800  -2.019   2.090
  525    H    THR  67           HN       THR  67  19.822  -1.747   3.575
  526    HA   THR  67           HA       THR  67  20.828   0.522   2.042
  527    HB   THR  67           HB       THR  67  22.316  -2.069   2.291
  528    HG1  THR  67           HG1      THR  67  22.870  -0.678   4.405
  529   1HG2  THR  67          HG23      THR  67  23.183   0.036   1.137
  530   2HG2  THR  67          HG22      THR  67  23.223   0.779   2.736
  531   3HG2  THR  67          HG21      THR  67  24.220  -0.636   2.395
  532    NH1  ARG  68           NH2      ARG  68  20.709  -4.909   3.617
  533    NH2  ARG  68           NH1      ARG  68  22.837  -5.083   2.881
  534    H    ARG  68           HN       ARG  68  19.423  -2.568   1.287
  535    HA   ARG  68           HA       ARG  68  20.587  -3.077  -1.246
  536   1HB   ARG  68           HB2      ARG  68  17.981  -3.763   0.061
  537   2HB   ARG  68           HB1      ARG  68  18.161  -4.068  -1.667
  538   1HG   ARG  68           HG2      ARG  68  18.960  -6.069  -0.804
  539   2HG   ARG  68           HG1      ARG  68  20.459  -5.144  -0.910
  540   1HD   ARG  68           HD2      ARG  68  19.185  -4.520   1.577
  541   2HD   ARG  68           HD1      ARG  68  19.265  -6.273   1.418
  542    HE   ARG  68           HE       ARG  68  21.796  -5.435   0.689
  543   1HH1  ARG  68          HH21      ARG  68  19.725  -4.915   3.452
  544   2HH1  ARG  68          HH22      ARG  68  21.053  -4.756   4.544
  545   1HH2  ARG  68          HH11      ARG  68  23.490  -5.226   2.138
  546   2HH2  ARG  68          HH12      ARG  68  23.164  -4.929   3.813
  547    H    CYS  69           HN       CYS  69  17.738  -1.093  -0.404
  548    HA   CYS  69           HA       CYS  69  17.446  -0.274  -3.220
  549   1HB   CYS  69           HB2      CYS  69  15.613  -0.626  -1.264
  550   2HB   CYS  69           HB1      CYS  69  15.895   1.107  -1.100
  551    H    LEU  70           HN       LEU  70  19.118   0.868  -0.423
  552    HA   LEU  70           HA       LEU  70  19.029   3.663  -0.749
  553   1HB   LEU  70           HB2      LEU  70  20.874   1.722   0.464
  554   2HB   LEU  70           HB1      LEU  70  21.662   3.205  -0.075
  555    HG   LEU  70           HG       LEU  70  19.148   3.181   1.614
  556   1HD1  LEU  70          HD11      LEU  70  22.065   3.178   2.372
  557   2HD1  LEU  70          HD13      LEU  70  20.868   3.962   3.405
  558   3HD1  LEU  70          HD12      LEU  70  20.744   2.236   3.063
  559   1HD2  LEU  70          HD22      LEU  70  20.187   5.185   0.095
  560   2HD2  LEU  70          HD21      LEU  70  19.304   5.465   1.596
  561   3HD2  LEU  70          HD23      LEU  70  21.068   5.443   1.601
  562    H    GLY  71           HN       GLY  71  21.936   1.883  -1.784
  563   1HA   GLY  71           HA2      GLY  71  22.499   1.854  -4.241
  564   2HA   GLY  71           HA1      GLY  71  21.880   3.505  -4.300
  565    H    ALA  72           HN       ALA  72  23.636   4.802  -4.631
  566    HA   ALA  72           HA       ALA  72  25.651   5.035  -2.564
  567   1HB   ALA  72           HB3      ALA  72  26.354   3.685  -5.171
  568   2HB   ALA  72           HB2      ALA  72  27.566   4.564  -4.239
  569   3HB   ALA  72           HB1      ALA  72  26.746   3.172  -3.530
  570    H    THR  73           HN       THR  73  23.813   6.821  -3.796
  571    HA   THR  73           HA       THR  73  25.741   8.713  -5.069
  572    HB   THR  73           HB       THR  73  22.923   8.962  -5.922
  573    HG1  THR  73           HG1      THR  73  23.474   7.232  -7.532
  574   1HG2  THR  73          HG22      THR  73  25.579   8.893  -7.381
  575   2HG2  THR  73          HG21      THR  73  24.032   9.346  -8.096
  576   3HG2  THR  73          HG23      THR  73  24.745  10.345  -6.829
  577    H    ALA  74           HN       ALA  74  25.118  10.997  -4.756
  578    HA   ALA  74           HA       ALA  74  23.979  11.407  -2.084
  579   1HB   ALA  74           HB3      ALA  74  25.991  12.658  -3.128
  580   2HB   ALA  74           HB2      ALA  74  24.780  13.591  -4.007
  581   3HB   ALA  74           HB1      ALA  74  24.805  13.617  -2.244
  582    H    GLN  75           HN       GLN  75  22.988  11.827  -5.426
  583    HA   GLN  75           HA       GLN  75  20.659  13.462  -4.726
  584   1HB   GLN  75           HB2      GLN  75  21.901  12.408  -7.200
  585   2HB   GLN  75           HB1      GLN  75  20.143  12.557  -7.247
  586   1HG   GLN  75           HG2      GLN  75  20.440  14.923  -6.350
  587   2HG   GLN  75           HG1      GLN  75  22.166  14.733  -6.668
  588   1HE2  GLN  75          HE22      GLN  75  19.566  15.041  -9.834
  589   2HE2  GLN  75          HE21      GLN  75  18.967  14.640  -8.298
  590    H    GLN  76           HN       GLN  76  21.353  10.059  -5.359
  591    HA   GLN  76           HA       GLN  76  18.640   9.176  -5.594
  592   1HB   GLN  76           HB2      GLN  76  21.209   7.981  -5.574
  593   2HB   GLN  76           HB1      GLN  76  20.278   7.188  -4.303
  594   1HG   GLN  76           HG2      GLN  76  18.424   6.833  -5.938
  595   2HG   GLN  76           HG1      GLN  76  19.451   7.513  -7.201
  596   1HE2  GLN  76          HE22      GLN  76  19.779   3.675  -6.769
  597   2HE2  GLN  76          HE21      GLN  76  18.386   4.638  -6.647
  598    H    PHE  77           HN       PHE  77  20.660   9.931  -2.825
  599    HA   PHE  77           HA       PHE  77  19.084   8.612  -0.828
  600   1HB   PHE  77           HB2      PHE  77  21.416  10.137  -0.857
  601   2HB   PHE  77           HB1      PHE  77  20.281  11.124   0.064
  602    HD1  PHE  77           HD2      PHE  77  18.696   9.566   1.676
  603    HD2  PHE  77           HD1      PHE  77  22.702   8.672   0.410
  604    HE1  PHE  77           HE2      PHE  77  18.982   8.074   3.635
  605    HE2  PHE  77           HE1      PHE  77  22.988   7.179   2.370
  606    HZ   PHE  77           HZ       PHE  77  21.128   6.880   3.982
  607    H    HIS  78           HN       HIS  78  19.060  12.012  -1.952
  608    HA   HIS  78           HA       HIS  78  16.874  12.855  -0.340
  609   1HB   HIS  78           HB2      HIS  78  18.381  14.381  -1.634
  610   2HB   HIS  78           HB1      HIS  78  17.584  13.851  -3.115
  611    HD1  HIS  78           HD1      HIS  78  15.101  14.577  -3.469
  612    HD2  HIS  78           HD2      HIS  78  16.845  16.135  -0.018
  613    HE1  HIS  78           HE1      HIS  78  13.549  16.400  -2.641
  614    NH1  ARG  79           NH2      ARG  79  15.430  13.726  -8.792
  615    NH2  ARG  79           NH1      ARG  79  13.346  13.569  -9.650
  616    H    ARG  79           HN       ARG  79  16.968  11.271  -3.504
  617    HA   ARG  79           HA       ARG  79  14.186  11.555  -4.117
  618   1HB   ARG  79           HB2      ARG  79  16.377  10.475  -5.401
  619   2HB   ARG  79           HB1      ARG  79  15.422   9.043  -5.015
  620   1HG   ARG  79           HG2      ARG  79  14.198   9.540  -6.849
  621   2HG   ARG  79           HG1      ARG  79  13.517  10.858  -5.896
  622   1HD   ARG  79           HD2      ARG  79  15.512  12.261  -6.657
  623   2HD   ARG  79           HD1      ARG  79  15.849  10.976  -7.818
  624    HE   ARG  79           HE       ARG  79  13.172  11.574  -8.234
  625   1HH1  ARG  79          HH21      ARG  79  16.156  13.386  -8.198
  626   2HH1  ARG  79          HH22      ARG  79  15.582  14.548  -9.339
  627   1HH2  ARG  79          HH11      ARG  79  12.464  13.100  -9.712
  628   2HH2  ARG  79          HH12      ARG  79  13.513  14.393 -10.190
  629    H    HIS  80           HN       HIS  80  15.976   9.230  -2.158
  630    HA   HIS  80           HA       HIS  80  13.785   7.376  -1.825
  631   1HB   HIS  80           HB2      HIS  80  16.476   7.410  -1.144
  632   2HB   HIS  80           HB1      HIS  80  15.666   7.526   0.418
  633    HD1  HIS  80           HD1      HIS  80  13.524   5.704   0.591
  634    HD2  HIS  80           HD2      HIS  80  16.677   4.793  -1.980
  635    HE1  HIS  80           HE1      HIS  80  13.395   3.213   0.154
  636    H    LYS  81           HN       LYS  81  14.830  10.299  -0.161
  637    HA   LYS  81           HA       LYS  81  13.292  10.060   2.208
  638   1HB   LYS  81           HB2      LYS  81  14.921  12.001   1.078
  639   2HB   LYS  81           HB1      LYS  81  13.337  12.775   1.108
  640   1HG   LYS  81           HG2      LYS  81  13.230  11.820   3.555
  641   2HG   LYS  81           HG1      LYS  81  14.985  11.750   3.399
  642   1HD   LYS  81           HD2      LYS  81  15.068  14.131   2.854
  643   2HD   LYS  81           HD1      LYS  81  13.307  14.227   2.905
  644   1HE   LYS  81           HE2      LYS  81  13.780  14.930   5.053
  645   2HE   LYS  81           HE1      LYS  81  13.689  13.191   5.334
  646   1HZ   LYS  81           HZ3      LYS  81  16.262  14.293   4.500
  647   2HZ   LYS  81           HZ2      LYS  81  15.756  14.616   6.089
  648   3HZ   LYS  81           HZ1      LYS  81  15.924  13.012   5.558
  649    H    GLN  82           HN       GLN  82  12.372  11.102  -1.041
  650    HA   GLN  82           HA       GLN  82   9.699  11.936  -0.215
  651   1HB   GLN  82           HB2      GLN  82  11.271  11.873  -2.702
  652   2HB   GLN  82           HB1      GLN  82   9.553  11.547  -2.935
  653   1HG   GLN  82           HG2      GLN  82  10.105  13.763  -1.076
  654   2HG   GLN  82           HG1      GLN  82  10.649  14.060  -2.728
  655   1HE2  GLN  82          HE22      GLN  82   7.389  14.704  -3.858
  656   2HE2  GLN  82          HE21      GLN  82   9.060  14.910  -4.071
  657    H    LEU  83           HN       LEU  83  11.187   8.948  -1.264
  658    HA   LEU  83           HA       LEU  83   8.779   7.619  -2.124
  659   1HB   LEU  83           HB2      LEU  83  11.398   6.982  -2.267
  660   2HB   LEU  83           HB1      LEU  83  10.952   6.024  -0.855
  661    HG   LEU  83           HG       LEU  83   9.531   5.940  -3.534
  662   1HD1  LEU  83          HD12      LEU  83  11.733   4.331  -2.303
  663   2HD1  LEU  83          HD11      LEU  83  10.527   3.483  -3.270
  664   3HD1  LEU  83          HD13      LEU  83  11.482   4.779  -3.990
  665   1HD2  LEU  83          HD21      LEU  83   9.170   4.455  -0.921
  666   2HD2  LEU  83          HD23      LEU  83   7.965   5.383  -1.814
  667   3HD2  LEU  83          HD22      LEU  83   8.538   3.841  -2.449
  668    H    ILE  84           HN       ILE  84  10.608   7.421   0.948
  669    HA   ILE  84           HA       ILE  84   8.633   5.838   2.302
  670    HB   ILE  84           HB       ILE  84  10.563   7.763   3.607
  671   1HG1  ILE  84          HG12      ILE  84  11.962   6.560   2.122
  672   2HG1  ILE  84          HG11      ILE  84  12.058   5.640   3.623
  673   1HG2  ILE  84          HG21      ILE  84   8.722   6.417   4.869
  674   2HG2  ILE  84          HG23      ILE  84   9.746   5.017   4.546
  675   3HG2  ILE  84          HG22      ILE  84  10.370   6.367   5.496
  676   1HD1  ILE  84          HD11      ILE  84  10.075   4.269   2.674
  677   2HD1  ILE  84          HD13      ILE  84  10.503   4.990   1.122
  678   3HD1  ILE  84          HD12      ILE  84  11.672   3.989   1.981
  679    NH1  ARG  85           NH2      ARG  85   8.263  15.299   4.275
  680    NH2  ARG  85           NH1      ARG  85   7.883  15.248   6.499
  681    H    ARG  85           HN       ARG  85   9.020   9.301   1.846
  682    HA   ARG  85           HA       ARG  85   7.171  10.141   3.872
  683   1HB   ARG  85           HB2      ARG  85   8.793  11.413   2.016
  684   2HB   ARG  85           HB1      ARG  85   7.167  11.788   1.448
  685   1HG   ARG  85           HG2      ARG  85   7.398  13.486   2.978
  686   2HG   ARG  85           HG1      ARG  85   6.782  12.240   4.058
  687   1HD   ARG  85           HD2      ARG  85   9.158  11.585   4.545
  688   2HD   ARG  85           HD1      ARG  85   9.693  12.982   3.617
  689    HE   ARG  85           HE       ARG  85   8.763  12.971   6.345
  690   1HH1  ARG  85          HH21      ARG  85   8.605  14.871   3.442
  691   2HH1  ARG  85          HH22      ARG  85   7.929  16.242   4.248
  692   1HH2  ARG  85          HH11      ARG  85   7.926  14.769   7.376
  693   2HH2  ARG  85          HH12      ARG  85   7.564  16.194   6.460
  694    H    PHE  86           HN       PHE  86   6.768   9.203   0.486
  695    HA   PHE  86           HA       PHE  86   3.980   9.866   0.297
  696   1HB   PHE  86           HB2      PHE  86   5.988   8.698  -1.376
  697   2HB   PHE  86           HB1      PHE  86   4.573   7.645  -1.394
  698    HD1  PHE  86           HD2      PHE  86   2.289   9.327  -1.180
  699    HD2  PHE  86           HD1      PHE  86   5.984  10.112  -3.224
  700    HE1  PHE  86           HE2      PHE  86   1.125  10.926  -2.673
  701    HE2  PHE  86           HE1      PHE  86   4.821  11.709  -4.717
  702    HZ   PHE  86           HZ       PHE  86   2.389  12.120  -4.442
  703    H    LEU  87           HN       LEU  87   5.524   6.643   0.630
  704    HA   LEU  87           HA       LEU  87   3.089   5.270   1.188
  705   1HB   LEU  87           HB2      LEU  87   4.555   3.468   2.077
  706   2HB   LEU  87           HB1      LEU  87   5.106   4.070   0.516
  707    HG   LEU  87           HG       LEU  87   6.528   5.716   2.041
  708   1HD1  LEU  87          HD13      LEU  87   5.324   4.021   3.949
  709   2HD1  LEU  87          HD12      LEU  87   7.006   3.505   3.838
  710   3HD1  LEU  87          HD11      LEU  87   6.623   5.182   4.227
  711   1HD2  LEU  87          HD23      LEU  87   6.952   3.191   0.736
  712   2HD2  LEU  87          HD22      LEU  87   8.098   4.510   0.958
  713   3HD2  LEU  87          HD21      LEU  87   7.950   3.255   2.188
  714    H    LYS  88           HN       LYS  88   4.969   7.353   3.204
  715    HA   LYS  88           HA       LYS  88   4.186   6.199   5.743
  716   1HB   LYS  88           HB2      LYS  88   5.525   8.685   4.813
  717   2HB   LYS  88           HB1      LYS  88   4.692   8.787   6.366
  718   1HG   LYS  88           HG2      LYS  88   5.963   6.946   7.258
  719   2HG   LYS  88           HG1      LYS  88   6.649   6.581   5.674
  720   1HD   LYS  88           HD2      LYS  88   8.385   7.900   6.261
  721   2HD   LYS  88           HD1      LYS  88   7.283   9.265   6.065
  722   1HE   LYS  88           HE2      LYS  88   7.420   7.705   8.647
  723   2HE   LYS  88           HE1      LYS  88   8.502   9.061   8.328
  724   1HZ   LYS  88           HZ3      LYS  88   6.251  10.209   7.681
  725   2HZ   LYS  88           HZ2      LYS  88   5.605   9.048   8.741
  726   3HZ   LYS  88           HZ1      LYS  88   6.775  10.150   9.293
  727    NH1  ARG  89           NH2      ARG  89  -1.015  14.096   0.782
  728    NH2  ARG  89           NH1      ARG  89   0.699  13.365  -0.495
  729    H    ARG  89           HN       ARG  89   3.019   9.021   3.876
  730    HA   ARG  89           HA       ARG  89   0.823   9.567   5.656
  731   1HB   ARG  89           HB2      ARG  89   1.157  11.392   4.299
  732   2HB   ARG  89           HB1      ARG  89   1.648  10.406   2.922
  733   1HG   ARG  89           HG2      ARG  89  -0.591   9.895   2.341
  734   2HG   ARG  89           HG1      ARG  89  -1.203  10.416   3.911
  735   1HD   ARG  89           HD2      ARG  89  -1.731  12.158   2.334
  736   2HD   ARG  89           HD1      ARG  89  -0.410  12.750   3.341
  737    HE   ARG  89           HE       ARG  89   0.873  11.582   1.181
  738   1HH1  ARG  89          HH21      ARG  89  -1.607  14.007   1.581
  739   2HH1  ARG  89          HH22      ARG  89  -1.153  14.853   0.145
  740   1HH2  ARG  89          HH11      ARG  89   1.430  12.708  -0.677
  741   2HH2  ARG  89          HH12      ARG  89   0.548  14.129  -1.122
  742    H    LEU  90           HN       LEU  90   1.219   7.503   2.831
  743    HA   LEU  90           HA       LEU  90  -1.608   6.819   2.668
  744   1HB   LEU  90           HB2      LEU  90  -0.050   6.782   0.702
  745   2HB   LEU  90           HB1      LEU  90   0.754   5.388   1.426
  746    HG   LEU  90           HG       LEU  90  -2.057   4.889   1.466
  747   1HD1  LEU  90          HD13      LEU  90  -0.957   5.884  -1.175
  748   2HD1  LEU  90          HD12      LEU  90  -2.392   4.867  -1.053
  749   3HD1  LEU  90          HD11      LEU  90  -2.382   6.470  -0.317
  750   1HD2  LEU  90          HD21      LEU  90  -0.169   3.244   1.364
  751   2HD2  LEU  90          HD23      LEU  90  -1.402   2.949   0.138
  752   3HD2  LEU  90          HD22      LEU  90   0.116   3.729  -0.306
  753    H    ASP  91           HN       ASP  91   0.934   5.813   4.725
  754    HA   ASP  91           HA       ASP  91   0.215   3.040   4.996
  755   1HB   ASP  91           HB2      ASP  91   2.373   3.880   5.819
  756   2HB   ASP  91           HB1      ASP  91   1.544   4.919   6.980
  757    NH1  ARG  92           NH2      ARG  92  -6.278   7.012  11.284
  758    NH2  ARG  92           NH1      ARG  92  -5.397   9.006  11.875
  759    H    ARG  92           HN       ARG  92  -0.730   5.974   6.806
  760    HA   ARG  92           HA       ARG  92  -2.687   4.395   8.357
  761   1HB   ARG  92           HB2      ARG  92  -1.224   6.798   8.787
  762   2HB   ARG  92           HB1      ARG  92  -2.938   7.205   8.829
  763   1HG   ARG  92           HG2      ARG  92  -2.065   4.741  10.274
  764   2HG   ARG  92           HG1      ARG  92  -1.668   6.300  10.998
  765   1HD   ARG  92           HD2      ARG  92  -4.459   5.678  10.027
  766   2HD   ARG  92           HD1      ARG  92  -3.930   5.246  11.653
  767    HE   ARG  92           HE       ARG  92  -3.245   7.918  11.428
  768   1HH1  ARG  92          HH21      ARG  92  -6.171   6.067  10.980
  769   2HH1  ARG  92          HH22      ARG  92  -7.193   7.380  11.444
  770   1HH2  ARG  92          HH11      ARG  92  -4.603   9.597  12.024
  771   2HH2  ARG  92          HH12      ARG  92  -6.319   9.360  12.030
  772    H    ASN  93           HN       ASN  93  -2.664   6.673   5.667
  773    HA   ASN  93           HA       ASN  93  -5.529   7.207   5.825
  774   1HB   ASN  93           HB2      ASN  93  -3.293   8.158   4.284
  775   2HB   ASN  93           HB1      ASN  93  -4.611   7.721   3.199
  776   1HD2  ASN  93          HD22      ASN  93  -5.461  10.548   6.075
  777   2HD2  ASN  93          HD21      ASN  93  -4.424   9.264   6.467
  778    H    LEU  94           HN       LEU  94  -3.533   4.800   4.248
  779    HA   LEU  94           HA       LEU  94  -5.391   3.955   2.252
  780   1HB   LEU  94           HB2      LEU  94  -3.123   3.156   2.139
  781   2HB   LEU  94           HB1      LEU  94  -3.234   2.444   3.749
  782    HG   LEU  94           HG       LEU  94  -5.286   1.541   1.815
  783   1HD1  LEU  94          HD13      LEU  94  -2.461   1.503   1.146
  784   2HD1  LEU  94          HD12      LEU  94  -3.089  -0.138   1.307
  785   3HD1  LEU  94          HD11      LEU  94  -3.841   0.986   0.175
  786   1HD2  LEU  94          HD23      LEU  94  -3.665   0.501   4.093
  787   2HD2  LEU  94          HD22      LEU  94  -5.386   0.307   3.758
  788   3HD2  LEU  94          HD21      LEU  94  -4.203  -0.673   2.893
  789    CH2  TRP  95           CH2      TRP  95  -5.718   1.815  12.037
  790    H    TRP  95           HN       TRP  95  -4.707   2.378   5.389
  791    HA   TRP  95           HA       TRP  95  -7.276   0.966   5.267
  792   1HB   TRP  95           HB2      TRP  95  -5.794  -0.440   6.270
  793   2HB   TRP  95           HB1      TRP  95  -4.807   0.876   6.891
  794    HD1  TRP  95           HD1      TRP  95  -8.118  -0.952   7.663
  795    HE1  TRP  95           HE1      TRP  95  -8.592  -0.703  10.189
  796    HE3  TRP  95           HE3      TRP  95  -4.289   2.123   8.958
  797    HZ2  TRP  95           HZ2      TRP  95  -7.471   0.646  12.464
  798    HZ3  TRP  95           HZ3      TRP  95  -4.000   2.887  11.303
  799    HH2  TRP  95           HH2      TRP  95  -5.592   2.146  13.057
  800    H    GLY  96           HN       GLY  96  -6.214   3.995   6.418
  801   1HA   GLY  96           HA2      GLY  96  -7.657   4.392   8.795
  802   2HA   GLY  96           HA1      GLY  96  -7.359   5.662   7.609
  803    H    LEU  97           HN       LEU  97  -8.829   4.239   5.470
  804    HA   LEU  97           HA       LEU  97 -11.459   5.297   5.984
  805   1HB   LEU  97           HB2      LEU  97 -10.827   5.178   3.698
  806   2HB   LEU  97           HB1      LEU  97 -10.320   3.494   3.844
  807    HG   LEU  97           HG       LEU  97 -13.150   4.040   4.539
  808   1HD1  LEU  97          HD12      LEU  97 -11.965   4.643   1.867
  809   2HD1  LEU  97          HD11      LEU  97 -13.508   3.788   1.900
  810   3HD1  LEU  97          HD13      LEU  97 -13.359   5.370   2.667
  811   1HD2  LEU  97          HD22      LEU  97 -11.475   1.853   3.815
  812   2HD2  LEU  97          HD21      LEU  97 -13.187   1.807   4.234
  813   3HD2  LEU  97          HD23      LEU  97 -12.696   2.012   2.553
  814    H    ALA  98           HN       ALA  98 -10.087   2.038   6.039
  815    HA   ALA  98           HA       ALA  98 -12.325   0.434   6.396
  816   1HB   ALA  98           HB1      ALA  98  -9.558   0.162   6.758
  817   2HB   ALA  98           HB3      ALA  98 -10.255  -0.265   8.320
  818   3HB   ALA  98           HB2      ALA  98 -10.757  -1.127   6.866
  819    H    GLY  99           HN       GLY  99 -10.559   2.181   8.953
  820   1HA   GLY  99           HA2      GLY  99 -11.336   3.027  11.004
  821   2HA   GLY  99           HA1      GLY  99 -12.977   2.784  10.406
  822    H    LEU 100           HN       LEU 100 -10.709   0.121  10.501
  823    HA   LEU 100           HA       LEU 100 -12.333  -1.054  12.719
  824   1HB   LEU 100           HB2      LEU 100 -11.049  -2.223  10.270
  825   2HB   LEU 100           HB1      LEU 100 -11.245  -3.240  11.697
  826    HG   LEU 100           HG       LEU 100 -13.485  -1.682  10.374
  827   1HD1  LEU 100          HD13      LEU 100 -12.551  -4.540  10.140
  828   2HD1  LEU 100          HD12      LEU 100 -14.240  -4.114   9.862
  829   3HD1  LEU 100          HD11      LEU 100 -12.976  -3.411   8.853
  830   1HD2  LEU 100          HD23      LEU 100 -13.199  -2.929  12.944
  831   2HD2  LEU 100          HD22      LEU 100 -14.618  -2.128  12.269
  832   3HD2  LEU 100          HD21      LEU 100 -14.367  -3.852  11.998
  833    H    ASN 101           HN       ASN 101 -10.735  -3.056  13.596
  834    HA   ASN 101           HA       ASN 101  -8.504  -1.558  14.817
  835   1HB   ASN 101           HB2      ASN 101  -8.678  -3.033  16.549
  836   2HB   ASN 101           HB1      ASN 101 -10.245  -3.407  15.833
  837   1HD2  ASN 101          HD22      ASN 101  -7.545  -6.318  16.036
  838   2HD2  ASN 101          HD21      ASN 101  -7.498  -4.900  16.966
  839    H    SER 102           HN       SER 102  -6.418  -3.005  15.115
  840    HA   SER 102           HA       SER 102  -5.177  -3.312  12.605
  841   1HB   SER 102           HB2      SER 102  -3.456  -4.642  13.838
  842   2HB   SER 102           HB1      SER 102  -3.874  -3.141  14.658
  843    HG   SER 102           HG       SER 102  -4.591  -5.797  15.274
  844    H    CYS 103           HN       CYS 103  -4.203  -5.553  11.894
  845    HA   CYS 103           HA       CYS 103  -5.995  -7.838  12.331
  846   1HB   CYS 103           HB2      CYS 103  -5.995  -7.814   9.586
  847   2HB   CYS 103           HB1      CYS 103  -7.339  -7.274  10.591
  848    HA   PRO 104           HA       PRO 104  -1.515  -8.792  11.787
  849   1HB   PRO 104           HB2      PRO 104  -2.246 -11.290  13.101
  850   2HB   PRO 104           HB1      PRO 104  -1.126 -10.035  13.651
  851   1HG   PRO 104           HG2      PRO 104  -3.744 -10.562  14.672
  852   2HG   PRO 104           HG1      PRO 104  -2.677  -9.221  15.112
  853   1HD   PRO 104           HD2      PRO 104  -5.114  -9.107  13.575
  854   2HD   PRO 104           HD1      PRO 104  -4.040  -7.763  14.015
  855    H    VAL 105           HN       VAL 105  -1.467  -9.214   9.602
  856    HA   VAL 105           HA       VAL 105  -3.100 -10.826   8.040
  857    HB   VAL 105           HB       VAL 105  -0.194 -10.101   7.854
  858   1HG1  VAL 105          HG12      VAL 105  -1.689 -12.079   6.123
  859   2HG1  VAL 105          HG11      VAL 105  -0.271 -11.204   5.546
  860   3HG1  VAL 105          HG13      VAL 105  -0.133 -12.298   6.923
  861   1HG2  VAL 105          HG22      VAL 105  -2.762  -9.192   6.820
  862   2HG2  VAL 105          HG21      VAL 105  -1.207  -8.361   6.829
  863   3HG2  VAL 105          HG23      VAL 105  -1.604  -9.473   5.520
  864    H    LYS 106           HN       LYS 106  -3.643 -12.927   8.268
  865    HA   LYS 106           HA       LYS 106  -1.763 -14.764   9.648
  866   1HB   LYS 106           HB2      LYS 106  -4.473 -15.639   8.731
  867   2HB   LYS 106           HB1      LYS 106  -3.602 -16.050  10.210
  868   1HG   LYS 106           HG2      LYS 106  -3.929 -13.633  10.934
  869   2HG   LYS 106           HG1      LYS 106  -5.036 -13.460   9.572
  870   1HD   LYS 106           HD2      LYS 106  -6.353 -15.395  10.465
  871   2HD   LYS 106           HD1      LYS 106  -5.303 -15.403  11.883
  872   1HE   LYS 106           HE2      LYS 106  -6.257 -13.527  12.763
  873   2HE   LYS 106           HE1      LYS 106  -6.452 -12.766  11.185
  874   1HZ   LYS 106           HZ1      LYS 106  -8.087 -15.114  11.807
  875   2HZ   LYS 106           HZ3      LYS 106  -8.504 -13.639  12.530
  876   3HZ   LYS 106           HZ2      LYS 106  -8.450 -13.768  10.837
  877    H    GLU 107           HN       GLU 107  -3.948 -15.001   6.813
  878    HA   GLU 107           HA       GLU 107  -2.244 -17.084   5.649
  879   1HB   GLU 107           HB2      GLU 107  -4.648 -17.250   5.320
  880   2HB   GLU 107           HB1      GLU 107  -4.696 -15.642   4.597
  881   1HG   GLU 107           HG2      GLU 107  -4.009 -16.412   2.583
  882   2HG   GLU 107           HG1      GLU 107  -2.751 -17.416   3.307
  883    H    ALA 108           HN       ALA 108  -0.299 -16.318   4.895
  884    HA   ALA 108           HA       ALA 108  -0.242 -14.653   2.550
  885   1HB   ALA 108           HB2      ALA 108  -0.685 -12.905   4.290
  886   2HB   ALA 108           HB1      ALA 108   0.821 -13.368   5.084
  887   3HB   ALA 108           HB3      ALA 108   0.855 -12.677   3.462
  888    H    ASP 109           HN       ASP 109   1.599 -15.204   1.466
  889    HA   ASP 109           HA       ASP 109   3.834 -16.389   3.068
  890   1HB   ASP 109           HB2      ASP 109   2.325 -17.511   0.942
  891   2HB   ASP 109           HB1      ASP 109   3.926 -17.153   0.291
  892    H    GLN 110           HN       GLN 110   5.907 -16.347   1.433
  893    HA   GLN 110           HA       GLN 110   6.550 -13.546   1.163
  894   1HB   GLN 110           HB2      GLN 110   7.986 -15.969   1.193
  895   2HB   GLN 110           HB1      GLN 110   8.297 -15.258  -0.390
  896   1HG   GLN 110           HG2      GLN 110   9.841 -13.982   0.657
  897   2HG   GLN 110           HG1      GLN 110   8.476 -13.080   1.315
  898   1HE2  GLN 110          HE22      GLN 110   9.494 -13.960   4.567
  899   2HE2  GLN 110          HE21      GLN 110   8.978 -12.745   3.499
  900    H    SER 111           HN       SER 111   5.382 -12.437  -0.354
  901    HA   SER 111           HA       SER 111   5.158 -13.617  -3.085
  902   1HB   SER 111           HB2      SER 111   3.135 -12.588  -3.251
  903   2HB   SER 111           HB1      SER 111   3.242 -12.409  -1.502
  904    HG   SER 111           HG       SER 111   3.346 -10.530  -3.440
  905    H    THR 112           HN       THR 112   5.033 -11.483  -4.700
  906    HA   THR 112           HA       THR 112   7.645 -10.117  -4.217
  907    HB   THR 112           HB       THR 112   7.695  -9.765  -6.665
  908    HG1  THR 112           HG1      THR 112   6.069 -10.792  -7.898
  909   1HG2  THR 112          HG23      THR 112   8.616 -11.847  -5.627
  910   2HG2  THR 112          HG22      THR 112   7.076 -12.643  -5.950
  911   3HG2  THR 112          HG21      THR 112   8.078 -12.081  -7.289
  912    H    LEU 113           HN       LEU 113   7.695  -7.886  -4.123
  913    HA   LEU 113           HA       LEU 113   5.244  -6.470  -3.662
  914   1HB   LEU 113           HB2      LEU 113   7.566  -5.878  -2.780
  915   2HB   LEU 113           HB1      LEU 113   7.888  -5.191  -4.372
  916    HG   LEU 113           HG       LEU 113   5.874  -3.734  -4.109
  917   1HD1  LEU 113          HD11      LEU 113   5.839  -5.047  -1.382
  918   2HD1  LEU 113          HD13      LEU 113   5.021  -3.521  -1.715
  919   3HD1  LEU 113          HD12      LEU 113   4.533  -4.987  -2.565
  920   1HD2  LEU 113          HD21      LEU 113   8.260  -3.646  -2.328
  921   2HD2  LEU 113          HD23      LEU 113   7.713  -2.479  -3.531
  922   3HD2  LEU 113          HD22      LEU 113   6.946  -2.534  -1.944
  923    H    GLU 114           HN       GLU 114   6.869  -7.277  -6.599
  924    HA   GLU 114           HA       GLU 114   5.910  -5.002  -8.125
  925   1HB   GLU 114           HB2      GLU 114   6.240  -6.770 -10.105
  926   2HB   GLU 114           HB1      GLU 114   7.603  -5.945  -9.361
  927   1HG   GLU 114           HG2      GLU 114   8.159  -7.848  -8.037
  928   2HG   GLU 114           HG1      GLU 114   6.622  -8.633  -8.383
  929    H    ASN 115           HN       ASN 115   4.784  -8.393  -7.922
  930    HA   ASN 115           HA       ASN 115   2.367  -7.844  -9.419
  931   1HB   ASN 115           HB2      ASN 115   3.674 -10.138  -8.447
  932   2HB   ASN 115           HB1      ASN 115   2.129 -10.093  -7.598
  933   1HD2  ASN 115          HD22      ASN 115   0.194 -10.719 -10.514
  934   2HD2  ASN 115          HD21      ASN 115   0.155 -10.228  -8.889
  935    H    PHE 116           HN       PHE 116   3.336  -7.465  -6.094
  936    HA   PHE 116           HA       PHE 116   0.747  -7.515  -4.869
  937   1HB   PHE 116           HB2      PHE 116   2.835  -7.587  -3.558
  938   2HB   PHE 116           HB1      PHE 116   3.241  -5.960  -4.103
  939    HD1  PHE 116           HD1      PHE 116   0.696  -7.927  -2.220
  940    HD2  PHE 116           HD2      PHE 116   2.358  -4.047  -3.017
  941    HE1  PHE 116           HE1      PHE 116  -0.649  -6.972  -0.369
  942    HE2  PHE 116           HE2      PHE 116   1.012  -3.092  -1.165
  943    HZ   PHE 116           HZ       PHE 116  -0.492  -4.554   0.158
  944    H    LEU 117           HN       LEU 117   2.744  -4.794  -6.064
  945    HA   LEU 117           HA       LEU 117   0.767  -2.781  -5.618
  946   1HB   LEU 117           HB2      LEU 117   3.259  -3.016  -7.236
  947   2HB   LEU 117           HB1      LEU 117   2.129  -1.740  -7.691
  948    HG   LEU 117           HG       LEU 117   2.414  -1.838  -4.817
  949   1HD1  LEU 117          HD12      LEU 117   4.712  -2.732  -5.829
  950   2HD1  LEU 117          HD11      LEU 117   4.976  -1.014  -6.117
  951   3HD1  LEU 117          HD13      LEU 117   4.688  -1.598  -4.478
  952   1HD2  LEU 117          HD22      LEU 117   1.715   0.025  -6.542
  953   2HD2  LEU 117          HD21      LEU 117   2.573   0.480  -5.070
  954   3HD2  LEU 117          HD23      LEU 117   3.447   0.353  -6.597
  955    H    GLU 118           HN       GLU 118   1.321  -5.062  -8.240
  956    HA   GLU 118           HA       GLU 118  -0.329  -3.932 -10.240
  957   1HB   GLU 118           HB2      GLU 118   1.121  -5.983 -10.475
  958   2HB   GLU 118           HB1      GLU 118  -0.101  -6.881  -9.576
  959   1HG   GLU 118           HG2      GLU 118  -0.662  -7.270 -11.836
  960   2HG   GLU 118           HG1      GLU 118  -1.769  -5.988 -11.339
  961    NH1  ARG 119           NH2      ARG 119  -4.393  -8.921 -11.559
  962    NH2  ARG 119           NH1      ARG 119  -3.655 -11.056 -11.532
  963    H    ARG 119           HN       ARG 119  -1.274  -6.456  -7.897
  964    HA   ARG 119           HA       ARG 119  -4.101  -6.129  -8.389
  965   1HB   ARG 119           HB2      ARG 119  -2.849  -7.307  -5.902
  966   2HB   ARG 119           HB1      ARG 119  -4.413  -7.696  -6.617
  967   1HG   ARG 119           HG2      ARG 119  -1.661  -8.412  -7.620
  968   2HG   ARG 119           HG1      ARG 119  -3.033  -9.478  -7.314
  969   1HD   ARG 119           HD2      ARG 119  -4.194  -7.981  -9.165
  970   2HD   ARG 119           HD1      ARG 119  -2.527  -7.662  -9.643
  971    HE   ARG 119           HE       ARG 119  -2.627 -10.417  -9.398
  972   1HH1  ARG 119          HH21      ARG 119  -4.458  -8.015 -11.146
  973   2HH1  ARG 119          HH22      ARG 119  -4.844  -9.099 -12.434
  974   1HH2  ARG 119          HH11      ARG 119  -3.145 -11.794 -11.089
  975   2HH2  ARG 119          HH12      ARG 119  -4.111 -11.218 -12.407
  976    H    LEU 120           HN       LEU 120  -1.891  -4.206  -6.625
  977    HA   LEU 120           HA       LEU 120  -3.718  -3.370  -4.529
  978   1HB   LEU 120           HB2      LEU 120  -1.031  -3.114  -4.883
  979   2HB   LEU 120           HB1      LEU 120  -1.572  -1.509  -5.374
  980    HG   LEU 120           HG       LEU 120  -2.577  -2.779  -2.831
  981   1HD1  LEU 120          HD12      LEU 120   0.080  -2.425  -3.192
  982   2HD1  LEU 120          HD11      LEU 120  -0.367  -0.795  -2.685
  983   3HD1  LEU 120          HD13      LEU 120  -0.715  -2.172  -1.638
  984   1HD2  LEU 120          HD23      LEU 120  -2.256   0.080  -3.802
  985   2HD2  LEU 120          HD22      LEU 120  -3.773  -0.813  -3.684
  986   3HD2  LEU 120          HD21      LEU 120  -2.887  -0.384  -2.221
  987    H    LYS 121           HN       LYS 121  -2.784  -2.133  -7.726
  988    HA   LYS 121           HA       LYS 121  -4.506   0.216  -7.506
  989   1HB   LYS 121           HB2      LYS 121  -2.386  -0.152  -9.015
  990   2HB   LYS 121           HB1      LYS 121  -3.535  -0.909 -10.120
  991   1HG   LYS 121           HG2      LYS 121  -4.859   1.102 -10.242
  992   2HG   LYS 121           HG1      LYS 121  -3.925   1.859  -8.952
  993   1HD   LYS 121           HD2      LYS 121  -3.105   2.762 -11.023
  994   2HD   LYS 121           HD1      LYS 121  -1.883   1.633 -10.440
  995   1HE   LYS 121           HE2      LYS 121  -2.362   0.054 -12.069
  996   2HE   LYS 121           HE1      LYS 121  -4.030   0.598 -12.253
  997   1HZ   LYS 121           HZ2      LYS 121  -3.009   2.723 -13.159
  998   2HZ   LYS 121           HZ1      LYS 121  -1.563   1.843 -13.305
  999   3HZ   LYS 121           HZ3      LYS 121  -2.945   1.350 -14.157
 1000    H    THR 122           HN       THR 122  -4.593  -2.805  -9.359
 1001    HA   THR 122           HA       THR 122  -7.088  -2.473 -10.612
 1002    HB   THR 122           HB       THR 122  -7.024  -5.184  -9.911
 1003    HG1  THR 122           HG1      THR 122  -4.577  -5.210 -10.689
 1004   1HG2  THR 122          HG23      THR 122  -5.790  -3.713 -12.253
 1005   2HG2  THR 122          HG22      THR 122  -6.124  -5.445 -12.216
 1006   3HG2  THR 122          HG21      THR 122  -7.454  -4.288 -12.141
 1007    H    ILE 123           HN       ILE 123  -6.448  -4.009  -7.469
 1008    HA   ILE 123           HA       ILE 123  -9.194  -4.453  -6.807
 1009    HB   ILE 123           HB       ILE 123  -6.744  -4.161  -5.056
 1010   1HG1  ILE 123          HG12      ILE 123  -6.703  -6.081  -6.597
 1011   2HG1  ILE 123          HG11      ILE 123  -6.919  -6.630  -4.935
 1012   1HG2  ILE 123          HG21      ILE 123  -9.603  -4.455  -4.401
 1013   2HG2  ILE 123          HG23      ILE 123  -8.555  -5.643  -3.627
 1014   3HG2  ILE 123          HG22      ILE 123  -8.264  -3.921  -3.386
 1015   1HD1  ILE 123          HD11      ILE 123  -9.433  -6.614  -5.398
 1016   2HD1  ILE 123          HD13      ILE 123  -9.019  -6.411  -7.100
 1017   3HD1  ILE 123          HD12      ILE 123  -8.503  -7.856  -6.234
 1018    H    MET 124           HN       MET 124  -7.036  -1.708  -6.148
 1019    HA   MET 124           HA       MET 124  -8.821  -0.347  -4.369
 1020   1HB   MET 124           HB2      MET 124  -6.568   0.590  -6.133
 1021   2HB   MET 124           HB1      MET 124  -7.503   1.715  -5.144
 1022   1HG   MET 124           HG2      MET 124  -6.602  -0.717  -3.730
 1023   2HG   MET 124           HG1      MET 124  -5.306   0.362  -4.245
 1024   1HE   MET 124           HE3      MET 124  -5.555   2.634  -4.331
 1025   2HE   MET 124           HE2      MET 124  -6.701   3.661  -3.481
 1026   3HE   MET 124           HE1      MET 124  -5.178   3.227  -2.709
 1027    NH1  ARG 125           NH2      ARG 125 -11.274   0.854 -14.781
 1028    NH2  ARG 125           NH1      ARG 125 -12.739  -0.726 -14.099
 1029    H    ARG 125           HN       ARG 125  -8.775  -0.580  -7.869
 1030    HA   ARG 125           HA       ARG 125 -10.702   1.641  -8.112
 1031   1HB   ARG 125           HB2      ARG 125  -8.817   1.107  -9.790
 1032   2HB   ARG 125           HB1      ARG 125  -9.863  -0.199 -10.346
 1033   1HG   ARG 125           HG2      ARG 125 -11.692   1.710 -10.395
 1034   2HG   ARG 125           HG1      ARG 125 -10.283   2.764 -10.511
 1035   1HD   ARG 125           HD2      ARG 125 -10.680   2.329 -12.758
 1036   2HD   ARG 125           HD1      ARG 125  -9.538   1.040 -12.373
 1037    HE   ARG 125           HE       ARG 125 -11.995  -0.103 -11.847
 1038   1HH1  ARG 125          HH21      ARG 125 -10.591   1.554 -14.582
 1039   2HH1  ARG 125          HH22      ARG 125 -11.524   0.660 -15.729
 1040   1HH2  ARG 125          HH11      ARG 125 -13.183  -1.242 -13.368
 1041   2HH2  ARG 125          HH12      ARG 125 -12.977  -0.905 -15.054
 1042    H    GLU 126           HN       GLU 126 -10.747  -1.690  -9.402
 1043    HA   GLU 126           HA       GLU 126 -13.513  -1.822  -9.862
 1044   1HB   GLU 126           HB2      GLU 126 -11.374  -3.558 -10.119
 1045   2HB   GLU 126           HB1      GLU 126 -12.388  -4.356  -8.917
 1046   1HG   GLU 126           HG2      GLU 126 -14.336  -3.747 -10.582
 1047   2HG   GLU 126           HG1      GLU 126 -13.028  -3.650 -11.762
 1048    H    LYS 127           HN       LYS 127 -11.798  -2.109  -6.818
 1049    HA   LYS 127           HA       LYS 127 -14.189  -3.229  -5.504
 1050   1HB   LYS 127           HB2      LYS 127 -11.612  -3.702  -5.013
 1051   2HB   LYS 127           HB1      LYS 127 -11.844  -2.353  -3.896
 1052   1HG   LYS 127           HG2      LYS 127 -12.349  -4.405  -2.712
 1053   2HG   LYS 127           HG1      LYS 127 -13.868  -3.555  -3.001
 1054   1HD   LYS 127           HD2      LYS 127 -14.639  -5.412  -4.014
 1055   2HD   LYS 127           HD1      LYS 127 -13.451  -5.139  -5.290
 1056   1HE   LYS 127           HE2      LYS 127 -11.795  -6.465  -4.097
 1057   2HE   LYS 127           HE1      LYS 127 -12.884  -6.648  -2.722
 1058   1HZ   LYS 127           HZ1      LYS 127 -14.126  -7.436  -5.160
 1059   2HZ   LYS 127           HZ3      LYS 127 -12.699  -8.313  -4.891
 1060   3HZ   LYS 127           HZ2      LYS 127 -13.927  -8.314  -3.719
 1061    OH   TYR 128           OH       TYR 128 -12.706   6.097  -8.144
 1062    H    TYR 128           HN       TYR 128 -12.238  -0.189  -5.206
 1063    HA   TYR 128           HA       TYR 128 -14.115   0.910  -3.289
 1064   1HB   TYR 128           HB2      TYR 128 -12.636   2.603  -3.102
 1065   2HB   TYR 128           HB1      TYR 128 -11.593   1.613  -4.117
 1066    HD1  TYR 128           HD2      TYR 128 -12.097   1.815  -6.724
 1067    HD2  TYR 128           HD1      TYR 128 -13.104   4.781  -3.797
 1068    HE1  TYR 128           HE2      TYR 128 -12.159   3.534  -8.503
 1069    HE2  TYR 128           HE1      TYR 128 -13.169   6.507  -5.573
 1070    HH   TYR 128           HH       TYR 128 -13.467   6.659  -7.983
 1071    H    SER 129           HN       SER 129 -14.462   0.394  -6.618
 1072    HA   SER 129           HA       SER 129 -16.135   2.791  -7.044
 1073   1HB   SER 129           HB2      SER 129 -14.936   0.688  -8.747
 1074   2HB   SER 129           HB1      SER 129 -16.513   1.273  -9.269
 1075    HG   SER 129           HG       SER 129 -15.237   2.764 -10.119
 1076    H    LYS 130           HN       LYS 130 -16.835   0.417  -5.152
 1077    HA   LYS 130           HA       LYS 130 -19.516  -0.127  -6.357
 1078   1HB   LYS 130           HB2      LYS 130 -17.942  -1.866  -4.429
 1079   2HB   LYS 130           HB1      LYS 130 -19.530  -2.241  -5.100
 1080   1HG   LYS 130           HG2      LYS 130 -17.851  -1.604  -7.296
 1081   2HG   LYS 130           HG1      LYS 130 -16.937  -2.702  -6.262
 1082   1HD   LYS 130           HD2      LYS 130 -19.436  -3.855  -6.247
 1083   2HD   LYS 130           HD1      LYS 130 -19.334  -3.220  -7.890
 1084   1HE   LYS 130           HE2      LYS 130 -17.185  -4.919  -6.592
 1085   2HE   LYS 130           HE1      LYS 130 -18.434  -5.553  -7.663
 1086   1HZ   LYS 130           HZ3      LYS 130 -16.898  -3.261  -8.611
 1087   2HZ   LYS 130           HZ2      LYS 130 -16.092  -4.755  -8.549
 1088   3HZ   LYS 130           HZ1      LYS 130 -17.509  -4.588  -9.472
 1089    H    CYS 131           HN       CYS 131 -18.696   2.149  -4.667
 1090    HA   CYS 131           HA       CYS 131 -20.301   1.544  -2.216
 1091   1HB   CYS 131           HB2      CYS 131 -17.758   2.538  -2.311
 1092   2HB   CYS 131           HB1      CYS 131 -18.697   4.029  -2.285
 1093    H    SER 132           HN       SER 132 -19.760   3.874  -4.834
 1094    HA   SER 132           HA       SER 132 -22.349   5.174  -4.090
 1095   1HB   SER 132           HB2      SER 132 -20.031   6.264  -5.715
 1096   2HB   SER 132           HB1      SER 132 -21.533   7.123  -5.389
 1097    HG   SER 132           HG       SER 132 -19.934   7.692  -3.884
 1098    H    SER 133           HN       SER 133 -23.217   6.282  -6.329
 1099    HA   SER 133           HA       SER 133 -22.971   4.348  -8.561
 1100   1HB   SER 133           HB2      SER 133 -25.635   5.077  -7.308
 1101   2HB   SER 133           HB1      SER 133 -25.402   4.067  -8.732
 1102    HG   SER 133           HG       SER 133 -23.992   2.795  -7.219
   
  Start of MODEL          17
 Raw file had 1102 H/Q atoms
  Start of MODEL   17
    1   1H    GLU   1           HT2      GLU   1 -22.863  23.640  -2.384
    2   2H    GLU   1           HT1      GLU   1 -21.655  24.132  -3.473
    3   3H    GLU   1           HT3      GLU   1 -23.092  25.025  -3.341
    4    HA   GLU   1           HA       GLU   1 -24.070  23.800  -4.882
    5   1HB   GLU   1           HB2      GLU   1 -21.787  23.700  -5.828
    6   2HB   GLU   1           HB1      GLU   1 -21.466  22.241  -4.891
    7   1HG   GLU   1           HG2      GLU   1 -23.893  21.747  -6.231
    8   2HG   GLU   1           HG1      GLU   1 -22.842  22.509  -7.426
    9    H    ALA   2           HN       ALA   2 -22.142  21.219  -3.305
   10    HA   ALA   2           HA       ALA   2 -24.329  20.117  -1.830
   11   1HB   ALA   2           HB1      ALA   2 -23.881  19.043  -4.615
   12   2HB   ALA   2           HB3      ALA   2 -24.563  18.030  -3.343
   13   3HB   ALA   2           HB2      ALA   2 -25.402  19.496  -3.846
   14    H    GLU   3           HN       GLU   3 -23.419  18.774  -0.330
   15    HA   GLU   3           HA       GLU   3 -20.615  17.911  -0.790
   16   1HB   GLU   3           HB2      GLU   3 -22.319  17.877   1.721
   17   2HB   GLU   3           HB1      GLU   3 -20.620  17.411   1.639
   18   1HG   GLU   3           HG2      GLU   3 -20.263  19.770   0.593
   19   2HG   GLU   3           HG1      GLU   3 -21.841  20.141   1.291
   20    H    ALA   4           HN       ALA   4 -20.527  15.969  -1.822
   21    HA   ALA   4           HA       ALA   4 -22.558  13.980  -1.827
   22   1HB   ALA   4           HB3      ALA   4 -19.577  13.832  -2.339
   23   2HB   ALA   4           HB2      ALA   4 -20.651  12.455  -2.574
   24   3HB   ALA   4           HB1      ALA   4 -20.872  13.916  -3.532
   25    H    HIS   5           HN       HIS   5 -21.469  11.561  -1.047
   26    HA   HIS   5           HA       HIS   5 -21.587  11.817   1.886
   27   1HB   HIS   5           HB2      HIS   5 -22.484   9.899   0.071
   28   2HB   HIS   5           HB1      HIS   5 -21.092   9.132   0.835
   29    HD1  HIS   5           HD1      HIS   5 -24.382   8.761   1.308
   30    HD2  HIS   5           HD2      HIS   5 -21.521  10.337   3.899
   31    HE1  HIS   5           HE1      HIS   5 -25.346   8.568   3.642
   32    H    LYS   6           HN       LYS   6 -19.966   9.733   2.740
   33    HA   LYS   6           HA       LYS   6 -17.311  10.934   2.300
   34   1HB   LYS   6           HB2      LYS   6 -17.821   8.512   3.994
   35   2HB   LYS   6           HB1      LYS   6 -16.591   9.762   4.183
   36   1HG   LYS   6           HG2      LYS   6 -19.569  10.041   4.674
   37   2HG   LYS   6           HG1      LYS   6 -18.278  10.149   5.872
   38   1HD   LYS   6           HD2      LYS   6 -17.360  12.112   4.551
   39   2HD   LYS   6           HD1      LYS   6 -18.850  12.075   3.608
   40   1HE   LYS   6           HE2      LYS   6 -19.041  12.110   6.598
   41   2HE   LYS   6           HE1      LYS   6 -18.668  13.613   5.754
   42   1HZ   LYS   6           HZ2      LYS   6 -20.963  11.859   5.080
   43   2HZ   LYS   6           HZ1      LYS   6 -21.074  13.216   6.096
   44   3HZ   LYS   6           HZ3      LYS   6 -20.644  13.412   4.468
   45    H    CYS   7           HN       CYS   7 -16.674  10.305   0.283
   46    HA   CYS   7           HA       CYS   7 -15.587   7.642  -0.005
   47   1HB   CYS   7           HB2      CYS   7 -17.830   6.978  -0.539
   48   2HB   CYS   7           HB1      CYS   7 -18.065   8.382  -1.578
   49    H    ASP   8           HN       ASP   8 -16.892  10.160  -2.203
   50    HA   ASP   8           HA       ASP   8 -14.729  10.046  -4.035
   51   1HB   ASP   8           HB2      ASP   8 -16.955  11.885  -3.463
   52   2HB   ASP   8           HB1      ASP   8 -15.546  12.660  -4.191
   53    H    ILE   9           HN       ILE   9 -14.845  11.425  -0.852
   54    HA   ILE   9           HA       ILE   9 -12.523  13.153  -1.430
   55    HB   ILE   9           HB       ILE   9 -13.804  14.328   0.066
   56   1HG1  ILE   9          HG12      ILE   9 -12.358  12.755   2.170
   57   2HG1  ILE   9          HG11      ILE   9 -11.452  13.709   0.995
   58   1HG2  ILE   9          HG22      ILE   9 -14.695  11.672   1.053
   59   2HG2  ILE   9          HG21      ILE   9 -14.708  12.996   2.210
   60   3HG2  ILE   9          HG23      ILE   9 -15.629  13.121   0.714
   61   1HD1  ILE   9          HD13      ILE   9 -13.336  15.519   1.716
   62   2HD1  ILE   9          HD12      ILE   9 -13.203  14.604   3.218
   63   3HD1  ILE   9          HD11      ILE   9 -11.776  15.376   2.527
   64    H    THR  10           HN       THR  10 -13.015  10.920   1.320
   65    HA   THR  10           HA       THR  10 -10.192  10.493   1.590
   66    HB   THR  10           HB       THR  10 -12.453   8.824   2.710
   67    HG1  THR  10           HG1      THR  10 -11.868  10.256   4.569
   68   1HG2  THR  10          HG21      THR  10  -9.648   8.497   2.775
   69   2HG2  THR  10          HG23      THR  10 -10.109   9.115   4.361
   70   3HG2  THR  10          HG22      THR  10 -10.847   7.638   3.741
   71    H    LEU  11           HN       LEU  11 -12.755   8.401   0.183
   72    HA   LEU  11           HA       LEU  11 -10.951   6.221  -0.303
   73   1HB   LEU  11           HB2      LEU  11 -13.722   6.857  -0.927
   74   2HB   LEU  11           HB1      LEU  11 -12.929   6.009  -2.254
   75    HG   LEU  11           HG       LEU  11 -13.993   4.473  -0.573
   76   1HD1  LEU  11          HD12      LEU  11 -12.043   3.777  -1.973
   77   2HD1  LEU  11          HD11      LEU  11 -10.966   4.286  -0.674
   78   3HD1  LEU  11          HD13      LEU  11 -12.093   2.958  -0.412
   79   1HD2  LEU  11          HD21      LEU  11 -12.957   6.210   1.283
   80   2HD2  LEU  11          HD23      LEU  11 -13.503   4.573   1.648
   81   3HD2  LEU  11          HD22      LEU  11 -11.793   4.888   1.352
   82    H    GLN  12           HN       GLN  12 -12.088   8.832  -2.505
   83    HA   GLN  12           HA       GLN  12 -10.566   7.900  -4.750
   84   1HB   GLN  12           HB2      GLN  12 -11.601   9.610  -5.787
   85   2HB   GLN  12           HB1      GLN  12 -12.330  10.032  -4.239
   86   1HG   GLN  12           HG2      GLN  12 -10.377  11.461  -3.711
   87   2HG   GLN  12           HG1      GLN  12  -9.660  11.052  -5.271
   88   1HE2  GLN  12          HE22      GLN  12 -11.883  14.224  -5.310
   89   2HE2  GLN  12          HE21      GLN  12 -10.847  13.679  -4.080
   90    H    GLU  13           HN       GLU  13  -9.764  10.071  -2.074
   91    HA   GLU  13           HA       GLU  13  -7.232  10.936  -3.115
   92   1HB   GLU  13           HB2      GLU  13  -8.526  11.927  -1.141
   93   2HB   GLU  13           HB1      GLU  13  -7.901  10.584  -0.184
   94   1HG   GLU  13           HG2      GLU  13  -5.958  11.677   0.097
   95   2HG   GLU  13           HG1      GLU  13  -5.724  11.725  -1.651
   96    H    ILE  14           HN       ILE  14  -8.270   8.095  -1.329
   97    HA   ILE  14           HA       ILE  14  -5.621   7.136  -0.697
   98    HB   ILE  14           HB       ILE  14  -8.355   6.282  -0.311
   99   1HG1  ILE  14          HG12      ILE  14  -5.793   5.187   0.884
  100   2HG1  ILE  14          HG11      ILE  14  -6.534   6.704   1.396
  101   1HG2  ILE  14          HG22      ILE  14  -6.410   4.155  -1.261
  102   2HG2  ILE  14          HG21      ILE  14  -7.953   3.827  -0.481
  103   3HG2  ILE  14          HG23      ILE  14  -7.917   4.614  -2.057
  104   1HD1  ILE  14          HD11      ILE  14  -8.698   5.263   1.675
  105   2HD1  ILE  14          HD13      ILE  14  -7.579   3.899   1.697
  106   3HD1  ILE  14          HD12      ILE  14  -7.446   5.169   2.914
  107    H    ILE  15           HN       ILE  15  -7.804   6.778  -3.437
  108    HA   ILE  15           HA       ILE  15  -6.341   4.659  -4.729
  109    HB   ILE  15           HB       ILE  15  -8.404   6.663  -5.609
  110   1HG1  ILE  15          HG12      ILE  15  -8.759   3.801  -6.146
  111   2HG1  ILE  15          HG11      ILE  15  -8.493   4.147  -4.438
  112   1HG2  ILE  15          HG23      ILE  15  -6.579   5.022  -7.306
  113   2HG2  ILE  15          HG22      ILE  15  -8.278   5.100  -7.774
  114   3HG2  ILE  15          HG21      ILE  15  -7.330   6.581  -7.647
  115   1HD1  ILE  15          HD11      ILE  15 -10.397   5.906  -5.919
  116   2HD1  ILE  15          HD13      ILE  15 -10.932   4.272  -5.524
  117   3HD1  ILE  15          HD12      ILE  15 -10.435   5.373  -4.239
  118    H    LYS  16           HN       LYS  16  -6.234   8.209  -4.999
  119    HA   LYS  16           HA       LYS  16  -4.359   8.312  -7.153
  120   1HB   LYS  16           HB2      LYS  16  -5.124  10.214  -4.952
  121   2HB   LYS  16           HB1      LYS  16  -3.776  10.593  -6.023
  122   1HG   LYS  16           HG2      LYS  16  -5.473   9.984  -7.930
  123   2HG   LYS  16           HG1      LYS  16  -6.690  10.293  -6.689
  124   1HD   LYS  16           HD2      LYS  16  -4.562  12.332  -6.843
  125   2HD   LYS  16           HD1      LYS  16  -5.584  12.232  -8.277
  126   1HE   LYS  16           HE2      LYS  16  -7.573  12.236  -6.627
  127   2HE   LYS  16           HE1      LYS  16  -6.405  12.794  -5.429
  128   1HZ   LYS  16           HZ1      LYS  16  -5.835  14.443  -7.403
  129   2HZ   LYS  16           HZ3      LYS  16  -7.467  14.165  -7.773
  130   3HZ   LYS  16           HZ2      LYS  16  -7.036  14.786  -6.251
  131    H    THR  17           HN       THR  17  -3.886   8.373  -3.619
  132    HA   THR  17           HA       THR  17  -1.053   8.560  -3.638
  133    HB   THR  17           HB       THR  17  -2.507   6.868  -1.617
  134    HG1  THR  17           HG1      THR  17  -2.457   9.687  -1.551
  135   1HG2  THR  17          HG22      THR  17   0.077   7.757  -1.808
  136   2HG2  THR  17          HG21      THR  17  -0.657   9.019  -0.818
  137   3HG2  THR  17          HG23      THR  17  -0.722   7.336  -0.294
  138    H    LEU  18           HN       LEU  18  -3.213   5.784  -3.967
  139    HA   LEU  18           HA       LEU  18  -1.275   3.715  -3.778
  140   1HB   LEU  18           HB2      LEU  18  -3.938   3.711  -4.100
  141   2HB   LEU  18           HB1      LEU  18  -3.477   3.463  -5.783
  142    HG   LEU  18           HG       LEU  18  -3.751   1.297  -4.687
  143   1HD1  LEU  18          HD13      LEU  18  -1.769   1.881  -6.306
  144   2HD1  LEU  18          HD12      LEU  18  -0.773   1.671  -4.866
  145   3HD1  LEU  18          HD11      LEU  18  -1.763   0.338  -5.455
  146   1HD2  LEU  18          HD23      LEU  18  -2.640   2.655  -2.474
  147   2HD2  LEU  18          HD22      LEU  18  -3.134   0.963  -2.544
  148   3HD2  LEU  18          HD21      LEU  18  -1.468   1.410  -2.909
  149    H    ASN  19           HN       ASN  19  -2.294   5.722  -6.528
  150    HA   ASN  19           HA       ASN  19  -0.666   4.330  -8.464
  151   1HB   ASN  19           HB2      ASN  19  -2.055   5.591  -9.725
  152   2HB   ASN  19           HB1      ASN  19  -2.374   6.703  -8.393
  153   1HD2  ASN  19          HD22      ASN  19   0.336   7.704 -11.235
  154   2HD2  ASN  19          HD21      ASN  19  -0.537   6.250 -11.313
  155    H    SER  20           HN       SER  20  -0.051   6.908  -6.162
  156    HA   SER  20           HA       SER  20   2.358   7.919  -7.341
  157   1HB   SER  20           HB2      SER  20   1.002   8.943  -5.426
  158   2HB   SER  20           HB1      SER  20   1.794   7.775  -4.372
  159    HG   SER  20           HG       SER  20   3.785   8.682  -5.529
  160    H    LEU  21           HN       LEU  21   1.800   5.359  -4.919
  161    HA   LEU  21           HA       LEU  21   4.586   4.726  -4.575
  162   1HB   LEU  21           HB2      LEU  21   2.268   2.812  -4.204
  163   2HB   LEU  21           HB1      LEU  21   3.827   2.795  -3.377
  164    HG   LEU  21           HG       LEU  21   1.556   4.753  -3.044
  165   1HD1  LEU  21          HD11      LEU  21   2.769   2.576  -1.529
  166   2HD1  LEU  21          HD13      LEU  21   2.713   4.073  -0.599
  167   3HD1  LEU  21          HD12      LEU  21   1.228   3.396  -1.269
  168   1HD2  LEU  21          HD22      LEU  21   4.495   5.085  -2.437
  169   2HD2  LEU  21          HD21      LEU  21   3.403   6.223  -3.226
  170   3HD2  LEU  21          HD23      LEU  21   3.269   5.930  -1.492
  171    H    THR  22           HN       THR  22   2.448   4.124  -7.198
  172    HA   THR  22           HA       THR  22   3.902   1.717  -8.086
  173    HB   THR  22           HB       THR  22   1.963   3.107  -9.873
  174    HG1  THR  22           HG1      THR  22   0.819   1.499  -7.962
  175   1HG2  THR  22          HG23      THR  22   3.151   0.839 -10.226
  176   2HG2  THR  22          HG22      THR  22   2.039   0.220  -9.005
  177   3HG2  THR  22          HG21      THR  22   1.410   0.900 -10.506
  178    H    GLU  23           HN       GLU  23   4.959   4.716  -8.007
  179    HA   GLU  23           HA       GLU  23   5.580   5.152 -10.839
  180   1HB   GLU  23           HB2      GLU  23   5.376   6.837  -8.699
  181   2HB   GLU  23           HB1      GLU  23   7.125   6.622  -8.791
  182   1HG   GLU  23           HG2      GLU  23   5.557   7.196 -11.291
  183   2HG   GLU  23           HG1      GLU  23   6.002   8.516 -10.208
  184    H    GLN  24           HN       GLN  24   7.458   4.442  -7.896
  185    HA   GLN  24           HA       GLN  24   9.695   3.492  -9.628
  186   1HB   GLN  24           HB2      GLN  24   9.496   4.723  -6.957
  187   2HB   GLN  24           HB1      GLN  24  10.599   3.351  -7.022
  188   1HG   GLN  24           HG2      GLN  24  12.140   4.596  -8.083
  189   2HG   GLN  24           HG1      GLN  24  10.989   4.966  -9.366
  190   1HE2  GLN  24          HE22      GLN  24   9.791   7.882  -7.316
  191   2HE2  GLN  24          HE21      GLN  24   9.062   6.446  -7.850
  192    H    LYS  25           HN       LYS  25   7.575   1.809  -9.716
  193    HA   LYS  25           HA       LYS  25   7.979  -0.262  -7.646
  194   1HB   LYS  25           HB2      LYS  25   6.029  -1.369  -8.710
  195   2HB   LYS  25           HB1      LYS  25   5.665   0.293  -8.243
  196   1HG   LYS  25           HG2      LYS  25   5.214   0.851 -10.375
  197   2HG   LYS  25           HG1      LYS  25   6.781   0.242 -10.906
  198   1HD   LYS  25           HD2      LYS  25   4.933  -0.963 -12.021
  199   2HD   LYS  25           HD1      LYS  25   5.876  -2.046 -10.997
  200   1HE   LYS  25           HE2      LYS  25   3.818  -0.862  -9.398
  201   2HE   LYS  25           HE1      LYS  25   3.080  -1.506 -10.865
  202   1HZ   LYS  25           HZ1      LYS  25   4.995  -3.049  -9.214
  203   2HZ   LYS  25           HZ3      LYS  25   3.319  -3.105  -8.965
  204   3HZ   LYS  25           HZ2      LYS  25   3.975  -3.628 -10.442
  205    H    THR  26           HN       THR  26  10.262  -0.432  -8.722
  206    HA   THR  26           HA       THR  26  10.195  -2.819 -10.429
  207    HB   THR  26           HB       THR  26  12.041  -1.360 -11.846
  208    HG1  THR  26           HG1      THR  26   9.852   0.362 -11.698
  209   1HG2  THR  26          HG22      THR  26   9.242  -2.236 -12.221
  210   2HG2  THR  26          HG21      THR  26   9.797  -0.992 -13.341
  211   3HG2  THR  26          HG23      THR  26  10.659  -2.526 -13.230
  212    H    LEU  27           HN       LEU  27  12.394  -0.225  -9.322
  213    HA   LEU  27           HA       LEU  27  14.455  -2.258  -8.732
  214   1HB   LEU  27           HB2      LEU  27  14.415   0.564  -9.351
  215   2HB   LEU  27           HB1      LEU  27  15.282   0.301  -7.837
  216    HG   LEU  27           HG       LEU  27  16.819   0.133  -9.755
  217   1HD1  LEU  27          HD11      LEU  27  16.769  -1.497  -7.643
  218   2HD1  LEU  27          HD13      LEU  27  16.475  -2.709  -8.890
  219   3HD1  LEU  27          HD12      LEU  27  17.937  -1.723  -8.946
  220   1HD2  LEU  27          HD22      LEU  27  14.593  -1.311 -10.870
  221   2HD2  LEU  27          HD21      LEU  27  16.069  -0.779 -11.674
  222   3HD2  LEU  27          HD23      LEU  27  16.016  -2.353 -10.879
  223    H    CYS  28           HN       CYS  28  12.411   0.078  -6.992
  224    HA   CYS  28           HA       CYS  28  13.527  -0.784  -4.417
  225   1HB   CYS  28           HB2      CYS  28  11.635   1.295  -5.346
  226   2HB   CYS  28           HB1      CYS  28  11.303   0.634  -3.744
  227    H    THR  29           HN       THR  29  11.196  -2.020  -6.552
  228    HA   THR  29           HA       THR  29   9.517  -3.183  -4.431
  229    HB   THR  29           HB       THR  29   8.442  -4.308  -6.503
  230    HG1  THR  29           HG1      THR  29   8.993  -3.446  -8.427
  231   1HG2  THR  29          HG22      THR  29   8.466  -1.335  -5.978
  232   2HG2  THR  29          HG21      THR  29   7.325  -2.100  -7.085
  233   3HG2  THR  29          HG23      THR  29   7.318  -2.528  -5.377
  234    H    GLU  30           HN       GLU  30  12.511  -3.912  -5.243
  235    HA   GLU  30           HA       GLU  30  12.170  -6.783  -5.793
  236   1HB   GLU  30           HB2      GLU  30  14.605  -6.807  -5.950
  237   2HB   GLU  30           HB1      GLU  30  13.993  -5.422  -6.852
  238   1HG   GLU  30           HG2      GLU  30  15.280  -4.077  -5.604
  239   2HG   GLU  30           HG1      GLU  30  14.353  -4.547  -4.180
  240    H    LEU  31           HN       LEU  31  10.899  -6.416  -3.489
  241    HA   LEU  31           HA       LEU  31  12.701  -7.584  -1.450
  242   1HB   LEU  31           HB2      LEU  31  10.681  -5.443  -0.751
  243   2HB   LEU  31           HB1      LEU  31  11.947  -6.114   0.278
  244    HG   LEU  31           HG       LEU  31  12.496  -4.552  -2.261
  245   1HD1  LEU  31          HD12      LEU  31  12.087  -3.705   0.579
  246   2HD1  LEU  31          HD11      LEU  31  13.336  -2.890  -0.364
  247   3HD1  LEU  31          HD13      LEU  31  11.660  -2.866  -0.912
  248   1HD2  LEU  31          HD22      LEU  31  14.108  -6.282  -0.835
  249   2HD2  LEU  31          HD21      LEU  31  14.691  -4.972  -1.861
  250   3HD2  LEU  31          HD23      LEU  31  14.510  -4.717  -0.125
  251    H    THR  32           HN       THR  32  11.692  -9.564  -1.794
  252    HA   THR  32           HA       THR  32   9.000 -10.193  -2.131
  253    HB   THR  32           HB       THR  32   9.610 -12.338  -0.832
  254    HG1  THR  32           HG1      THR  32  12.002 -12.438  -0.738
  255   1HG2  THR  32          HG22      THR  32  10.999 -11.281  -3.285
  256   2HG2  THR  32          HG21      THR  32  11.324 -12.913  -2.702
  257   3HG2  THR  32          HG23      THR  32   9.688 -12.457  -3.181
  258    H    VAL  33           HN       VAL  33   7.705  -8.812  -0.976
  259    HA   VAL  33           HA       VAL  33   7.729  -8.922   1.959
  260    HB   VAL  33           HB       VAL  33   5.595  -7.445   1.620
  261   1HG1  VAL  33          HG11      VAL  33   8.319  -6.922   1.844
  262   2HG1  VAL  33          HG13      VAL  33   7.804  -5.905   0.499
  263   3HG1  VAL  33          HG12      VAL  33   7.016  -5.753   2.069
  264   1HG2  VAL  33          HG23      VAL  33   5.842  -8.146  -0.999
  265   2HG2  VAL  33          HG22      VAL  33   5.100  -6.638  -0.468
  266   3HG2  VAL  33          HG21      VAL  33   6.785  -6.656  -0.985
  267    H    THR  34           HN       THR  34   4.606  -8.963   0.302
  268    HA   THR  34           HA       THR  34   4.213 -11.811   0.654
  269    HB   THR  34           HB       THR  34   3.471  -9.919   2.795
  270    HG1  THR  34           HG1      THR  34   3.587 -11.858   3.961
  271   1HG2  THR  34          HG22      THR  34   1.491 -11.917   1.681
  272   2HG2  THR  34          HG21      THR  34   1.404 -11.296   3.329
  273   3HG2  THR  34          HG23      THR  34   1.242 -10.194   1.962
  274    H    ASP  35           HN       ASP  35   2.430 -12.500  -0.514
  275    HA   ASP  35           HA       ASP  35   0.864 -10.355  -1.876
  276   1HB   ASP  35           HB2      ASP  35   2.035 -12.850  -2.758
  277   2HB   ASP  35           HB1      ASP  35   0.296 -12.860  -3.048
  278    H    ILE  36           HN       ILE  36  -0.991  -9.985  -0.735
  279    HA   ILE  36           HA       ILE  36  -2.311 -12.231   0.665
  280    HB   ILE  36           HB       ILE  36  -3.403 -10.625   1.937
  281   1HG1  ILE  36          HG12      ILE  36  -3.318  -9.024  -0.605
  282   2HG1  ILE  36          HG11      ILE  36  -4.694  -9.395   0.435
  283   1HG2  ILE  36          HG23      ILE  36  -0.840 -10.358   1.928
  284   2HG2  ILE  36          HG22      ILE  36  -1.113  -8.917   0.949
  285   3HG2  ILE  36          HG21      ILE  36  -1.779  -9.014   2.579
  286   1HD1  ILE  36          HD12      ILE  36  -3.501  -7.941   2.208
  287   2HD1  ILE  36          HD11      ILE  36  -2.514  -7.354   0.871
  288   3HD1  ILE  36          HD13      ILE  36  -4.260  -7.107   0.852
  289    H    PHE  37           HN       PHE  37  -2.336 -11.736  -2.410
  290    HA   PHE  37           HA       PHE  37  -5.312 -11.682  -2.709
  291   1HB   PHE  37           HB2      PHE  37  -3.228 -11.187  -4.855
  292   2HB   PHE  37           HB1      PHE  37  -4.970 -10.957  -4.998
  293    HD1  PHE  37           HD2      PHE  37  -6.104  -9.117  -3.798
  294    HD2  PHE  37           HD1      PHE  37  -1.837  -9.591  -3.688
  295    HE1  PHE  37           HE2      PHE  37  -5.869  -6.802  -2.939
  296    HE2  PHE  37           HE1      PHE  37  -1.600  -7.277  -2.830
  297    HZ   PHE  37           HZ       PHE  37  -3.617  -5.882  -2.455
  298    H    ALA  38           HN       ALA  38  -3.614 -14.006  -1.962
  299    HA   ALA  38           HA       ALA  38  -3.311 -15.710  -4.272
  300   1HB   ALA  38           HB3      ALA  38  -2.858 -15.881  -1.427
  301   2HB   ALA  38           HB2      ALA  38  -3.703 -17.326  -1.983
  302   3HB   ALA  38           HB1      ALA  38  -2.166 -16.868  -2.715
  303    H    ALA  39           HN       ALA  39  -5.901 -15.196  -1.915
  304    HA   ALA  39           HA       ALA  39  -7.861 -16.278  -3.778
  305   1HB   ALA  39           HB2      ALA  39  -6.666 -18.242  -2.417
  306   2HB   ALA  39           HB1      ALA  39  -7.827 -17.755  -1.182
  307   3HB   ALA  39           HB3      ALA  39  -8.394 -18.285  -2.766
  308    H    SER  40           HN       SER  40  -8.585 -14.057  -3.326
  309    HA   SER  40           HA       SER  40  -9.341 -13.206  -0.684
  310   1HB   SER  40           HB2      SER  40 -10.460 -12.280  -3.346
  311   2HB   SER  40           HB1      SER  40 -10.530 -11.404  -1.818
  312    HG   SER  40           HG       SER  40  -8.770 -10.594  -2.801
  313    H    LYS  41           HN       LYS  41 -10.762 -14.495   0.434
  314    HA   LYS  41           HA       LYS  41 -13.260 -15.323  -0.984
  315   1HB   LYS  41           HB2      LYS  41 -11.443 -16.736   0.791
  316   2HB   LYS  41           HB1      LYS  41 -13.092 -16.755   1.420
  317   1HG   LYS  41           HG2      LYS  41 -12.748 -17.278  -1.494
  318   2HG   LYS  41           HG1      LYS  41 -12.240 -18.552  -0.384
  319   1HD   LYS  41           HD2      LYS  41 -14.714 -17.619   0.600
  320   2HD   LYS  41           HD1      LYS  41 -14.917 -17.775  -1.146
  321   1HE   LYS  41           HE2      LYS  41 -13.815 -20.082  -0.908
  322   2HE   LYS  41           HE1      LYS  41 -14.074 -19.902   0.828
  323   1HZ   LYS  41           HZ3      LYS  41 -16.441 -19.204  -0.472
  324   2HZ   LYS  41           HZ2      LYS  41 -15.917 -20.676  -1.137
  325   3HZ   LYS  41           HZ1      LYS  41 -16.158 -20.536   0.539
  326    H    ASP  42           HN       ASP  42 -11.928 -13.754   1.877
  327    HA   ASP  42           HA       ASP  42 -14.673 -12.748   2.469
  328   1HB   ASP  42           HB2      ASP  42 -12.820 -14.231   4.272
  329   2HB   ASP  42           HB1      ASP  42 -13.701 -12.871   4.968
  330    H    THR  43           HN       THR  43 -11.953 -11.704   1.299
  331    HA   THR  43           HA       THR  43 -11.630  -9.439   3.201
  332    HB   THR  43           HB       THR  43  -9.568  -8.930   2.051
  333    HG1  THR  43           HG1      THR  43  -9.131 -10.766   0.360
  334   1HG2  THR  43          HG22      THR  43  -9.994 -11.209   3.525
  335   2HG2  THR  43          HG21      THR  43  -9.218 -11.851   2.077
  336   3HG2  THR  43          HG23      THR  43  -8.408 -10.613   3.036
  337    H    THR  44           HN       THR  44 -13.019  -7.853   2.747
  338    HA   THR  44           HA       THR  44 -13.884  -7.433  -0.018
  339    HB   THR  44           HB       THR  44 -14.740  -6.056   2.534
  340    HG1  THR  44           HG1      THR  44 -15.249  -8.435   1.604
  341   1HG2  THR  44          HG22      THR  44 -15.099  -5.289  -0.178
  342   2HG2  THR  44          HG21      THR  44 -16.642  -5.931   0.384
  343   3HG2  THR  44          HG23      THR  44 -15.875  -4.600   1.249
  344    H    GLU  45           HN       GLU  45 -13.392  -4.717   2.170
  345    HA   GLU  45           HA       GLU  45 -11.197  -3.802   0.381
  346   1HB   GLU  45           HB2      GLU  45 -12.132  -1.618   0.143
  347   2HB   GLU  45           HB1      GLU  45 -13.446  -2.737  -0.211
  348   1HG   GLU  45           HG2      GLU  45 -14.203  -2.504   2.173
  349   2HG   GLU  45           HG1      GLU  45 -12.972  -1.259   2.393
  350    H    LYS  46           HN       LYS  46 -12.918  -3.308   3.457
  351    HA   LYS  46           HA       LYS  46 -10.662  -1.895   4.633
  352   1HB   LYS  46           HB2      LYS  46 -11.956  -2.038   6.712
  353   2HB   LYS  46           HB1      LYS  46 -13.007  -1.536   5.388
  354   1HG   LYS  46           HG2      LYS  46 -13.867  -3.797   5.142
  355   2HG   LYS  46           HG1      LYS  46 -12.730  -4.402   6.346
  356   1HD   LYS  46           HD2      LYS  46 -14.504  -2.152   7.168
  357   2HD   LYS  46           HD1      LYS  46 -15.252  -3.739   6.981
  358   1HE   LYS  46           HE2      LYS  46 -13.594  -4.721   8.505
  359   2HE   LYS  46           HE1      LYS  46 -12.803  -3.153   8.672
  360   1HZ   LYS  46           HZ2      LYS  46 -15.565  -2.888   9.175
  361   2HZ   LYS  46           HZ1      LYS  46 -14.938  -4.135  10.144
  362   3HZ   LYS  46           HZ3      LYS  46 -14.259  -2.583  10.218
  363    H    GLU  47           HN       GLU  47 -11.627  -5.227   4.186
  364    HA   GLU  47           HA       GLU  47  -9.911  -6.251   6.324
  365   1HB   GLU  47           HB2      GLU  47 -11.976  -7.383   5.134
  366   2HB   GLU  47           HB1      GLU  47 -10.765  -7.876   3.951
  367   1HG   GLU  47           HG2      GLU  47 -10.848  -9.650   5.543
  368   2HG   GLU  47           HG1      GLU  47  -9.389  -8.736   5.930
  369    H    THR  48           HN       THR  48  -9.734  -5.884   2.788
  370    HA   THR  48           HA       THR  48  -7.149  -7.088   2.490
  371    HB   THR  48           HB       THR  48  -8.105  -4.874   0.698
  372    HG1  THR  48           HG1      THR  48  -9.757  -6.017   0.069
  373   1HG2  THR  48          HG22      THR  48  -6.625  -7.488   0.382
  374   2HG2  THR  48          HG21      THR  48  -7.288  -6.614  -0.999
  375   3HG2  THR  48          HG23      THR  48  -6.054  -5.862   0.011
  376    H    PHE  49           HN       PHE  49  -8.105  -3.733   3.237
  377    HA   PHE  49           HA       PHE  49  -5.376  -2.735   2.939
  378   1HB   PHE  49           HB2      PHE  49  -7.709  -1.481   4.410
  379   2HB   PHE  49           HB1      PHE  49  -6.214  -0.670   3.956
  380    HD1  PHE  49           HD2      PHE  49  -5.838  -1.915   1.214
  381    HD2  PHE  49           HD1      PHE  49  -9.288  -0.260   3.161
  382    HE1  PHE  49           HE2      PHE  49  -6.831  -1.391  -0.996
  383    HE2  PHE  49           HE1      PHE  49 -10.277   0.263   0.963
  384    HZ   PHE  49           HZ       PHE  49  -9.056  -0.301  -1.125
  385    H    CYS  50           HN       CYS  50  -7.288  -4.069   5.546
  386    HA   CYS  50           HA       CYS  50  -5.679  -3.148   7.754
  387   1HB   CYS  50           HB2      CYS  50  -7.954  -4.209   7.939
  388   2HB   CYS  50           HB1      CYS  50  -7.266  -5.750   7.435
  389    NH1  ARG  51           NH2      ARG  51  -6.662 -12.686   4.796
  390    NH2  ARG  51           NH1      ARG  51  -7.875 -12.899   6.691
  391    H    ARG  51           HN       ARG  51  -5.713  -6.377   6.120
  392    HA   ARG  51           HA       ARG  51  -3.319  -7.332   7.335
  393   1HB   ARG  51           HB2      ARG  51  -4.601  -8.008   4.672
  394   2HB   ARG  51           HB1      ARG  51  -3.238  -8.896   5.354
  395   1HG   ARG  51           HG2      ARG  51  -4.634  -9.283   7.422
  396   2HG   ARG  51           HG1      ARG  51  -6.004  -8.591   6.550
  397   1HD   ARG  51           HD2      ARG  51  -5.662 -10.307   4.759
  398   2HD   ARG  51           HD1      ARG  51  -4.409 -11.044   5.757
  399    HE   ARG  51           HE       ARG  51  -6.615 -10.928   7.431
  400   1HH1  ARG  51          HH21      ARG  51  -5.969 -12.216   4.252
  401   2HH1  ARG  51          HH22      ARG  51  -7.130 -13.484   4.418
  402   1HH2  ARG  51          HH11      ARG  51  -8.112 -12.587   7.611
  403   2HH2  ARG  51          HH12      ARG  51  -8.333 -13.697   6.300
  404    H    ALA  52           HN       ALA  52  -3.790  -5.804   4.132
  405    HA   ALA  52           HA       ALA  52  -1.020  -5.749   3.434
  406   1HB   ALA  52           HB1      ALA  52  -3.458  -4.270   2.528
  407   2HB   ALA  52           HB3      ALA  52  -1.875  -3.689   2.018
  408   3HB   ALA  52           HB2      ALA  52  -2.386  -5.326   1.610
  409    H    ALA  53           HN       ALA  53  -2.787  -3.867   5.724
  410    HA   ALA  53           HA       ALA  53  -1.057  -1.531   5.614
  411   1HB   ALA  53           HB2      ALA  53  -3.075  -2.510   7.648
  412   2HB   ALA  53           HB1      ALA  53  -2.127  -1.045   7.881
  413   3HB   ALA  53           HB3      ALA  53  -3.246  -1.164   6.525
  414    H    THR  54           HN       THR  54  -1.198  -4.559   7.416
  415    HA   THR  54           HA       THR  54   0.878  -3.872   9.311
  416    HB   THR  54           HB       THR  54  -0.566  -6.325   8.472
  417    HG1  THR  54           HG1      THR  54   0.241  -6.257  11.004
  418   1HG2  THR  54          HG22      THR  54   2.260  -6.373   9.537
  419   2HG2  THR  54          HG21      THR  54   1.150  -7.727   9.739
  420   3HG2  THR  54          HG23      THR  54   1.620  -7.207   8.121
  421    H    VAL  55           HN       VAL  55   0.839  -5.659   6.238
  422    HA   VAL  55           HA       VAL  55   3.654  -6.148   6.108
  423    HB   VAL  55           HB       VAL  55   1.844  -5.660   3.724
  424   1HG1  VAL  55          HG11      VAL  55   4.393  -7.173   4.266
  425   2HG1  VAL  55          HG13      VAL  55   3.340  -7.654   2.935
  426   3HG1  VAL  55          HG12      VAL  55   4.036  -6.034   2.968
  427   1HG2  VAL  55          HG23      VAL  55   1.804  -7.814   5.778
  428   2HG2  VAL  55          HG22      VAL  55   0.511  -7.240   4.724
  429   3HG2  VAL  55          HG21      VAL  55   1.732  -8.349   4.099
  430    H    LEU  56           HN       LEU  56   1.649  -3.388   5.281
  431    HA   LEU  56           HA       LEU  56   3.642  -1.906   3.832
  432   1HB   LEU  56           HB2      LEU  56   0.940  -1.490   4.787
  433   2HB   LEU  56           HB1      LEU  56   1.933  -0.075   5.141
  434    HG   LEU  56           HG       LEU  56   2.708  -0.081   2.762
  435   1HD1  LEU  56          HD11      LEU  56   1.641  -2.657   2.772
  436   2HD1  LEU  56          HD13      LEU  56   0.497  -1.729   1.804
  437   3HD1  LEU  56          HD12      LEU  56   2.201  -1.772   1.353
  438   1HD2  LEU  56          HD21      LEU  56   0.101   0.590   3.799
  439   2HD2  LEU  56          HD23      LEU  56   1.041   1.425   2.562
  440   3HD2  LEU  56          HD22      LEU  56  -0.046   0.113   2.107
  441    NH1  ARG  57           NH2      ARG  57   2.635  -0.615  14.500
  442    NH2  ARG  57           NH1      ARG  57   2.151   1.590  14.411
  443    H    ARG  57           HN       ARG  57   2.840  -2.271   7.240
  444    HA   ARG  57           HA       ARG  57   4.424  -0.092   8.225
  445   1HB   ARG  57           HB2      ARG  57   2.982  -2.368   9.333
  446   2HB   ARG  57           HB1      ARG  57   4.515  -2.112  10.168
  447   1HG   ARG  57           HG2      ARG  57   3.704   0.440  10.037
  448   2HG   ARG  57           HG1      ARG  57   2.122  -0.341  10.014
  449   1HD   ARG  57           HD2      ARG  57   2.612  -1.523  12.077
  450   2HD   ARG  57           HD1      ARG  57   4.272  -0.928  12.068
  451    HE   ARG  57           HE       ARG  57   2.731   1.377  12.040
  452   1HH1  ARG  57          HH21      ARG  57   2.926  -1.463  14.060
  453   2HH1  ARG  57          HH22      ARG  57   2.417  -0.614  15.476
  454   1HH2  ARG  57          HH11      ARG  57   2.072   2.443  13.896
  455   2HH2  ARG  57          HH12      ARG  57   1.935   1.575  15.388
  456    H    GLN  58           HN       GLN  58   5.135  -3.456   7.410
  457    HA   GLN  58           HA       GLN  58   7.832  -3.429   8.439
  458   1HB   GLN  58           HB2      GLN  58   6.121  -5.259   6.968
  459   2HB   GLN  58           HB1      GLN  58   7.757  -5.251   6.307
  460   1HG   GLN  58           HG2      GLN  58   7.412  -5.355   9.282
  461   2HG   GLN  58           HG1      GLN  58   7.147  -6.826   8.345
  462   1HE2  GLN  58          HE22      GLN  58  10.664  -7.269   8.736
  463   2HE2  GLN  58          HE21      GLN  58   9.137  -7.775   9.276
  464    H    PHE  59           HN       PHE  59   6.349  -2.317   5.461
  465    HA   PHE  59           HA       PHE  59   8.837  -2.169   3.966
  466   1HB   PHE  59           HB2      PHE  59   6.641  -2.292   2.838
  467   2HB   PHE  59           HB1      PHE  59   6.205  -0.726   3.519
  468    HD1  PHE  59           HD2      PHE  59   7.608   1.313   2.906
  469    HD2  PHE  59           HD1      PHE  59   7.964  -2.446   0.861
  470    HE1  PHE  59           HE2      PHE  59   8.716   2.454   1.010
  471    HE2  PHE  59           HE1      PHE  59   9.079  -1.302  -1.036
  472    HZ   PHE  59           HZ       PHE  59   9.453   1.146  -0.964
  473    OH   TYR  60           OH       TYR  60   6.263   3.875  11.427
  474    H    TYR  60           HN       TYR  60   6.738   0.490   5.167
  475    HA   TYR  60           HA       TYR  60   8.789   2.464   4.862
  476   1HB   TYR  60           HB2      TYR  60   7.116   3.893   5.348
  477   2HB   TYR  60           HB1      TYR  60   6.068   2.478   5.454
  478    HD1  TYR  60           HD2      TYR  60   5.630   1.397   7.653
  479    HD2  TYR  60           HD1      TYR  60   7.876   5.047   7.327
  480    HE1  TYR  60           HE2      TYR  60   5.329   1.801  10.082
  481    HE2  TYR  60           HE1      TYR  60   7.574   5.448   9.757
  482    HH   TYR  60           HH       TYR  60   7.095   3.683  11.867
  483    H    SER  61           HN       SER  61   8.316   0.126   7.344
  484    HA   SER  61           HA       SER  61   9.769   1.760   9.330
  485   1HB   SER  61           HB2      SER  61   7.869   0.288  10.017
  486   2HB   SER  61           HB1      SER  61   8.820  -1.112   9.528
  487    HG   SER  61           HG       SER  61   9.268   0.731  11.615
  488    H    HIS  62           HN       HIS  62  10.205  -1.490   7.912
  489    HA   HIS  62           HA       HIS  62  13.078  -1.369   8.591
  490   1HB   HIS  62           HB2      HIS  62  11.318  -3.558   7.472
  491   2HB   HIS  62           HB1      HIS  62  13.058  -3.739   7.703
  492    HD1  HIS  62           HD1      HIS  62  11.982  -1.598  10.335
  493    HD2  HIS  62           HD2      HIS  62  11.753  -5.711   9.696
  494    HE1  HIS  62           HE1      HIS  62  11.589  -2.655  12.603
  495    H    HIS  63           HN       HIS  63  11.028  -1.536   5.686
  496    HA   HIS  63           HA       HIS  63  13.415  -1.551   3.959
  497   1HB   HIS  63           HB2      HIS  63  10.486  -1.378   3.203
  498   2HB   HIS  63           HB1      HIS  63  11.829  -1.709   2.109
  499    HD1  HIS  63           HD1      HIS  63  13.048  -3.474   4.748
  500    HD2  HIS  63           HD2      HIS  63   9.667  -4.129   2.399
  501    HE1  HIS  63           HE1      HIS  63  12.477  -5.930   4.984
  502    H    GLU  64           HN       GLU  64  12.727   0.876   5.684
  503    HA   GLU  64           HA       GLU  64  12.094   2.898   3.632
  504   1HB   GLU  64           HB2      GLU  64  11.493   4.211   5.376
  505   2HB   GLU  64           HB1      GLU  64  11.634   2.752   6.352
  506   1HG   GLU  64           HG2      GLU  64  14.058   3.307   6.719
  507   2HG   GLU  64           HG1      GLU  64  13.777   4.845   5.899
  508    H    LYS  65           HN       LYS  65  14.837   1.656   5.440
  509    HA   LYS  65           HA       LYS  65  16.601   3.478   3.853
  510   1HB   LYS  65           HB2      LYS  65  16.587   4.044   6.284
  511   2HB   LYS  65           HB1      LYS  65  17.122   2.402   6.644
  512   1HG   LYS  65           HG2      LYS  65  19.166   2.765   5.316
  513   2HG   LYS  65           HG1      LYS  65  18.630   4.399   4.927
  514   1HD   LYS  65           HD2      LYS  65  18.688   3.685   7.812
  515   2HD   LYS  65           HD1      LYS  65  20.254   3.853   7.017
  516   1HE   LYS  65           HE2      LYS  65  18.090   5.940   6.720
  517   2HE   LYS  65           HE1      LYS  65  19.246   5.983   8.051
  518   1HZ   LYS  65           HZ1      LYS  65  21.043   5.945   6.412
  519   2HZ   LYS  65           HZ3      LYS  65  19.903   5.988   5.156
  520   3HZ   LYS  65           HZ2      LYS  65  20.042   7.305   6.221
  521    H    ASP  66           HN       ASP  66  16.218   1.432   2.422
  522    HA   ASP  66           HA       ASP  66  17.964  -0.823   3.252
  523   1HB   ASP  66           HB2      ASP  66  15.959  -0.463   1.014
  524   2HB   ASP  66           HB1      ASP  66  17.045  -1.851   1.094
  525    H    THR  67           HN       THR  67  19.872  -1.286   2.171
  526    HA   THR  67           HA       THR  67  21.139   0.852   0.705
  527    HB   THR  67           HB       THR  67  22.414  -0.765   2.083
  528    HG1  THR  67           HG1      THR  67  23.033   0.157  -0.242
  529   1HG2  THR  67          HG21      THR  67  21.601  -2.731  -0.076
  530   2HG2  THR  67          HG23      THR  67  22.763  -3.056   1.210
  531   3HG2  THR  67          HG22      THR  67  21.070  -2.762   1.605
  532    NH1  ARG  68           NH2      ARG  68  16.894  -6.081   1.445
  533    NH2  ARG  68           NH1      ARG  68  18.779  -6.100   2.690
  534    H    ARG  68           HN       ARG  68  19.303  -1.983  -0.225
  535    HA   ARG  68           HA       ARG  68  20.189  -2.111  -2.957
  536   1HB   ARG  68           HB2      ARG  68  17.523  -2.943  -1.767
  537   2HB   ARG  68           HB1      ARG  68  18.166  -3.458  -3.327
  538   1HG   ARG  68           HG2      ARG  68  19.645  -4.922  -2.387
  539   2HG   ARG  68           HG1      ARG  68  19.969  -3.866  -1.012
  540   1HD   ARG  68           HD2      ARG  68  17.328  -4.560  -0.613
  541   2HD   ARG  68           HD1      ARG  68  18.013  -6.042  -1.277
  542    HE   ARG  68           HE       ARG  68  19.846  -5.250   0.651
  543   1HH1  ARG  68          HH21      ARG  68  16.419  -5.907   0.585
  544   2HH1  ARG  68          HH22      ARG  68  16.384  -6.427   2.231
  545   1HH2  ARG  68          HH11      ARG  68  19.761  -5.936   2.783
  546   2HH2  ARG  68          HH12      ARG  68  18.254  -6.448   3.467
  547    H    CYS  69           HN       CYS  69  17.313  -0.585  -1.460
  548    HA   CYS  69           HA       CYS  69  16.233   0.551  -3.814
  549   1HB   CYS  69           HB2      CYS  69  16.044   1.090  -0.910
  550   2HB   CYS  69           HB1      CYS  69  15.671   2.466  -1.947
  551    H    LEU  70           HN       LEU  70  18.957   1.556  -1.835
  552    HA   LEU  70           HA       LEU  70  19.215   4.206  -2.941
  553   1HB   LEU  70           HB2      LEU  70  21.196   2.361  -1.581
  554   2HB   LEU  70           HB1      LEU  70  21.588   4.011  -2.067
  555    HG   LEU  70           HG       LEU  70  19.307   3.247  -0.220
  556   1HD1  LEU  70          HD12      LEU  70  21.779   2.993   0.579
  557   2HD1  LEU  70          HD11      LEU  70  21.793   4.754   0.563
  558   3HD1  LEU  70          HD13      LEU  70  20.653   3.892   1.595
  559   1HD2  LEU  70          HD21      LEU  70  20.382   5.851  -1.304
  560   2HD2  LEU  70          HD23      LEU  70  18.714   5.278  -1.274
  561   3HD2  LEU  70          HD22      LEU  70  19.494   5.799   0.219
  562    H    GLY  71           HN       GLY  71  21.682   1.674  -3.390
  563   1HA   GLY  71           HA2      GLY  71  22.381   0.760  -5.519
  564   2HA   GLY  71           HA1      GLY  71  21.499   2.056  -6.330
  565    H    ALA  72           HN       ALA  72  23.488   2.495  -7.544
  566    HA   ALA  72           HA       ALA  72  25.662   3.731  -5.922
  567   1HB   ALA  72           HB1      ALA  72  25.761   1.986  -8.083
  568   2HB   ALA  72           HB3      ALA  72  26.109   3.554  -8.810
  569   3HB   ALA  72           HB2      ALA  72  27.106   2.957  -7.484
  570    H    THR  73           HN       THR  73  23.143   5.104  -6.307
  571    HA   THR  73           HA       THR  73  24.163   7.466  -7.815
  572    HB   THR  73           HB       THR  73  21.249   6.702  -7.901
  573    HG1  THR  73           HG1      THR  73  21.608   5.403  -9.555
  574   1HG2  THR  73          HG22      THR  73  23.073   8.652  -9.195
  575   2HG2  THR  73          HG21      THR  73  21.848   7.929 -10.237
  576   3HG2  THR  73          HG23      THR  73  21.363   8.806  -8.786
  577    H    ALA  74           HN       ALA  74  23.494   9.475  -6.937
  578    HA   ALA  74           HA       ALA  74  22.650   9.334  -4.119
  579   1HB   ALA  74           HB2      ALA  74  24.311  11.040  -5.596
  580   2HB   ALA  74           HB1      ALA  74  22.895  12.019  -5.213
  581   3HB   ALA  74           HB3      ALA  74  23.817  11.255  -3.918
  582    H    GLN  75           HN       GLN  75  21.363  10.344  -7.232
  583    HA   GLN  75           HA       GLN  75  19.147  11.880  -6.357
  584   1HB   GLN  75           HB2      GLN  75  19.885  10.383  -8.792
  585   2HB   GLN  75           HB1      GLN  75  18.148  10.565  -8.544
  586   1HG   GLN  75           HG2      GLN  75  18.915  13.075  -7.962
  587   2HG   GLN  75           HG1      GLN  75  20.213  12.641  -9.075
  588   1HE2  GLN  75          HE22      GLN  75  16.520  13.394 -10.531
  589   2HE2  GLN  75          HE21      GLN  75  16.898  13.600  -8.888
  590    H    GLN  76           HN       GLN  76  19.510   8.358  -6.695
  591    HA   GLN  76           HA       GLN  76  16.814   7.635  -6.199
  592   1HB   GLN  76           HB2      GLN  76  19.203   6.272  -6.579
  593   2HB   GLN  76           HB1      GLN  76  18.746   5.841  -4.931
  594   1HG   GLN  76           HG2      GLN  76  17.464   4.269  -5.983
  595   2HG   GLN  76           HG1      GLN  76  16.340   5.615  -6.174
  596   1HE2  GLN  76          HE22      GLN  76  17.618   6.187  -9.627
  597   2HE2  GLN  76          HE21      GLN  76  17.497   7.114  -8.211
  598    H    PHE  77           HN       PHE  77  19.427   8.458  -3.957
  599    HA   PHE  77           HA       PHE  77  18.051   7.701  -1.557
  600   1HB   PHE  77           HB2      PHE  77  20.559   8.696  -2.150
  601   2HB   PHE  77           HB1      PHE  77  19.799  10.053  -1.319
  602    HD1  PHE  77           HD2      PHE  77  17.968   8.676   0.544
  603    HD2  PHE  77           HD1      PHE  77  22.017   7.748  -0.549
  604    HE1  PHE  77           HE2      PHE  77  18.292   7.532   2.719
  605    HE2  PHE  77           HE1      PHE  77  22.340   6.605   1.629
  606    HZ   PHE  77           HZ       PHE  77  20.479   6.497   3.262
  607    H    HIS  78           HN       HIS  78  18.034  10.649  -3.512
  608    HA   HIS  78           HA       HIS  78  16.611  12.306  -1.667
  609   1HB   HIS  78           HB2      HIS  78  17.779  12.968  -3.871
  610   2HB   HIS  78           HB1      HIS  78  16.292  12.452  -4.666
  611    HD1  HIS  78           HD1      HIS  78  16.726  14.378  -1.402
  612    HD2  HIS  78           HD2      HIS  78  14.979  14.837  -5.159
  613    HE1  HIS  78           HE1      HIS  78  15.469  16.576  -1.343
  614    NH1  ARG  79           NH2      ARG  79  10.860  12.881  -8.404
  615    NH2  ARG  79           NH1      ARG  79   8.679  12.580  -7.903
  616    H    ARG  79           HN       ARG  79  15.336  10.568  -4.525
  617    HA   ARG  79           HA       ARG  79  12.595  10.974  -3.873
  618   1HB   ARG  79           HB2      ARG  79  13.801   9.998  -6.041
  619   2HB   ARG  79           HB1      ARG  79  13.407   8.460  -5.271
  620   1HG   ARG  79           HG2      ARG  79  11.339   8.680  -6.148
  621   2HG   ARG  79           HG1      ARG  79  11.083   9.977  -4.982
  622   1HD   ARG  79           HD2      ARG  79  12.256  11.494  -6.728
  623   2HD   ARG  79           HD1      ARG  79  11.935  10.187  -7.866
  624    HE   ARG  79           HE       ARG  79   9.485  10.633  -6.649
  625   1HH1  ARG  79          HH21      ARG  79  11.818  12.604  -8.339
  626   2HH1  ARG  79          HH22      ARG  79  10.616  13.691  -8.938
  627   1HH2  ARG  79          HH11      ARG  79   7.956  12.064  -7.445
  628   2HH2  ARG  79          HH12      ARG  79   8.451  13.392  -8.439
  629    H    HIS  80           HN       HIS  80  14.931   8.801  -2.496
  630    HA   HIS  80           HA       HIS  80  13.063   6.810  -1.544
  631   1HB   HIS  80           HB2      HIS  80  15.703   6.779  -1.708
  632   2HB   HIS  80           HB1      HIS  80  15.600   7.441  -0.076
  633    HD1  HIS  80           HD1      HIS  80  12.716   5.638   0.053
  634    HD2  HIS  80           HD2      HIS  80  16.677   4.376  -0.240
  635    HE1  HIS  80           HE1      HIS  80  12.767   3.247   0.881
  636    H    LYS  81           HN       LYS  81  14.654   9.583   0.066
  637    HA   LYS  81           HA       LYS  81  13.341   9.310   2.567
  638   1HB   LYS  81           HB2      LYS  81  15.284  10.895   1.841
  639   2HB   LYS  81           HB1      LYS  81  13.991  12.005   1.388
  640   1HG   LYS  81           HG2      LYS  81  14.616  12.522   3.657
  641   2HG   LYS  81           HG1      LYS  81  13.048  11.716   3.716
  642   1HD   LYS  81           HD2      LYS  81  13.887   9.883   4.774
  643   2HD   LYS  81           HD1      LYS  81  15.377   9.901   3.829
  644   1HE   LYS  81           HE2      LYS  81  16.201  11.804   5.182
  645   2HE   LYS  81           HE1      LYS  81  14.725  11.748   6.144
  646   1HZ   LYS  81           HZ2      LYS  81  16.361   9.323   5.828
  647   2HZ   LYS  81           HZ1      LYS  81  16.820  10.505   6.959
  648   3HZ   LYS  81           HZ3      LYS  81  15.306   9.751   7.090
  649    H    GLN  82           HN       GLN  82  12.243  10.658  -0.481
  650    HA   GLN  82           HA       GLN  82   9.899  11.948   0.696
  651   1HB   GLN  82           HB2      GLN  82  10.333  11.251  -2.217
  652   2HB   GLN  82           HB1      GLN  82   9.311  12.527  -1.552
  653   1HG   GLN  82           HG2      GLN  82  11.700  13.213  -0.461
  654   2HG   GLN  82           HG1      GLN  82  12.245  12.484  -1.972
  655   1HE2  GLN  82          HE22      GLN  82  10.495  14.949  -4.000
  656   2HE2  GLN  82          HE21      GLN  82  10.824  13.284  -3.972
  657    H    LEU  83           HN       LEU  83  10.678   8.823  -0.690
  658    HA   LEU  83           HA       LEU  83   7.958   7.964  -1.130
  659   1HB   LEU  83           HB2      LEU  83   9.970   6.875  -2.161
  660   2HB   LEU  83           HB1      LEU  83  10.391   6.240  -0.569
  661    HG   LEU  83           HG       LEU  83   7.710   5.564  -0.844
  662   1HD1  LEU  83          HD12      LEU  83   8.265   6.255  -3.346
  663   2HD1  LEU  83          HD11      LEU  83   8.992   4.648  -3.391
  664   3HD1  LEU  83          HD13      LEU  83   7.281   4.831  -3.002
  665   1HD2  LEU  83          HD23      LEU  83   9.540   4.176   0.099
  666   2HD2  LEU  83          HD22      LEU  83   8.579   3.269  -1.070
  667   3HD2  LEU  83          HD21      LEU  83  10.158   3.903  -1.530
  668    H    ILE  84           HN       ILE  84  10.092   8.006   1.664
  669    HA   ILE  84           HA       ILE  84   8.563   6.147   3.261
  670    HB   ILE  84           HB       ILE  84  10.223   8.432   4.337
  671   1HG1  ILE  84          HG12      ILE  84  11.698   7.488   2.753
  672   2HG1  ILE  84          HG11      ILE  84  12.089   6.630   4.243
  673   1HG2  ILE  84          HG21      ILE  84   9.492   5.656   5.298
  674   2HG2  ILE  84          HG23      ILE  84  10.745   6.636   6.059
  675   3HG2  ILE  84          HG22      ILE  84   9.072   7.197   6.044
  676   1HD1  ILE  84          HD12      ILE  84  10.231   4.952   3.400
  677   2HD1  ILE  84          HD11      ILE  84  10.609   5.651   1.825
  678   3HD1  ILE  84          HD13      ILE  84  11.872   4.850   2.761
  679    NH1  ARG  85           NH2      ARG  85  10.138  15.705   4.362
  680    NH2  ARG  85           NH1      ARG  85   9.332  16.333   6.376
  681    H    ARG  85           HN       ARG  85   8.371   9.631   2.709
  682    HA   ARG  85           HA       ARG  85   6.448  10.085   4.841
  683   1HB   ARG  85           HB2      ARG  85   7.626  11.686   2.619
  684   2HB   ARG  85           HB1      ARG  85   6.084  12.232   3.279
  685   1HG   ARG  85           HG2      ARG  85   6.980  12.512   5.451
  686   2HG   ARG  85           HG1      ARG  85   8.401  11.533   5.080
  687   1HD   ARG  85           HD2      ARG  85   9.466  13.246   3.973
  688   2HD   ARG  85           HD1      ARG  85   7.955  13.960   3.411
  689    HE   ARG  85           HE       ARG  85   7.898  14.358   6.150
  690   1HH1  ARG  85          HH21      ARG  85  10.148  15.082   3.582
  691   2HH1  ARG  85          HH22      ARG  85  10.756  16.491   4.375
  692   1HH2  ARG  85          HH11      ARG  85   8.715  16.187   7.150
  693   2HH2  ARG  85          HH12      ARG  85   9.957  17.114   6.374
  694    H    PHE  86           HN       PHE  86   6.230   9.667   1.320
  695    HA   PHE  86           HA       PHE  86   3.438  10.108   1.040
  696   1HB   PHE  86           HB2      PHE  86   5.533   9.356  -0.627
  697   2HB   PHE  86           HB1      PHE  86   4.465   7.954  -0.652
  698    HD1  PHE  86           HD2      PHE  86   2.023   8.270  -1.225
  699    HD2  PHE  86           HD1      PHE  86   4.942  11.379  -1.735
  700    HE1  PHE  86           HE2      PHE  86   0.481   9.469  -2.752
  701    HE2  PHE  86           HE1      PHE  86   3.400  12.577  -3.262
  702    HZ   PHE  86           HZ       PHE  86   1.169  11.622  -3.771
  703    H    LEU  87           HN       LEU  87   5.209   7.063   1.589
  704    HA   LEU  87           HA       LEU  87   2.896   5.394   1.731
  705   1HB   LEU  87           HB2      LEU  87   5.072   4.413   1.389
  706   2HB   LEU  87           HB1      LEU  87   5.671   5.095   2.902
  707    HG   LEU  87           HG       LEU  87   4.163   3.702   4.192
  708   1HD1  LEU  87          HD11      LEU  87   2.927   3.330   1.522
  709   2HD1  LEU  87          HD13      LEU  87   2.967   1.900   2.554
  710   3HD1  LEU  87          HD12      LEU  87   2.172   3.370   3.116
  711   1HD2  LEU  87          HD21      LEU  87   5.521   2.114   1.991
  712   2HD2  LEU  87          HD23      LEU  87   6.289   2.684   3.471
  713   3HD2  LEU  87          HD22      LEU  87   5.015   1.467   3.553
  714    H    LYS  88           HN       LYS  88   4.725   7.112   4.267
  715    HA   LYS  88           HA       LYS  88   3.399   6.050   6.519
  716   1HB   LYS  88           HB2      LYS  88   4.652   8.735   5.965
  717   2HB   LYS  88           HB1      LYS  88   3.868   8.406   7.511
  718   1HG   LYS  88           HG2      LYS  88   5.331   6.530   7.934
  719   2HG   LYS  88           HG1      LYS  88   6.012   6.635   6.312
  720   1HD   LYS  88           HD2      LYS  88   7.465   7.652   8.106
  721   2HD   LYS  88           HD1      LYS  88   7.039   8.765   6.805
  722   1HE   LYS  88           HE2      LYS  88   5.403   9.862   8.137
  723   2HE   LYS  88           HE1      LYS  88   5.412   8.577   9.345
  724   1HZ   LYS  88           HZ3      LYS  88   7.774   9.163   9.777
  725   2HZ   LYS  88           HZ2      LYS  88   7.584  10.513   8.764
  726   3HZ   LYS  88           HZ1      LYS  88   6.673  10.384  10.193
  727    NH1  ARG  89           NH2      ARG  89   0.202  13.409   0.527
  728    NH2  ARG  89           NH1      ARG  89  -0.976  14.450   2.150
  729    H    ARG  89           HN       ARG  89   2.417   8.715   4.370
  730    HA   ARG  89           HA       ARG  89   0.065   9.392   5.903
  731   1HB   ARG  89           HB2      ARG  89  -0.113  11.051   4.379
  732   2HB   ARG  89           HB1      ARG  89   1.373  10.435   3.662
  733   1HG   ARG  89           HG2      ARG  89  -0.008   8.885   2.260
  734   2HG   ARG  89           HG1      ARG  89  -1.457   9.662   2.901
  735   1HD   ARG  89           HD2      ARG  89   0.762  11.032   1.356
  736   2HD   ARG  89           HD1      ARG  89  -0.849  10.662   0.744
  737    HE   ARG  89           HE       ARG  89  -1.328  12.178   3.013
  738   1HH1  ARG  89          HH21      ARG  89   0.562  12.578   0.107
  739   2HH1  ARG  89          HH22      ARG  89   0.392  14.297   0.110
  740   1HH2  ARG  89          HH11      ARG  89  -1.525  14.414   2.986
  741   2HH2  ARG  89          HH12      ARG  89  -0.778  15.330   1.719
  742    H    LEU  90           HN       LEU  90   0.774   7.080   3.355
  743    HA   LEU  90           HA       LEU  90  -2.000   6.318   2.910
  744   1HB   LEU  90           HB2      LEU  90  -0.082   6.011   1.261
  745   2HB   LEU  90           HB1      LEU  90   0.472   4.684   2.282
  746    HG   LEU  90           HG       LEU  90  -2.209   4.109   1.979
  747   1HD1  LEU  90          HD11      LEU  90  -1.134   5.181  -0.648
  748   2HD1  LEU  90          HD13      LEU  90  -2.652   4.308  -0.443
  749   3HD1  LEU  90          HD12      LEU  90  -2.442   5.897   0.293
  750   1HD2  LEU  90          HD21      LEU  90   0.366   3.164   0.872
  751   2HD2  LEU  90          HD23      LEU  90  -0.921   2.251   1.660
  752   3HD2  LEU  90          HD22      LEU  90  -1.057   2.673  -0.047
  753    H    ASP  91           HN       ASP  91   0.268   5.637   5.401
  754    HA   ASP  91           HA       ASP  91  -0.721   2.965   6.015
  755   1HB   ASP  91           HB2      ASP  91   1.455   4.600   6.837
  756   2HB   ASP  91           HB1      ASP  91   0.515   4.222   8.282
  757    NH1  ARG  92           NH2      ARG  92  -2.256   4.574  13.407
  758    NH2  ARG  92           NH1      ARG  92  -2.909   6.086  14.952
  759    H    ARG  92           HN       ARG  92  -1.419   6.262   7.070
  760    HA   ARG  92           HA       ARG  92  -3.281   5.266   9.134
  761   1HB   ARG  92           HB2      ARG  92  -1.715   7.471   9.087
  762   2HB   ARG  92           HB1      ARG  92  -3.208   8.156   8.446
  763   1HG   ARG  92           HG2      ARG  92  -3.231   8.377  10.868
  764   2HG   ARG  92           HG1      ARG  92  -4.435   7.177  10.399
  765   1HD   ARG  92           HD2      ARG  92  -3.087   5.370  11.107
  766   2HD   ARG  92           HD1      ARG  92  -1.625   6.355  11.129
  767    HE   ARG  92           HE       ARG  92  -3.253   7.557  13.016
  768   1HH1  ARG  92          HH21      ARG  92  -2.084   4.314  12.459
  769   2HH1  ARG  92          HH22      ARG  92  -2.092   3.913  14.138
  770   1HH2  ARG  92          HH11      ARG  92  -3.243   6.998  15.191
  771   2HH2  ARG  92          HH12      ARG  92  -2.741   5.411  15.671
  772    H    ASN  93           HN       ASN  93  -3.347   6.487   5.859
  773    HA   ASN  93           HA       ASN  93  -6.218   7.064   5.914
  774   1HB   ASN  93           HB2      ASN  93  -4.076   7.046   3.805
  775   2HB   ASN  93           HB1      ASN  93  -5.774   7.082   3.328
  776   1HD2  ASN  93          HD22      ASN  93  -5.075  10.628   3.607
  777   2HD2  ASN  93          HD21      ASN  93  -4.944   9.342   2.507
  778    H    LEU  94           HN       LEU  94  -4.193   4.634   4.230
  779    HA   LEU  94           HA       LEU  94  -6.280   3.042   3.202
  780   1HB   LEU  94           HB2      LEU  94  -3.624   2.867   3.025
  781   2HB   LEU  94           HB1      LEU  94  -3.853   1.687   4.316
  782    HG   LEU  94           HG       LEU  94  -5.765   0.795   2.709
  783   1HD1  LEU  94          HD13      LEU  94  -4.585   2.828   1.139
  784   2HD1  LEU  94          HD12      LEU  94  -4.048   1.299   0.444
  785   3HD1  LEU  94          HD11      LEU  94  -5.772   1.630   0.620
  786   1HD2  LEU  94          HD22      LEU  94  -2.919   0.236   3.042
  787   2HD2  LEU  94          HD21      LEU  94  -4.271  -0.890   2.925
  788   3HD2  LEU  94          HD23      LEU  94  -3.507  -0.272   1.459
  789    CH2  TRP  95           CH2      TRP  95  -2.219   0.474  13.155
  790    H    TRP  95           HN       TRP  95  -4.443   2.394   6.199
  791    HA   TRP  95           HA       TRP  95  -6.335   0.459   7.155
  792   1HB   TRP  95           HB2      TRP  95  -4.277   0.131   8.103
  793   2HB   TRP  95           HB1      TRP  95  -3.888   1.827   8.115
  794    HD1  TRP  95           HD1      TRP  95  -6.940   1.558  10.245
  795    HE1  TRP  95           HE1      TRP  95  -6.289   1.477  12.695
  796    HE3  TRP  95           HE3      TRP  95  -2.043   0.377   9.743
  797    HZ2  TRP  95           HZ2      TRP  95  -3.991   0.936  14.278
  798    HZ3  TRP  95           HZ3      TRP  95  -0.623   0.055  11.767
  799    HH2  TRP  95           HH2      TRP  95  -1.617   0.316  14.031
  800    H    GLY  96           HN       GLY  96  -6.117   3.967   7.377
  801   1HA   GLY  96           HA2      GLY  96  -7.704   4.712   9.487
  802   2HA   GLY  96           HA1      GLY  96  -7.907   5.445   7.894
  803    H    LEU  97           HN       LEU  97  -8.835   3.156   6.518
  804    HA   LEU  97           HA       LEU  97 -11.597   2.987   7.590
  805   1HB   LEU  97           HB2      LEU  97 -10.322   2.359   4.927
  806   2HB   LEU  97           HB1      LEU  97 -11.947   1.796   5.317
  807    HG   LEU  97           HG       LEU  97 -12.345   4.295   6.018
  808   1HD1  LEU  97          HD12      LEU  97  -9.672   4.411   5.135
  809   2HD1  LEU  97          HD11      LEU  97 -10.624   5.177   3.863
  810   3HD1  LEU  97          HD13      LEU  97 -10.722   5.775   5.519
  811   1HD2  LEU  97          HD22      LEU  97 -13.211   2.903   3.973
  812   2HD2  LEU  97          HD21      LEU  97 -13.337   4.660   3.921
  813   3HD2  LEU  97          HD23      LEU  97 -12.035   3.844   3.056
  814    H    ALA  98           HN       ALA  98  -8.806   0.958   6.847
  815    HA   ALA  98           HA       ALA  98 -10.093  -1.579   7.214
  816   1HB   ALA  98           HB1      ALA  98  -7.642  -0.738   6.300
  817   2HB   ALA  98           HB3      ALA  98  -7.222  -1.472   7.844
  818   3HB   ALA  98           HB2      ALA  98  -8.074  -2.407   6.631
  819    H    GLY  99           HN       GLY  99  -7.524  -0.288   9.332
  820   1HA   GLY  99           HA2      GLY  99  -7.746  -0.041  11.757
  821   2HA   GLY  99           HA1      GLY  99  -9.114  -1.160  11.706
  822    H    LEU 100           HN       LEU 100  -5.657  -0.907  11.517
  823    HA   LEU 100           HA       LEU 100  -5.171  -3.751  11.297
  824   1HB   LEU 100           HB2      LEU 100  -3.751  -1.876  10.315
  825   2HB   LEU 100           HB1      LEU 100  -3.184  -1.600  11.957
  826    HG   LEU 100           HG       LEU 100  -2.320  -3.882  12.083
  827   1HD1  LEU 100          HD11      LEU 100  -4.026  -4.201   9.739
  828   2HD1  LEU 100          HD13      LEU 100  -2.399  -4.823   9.463
  829   3HD1  LEU 100          HD12      LEU 100  -3.358  -5.430  10.812
  830   1HD2  LEU 100          HD22      LEU 100  -1.132  -1.890  10.833
  831   2HD2  LEU 100          HD21      LEU 100  -0.446  -3.513  10.750
  832   3HD2  LEU 100          HD23      LEU 100  -1.406  -2.890   9.409
  833    H    ASN 101           HN       ASN 101  -6.651  -3.453  13.627
  834    HA   ASN 101           HA       ASN 101  -4.716  -3.340  15.851
  835   1HB   ASN 101           HB2      ASN 101  -7.654  -3.374  15.578
  836   2HB   ASN 101           HB1      ASN 101  -7.063  -4.389  16.894
  837   1HD2  ASN 101          HD22      ASN 101  -6.184  -0.364  17.057
  838   2HD2  ASN 101          HD21      ASN 101  -6.316  -1.115  15.540
  839    H    SER 102           HN       SER 102  -7.215  -5.846  15.509
  840    HA   SER 102           HA       SER 102  -5.093  -7.903  15.775
  841   1HB   SER 102           HB2      SER 102  -7.954  -7.714  16.437
  842   2HB   SER 102           HB1      SER 102  -7.516  -9.234  15.661
  843    HG   SER 102           HG       SER 102  -5.733  -9.262  17.241
  844    H    CYS 103           HN       CYS 103  -4.212  -8.023  13.638
  845    HA   CYS 103           HA       CYS 103  -6.132  -9.007  11.579
  846   1HB   CYS 103           HB2      CYS 103  -4.895  -6.473  11.549
  847   2HB   CYS 103           HB1      CYS 103  -4.002  -7.437  10.381
  848    HA   PRO 104           HA       PRO 104  -2.346 -11.650  12.279
  849   1HB   PRO 104           HB2      PRO 104  -4.132 -13.898  12.066
  850   2HB   PRO 104           HB1      PRO 104  -3.221 -13.362  13.485
  851   1HG   PRO 104           HG2      PRO 104  -6.061 -13.137  13.027
  852   2HG   PRO 104           HG1      PRO 104  -5.144 -12.606  14.444
  853   1HD   PRO 104           HD2      PRO 104  -6.338 -10.959  12.406
  854   2HD   PRO 104           HD1      PRO 104  -5.387 -10.437  13.812
  855    H    VAL 105           HN       VAL 105  -1.739 -11.007  10.118
  856    HA   VAL 105           HA       VAL 105  -2.997 -11.589   7.689
  857    HB   VAL 105           HB       VAL 105  -0.942 -10.300   7.698
  858   1HG1  VAL 105          HG13      VAL 105  -0.065 -12.484   9.372
  859   2HG1  VAL 105          HG12      VAL 105   1.073 -12.251   8.046
  860   3HG1  VAL 105          HG11      VAL 105   0.689 -10.910   9.125
  861   1HG2  VAL 105          HG22      VAL 105  -1.479 -12.336   5.896
  862   2HG2  VAL 105          HG21      VAL 105  -0.265 -11.075   5.674
  863   3HG2  VAL 105          HG23      VAL 105   0.200 -12.641   6.339
  864    H    LYS 106           HN       LYS 106  -4.022 -13.600   7.525
  865    HA   LYS 106           HA       LYS 106  -2.627 -16.061   8.259
  866   1HB   LYS 106           HB2      LYS 106  -5.336 -15.314   7.310
  867   2HB   LYS 106           HB1      LYS 106  -4.782 -16.924   6.853
  868   1HG   LYS 106           HG2      LYS 106  -4.124 -17.238   9.305
  869   2HG   LYS 106           HG1      LYS 106  -5.051 -15.776   9.636
  870   1HD   LYS 106           HD2      LYS 106  -6.305 -18.002   8.050
  871   2HD   LYS 106           HD1      LYS 106  -6.235 -18.113   9.810
  872   1HE   LYS 106           HE2      LYS 106  -7.568 -16.195  10.109
  873   2HE   LYS 106           HE1      LYS 106  -7.266 -15.617   8.471
  874   1HZ   LYS 106           HZ2      LYS 106  -8.481 -18.216   8.550
  875   2HZ   LYS 106           HZ1      LYS 106  -9.445 -17.016   9.271
  876   3HZ   LYS 106           HZ3      LYS 106  -8.928 -16.836   7.666
  877    H    GLU 107           HN       GLU 107  -4.326 -15.618   5.164
  878    HA   GLU 107           HA       GLU 107  -2.430 -17.222   3.741
  879   1HB   GLU 107           HB2      GLU 107  -4.928 -16.044   3.207
  880   2HB   GLU 107           HB1      GLU 107  -3.823 -15.355   2.017
  881   1HG   GLU 107           HG2      GLU 107  -4.533 -17.330   0.967
  882   2HG   GLU 107           HG1      GLU 107  -3.008 -17.816   1.709
  883    H    ALA 108           HN       ALA 108  -0.325 -16.574   3.543
  884    HA   ALA 108           HA       ALA 108   0.333 -14.252   1.980
  885   1HB   ALA 108           HB2      ALA 108   0.537 -14.047   4.974
  886   2HB   ALA 108           HB1      ALA 108   1.679 -13.181   3.947
  887   3HB   ALA 108           HB3      ALA 108  -0.049 -12.851   3.819
  888    H    ASP 109           HN       ASP 109   2.296 -14.618   1.082
  889    HA   ASP 109           HA       ASP 109   4.301 -16.252   2.541
  890   1HB   ASP 109           HB2      ASP 109   2.696 -17.340   0.521
  891   2HB   ASP 109           HB1      ASP 109   4.202 -16.924  -0.300
  892    H    GLN 110           HN       GLN 110   6.498 -15.962   1.510
  893    HA   GLN 110           HA       GLN 110   7.137 -13.283   1.034
  894   1HB   GLN 110           HB2      GLN 110   9.266 -14.052   0.108
  895   2HB   GLN 110           HB1      GLN 110   8.823 -15.053   1.489
  896   1HG   GLN 110           HG2      GLN 110   7.655 -16.513  -0.395
  897   2HG   GLN 110           HG1      GLN 110   8.865 -15.737  -1.416
  898   1HE2  GLN 110          HE22      GLN 110  11.605 -17.490   0.024
  899   2HE2  GLN 110          HE21      GLN 110  11.142 -16.196  -0.971
  900    H    SER 111           HN       SER 111   6.312 -11.990  -0.514
  901    HA   SER 111           HA       SER 111   6.209 -13.069  -3.307
  902   1HB   SER 111           HB2      SER 111   3.951 -12.679  -1.898
  903   2HB   SER 111           HB1      SER 111   4.190 -11.035  -2.484
  904    HG   SER 111           HG       SER 111   4.433 -13.230  -4.229
  905    H    THR 112           HN       THR 112   7.409 -11.830  -4.647
  906    HA   THR 112           HA       THR 112   8.933  -9.615  -3.963
  907    HB   THR 112           HB       THR 112   9.010  -9.091  -6.393
  908    HG1  THR 112           HG1      THR 112   7.481 -11.252  -7.066
  909   1HG2  THR 112          HG21      THR 112   9.243 -11.923  -5.397
  910   2HG2  THR 112          HG23      THR 112   9.633 -11.524  -7.071
  911   3HG2  THR 112          HG22      THR 112  10.525 -10.766  -5.751
  912    H    LEU 113           HN       LEU 113   8.495  -7.537  -3.454
  913    HA   LEU 113           HA       LEU 113   5.915  -6.497  -3.106
  914   1HB   LEU 113           HB2      LEU 113   7.895  -5.459  -2.099
  915   2HB   LEU 113           HB1      LEU 113   8.462  -4.961  -3.692
  916    HG   LEU 113           HG       LEU 113   6.436  -3.584  -3.988
  917   1HD1  LEU 113          HD11      LEU 113   5.658  -5.004  -1.519
  918   2HD1  LEU 113          HD13      LEU 113   5.276  -3.284  -1.545
  919   3HD1  LEU 113          HD12      LEU 113   4.650  -4.347  -2.805
  920   1HD2  LEU 113          HD23      LEU 113   7.952  -3.112  -1.406
  921   2HD2  LEU 113          HD22      LEU 113   8.363  -2.484  -3.000
  922   3HD2  LEU 113          HD21      LEU 113   6.915  -1.911  -2.175
  923    H    GLU 114           HN       GLU 114   7.770  -6.733  -6.063
  924    HA   GLU 114           HA       GLU 114   6.606  -4.670  -7.593
  925   1HB   GLU 114           HB2      GLU 114   8.438  -5.960  -8.494
  926   2HB   GLU 114           HB1      GLU 114   7.489  -7.446  -8.419
  927   1HG   GLU 114           HG2      GLU 114   6.261  -5.218  -9.942
  928   2HG   GLU 114           HG1      GLU 114   7.705  -5.930 -10.661
  929    H    ASN 115           HN       ASN 115   5.579  -8.089  -7.760
  930    HA   ASN 115           HA       ASN 115   3.127  -7.562  -9.087
  931   1HB   ASN 115           HB2      ASN 115   4.452  -9.818  -8.429
  932   2HB   ASN 115           HB1      ASN 115   3.193  -9.853  -7.195
  933   1HD2  ASN 115          HD22      ASN 115   2.246 -10.705 -11.034
  934   2HD2  ASN 115          HD21      ASN 115   3.845 -10.390 -10.558
  935    H    PHE 116           HN       PHE 116   3.963  -7.134  -5.734
  936    HA   PHE 116           HA       PHE 116   1.263  -7.326  -4.699
  937   1HB   PHE 116           HB2      PHE 116   3.217  -7.567  -3.227
  938   2HB   PHE 116           HB1      PHE 116   3.700  -5.908  -3.581
  939    HD1  PHE 116           HD1      PHE 116   1.063  -8.006  -2.011
  940    HD2  PHE 116           HD2      PHE 116   2.646  -4.043  -2.513
  941    HE1  PHE 116           HE1      PHE 116  -0.424  -7.182  -0.204
  942    HE2  PHE 116           HE2      PHE 116   1.158  -3.221  -0.708
  943    HZ   PHE 116           HZ       PHE 116  -0.376  -4.789   0.447
  944    H    LEU 117           HN       LEU 117   3.281  -4.650  -5.872
  945    HA   LEU 117           HA       LEU 117   1.328  -2.608  -5.212
  946   1HB   LEU 117           HB2      LEU 117   4.005  -2.711  -6.256
  947   2HB   LEU 117           HB1      LEU 117   3.012  -1.725  -7.331
  948    HG   LEU 117           HG       LEU 117   4.020  -0.368  -5.518
  949   1HD1  LEU 117          HD11      LEU 117   1.360  -0.402  -6.365
  950   2HD1  LEU 117          HD13      LEU 117   1.251  -0.271  -4.609
  951   3HD1  LEU 117          HD12      LEU 117   2.168   0.923  -5.528
  952   1HD2  LEU 117          HD21      LEU 117   3.275  -2.619  -3.948
  953   2HD2  LEU 117          HD23      LEU 117   4.102  -1.158  -3.410
  954   3HD2  LEU 117          HD22      LEU 117   2.341  -1.246  -3.353
  955    H    GLU 118           HN       GLU 118   1.997  -4.673  -7.972
  956    HA   GLU 118           HA       GLU 118   0.423  -3.259  -9.903
  957   1HB   GLU 118           HB2      GLU 118   1.951  -4.977 -10.646
  958   2HB   GLU 118           HB1      GLU 118   1.152  -6.188  -9.645
  959   1HG   GLU 118           HG2      GLU 118   0.513  -6.266 -12.089
  960   2HG   GLU 118           HG1      GLU 118  -0.848  -6.084 -10.981
  961    NH1  ARG 119           NH2      ARG 119  -5.204 -10.134  -9.843
  962    NH2  ARG 119           NH1      ARG 119  -5.039 -11.809  -8.337
  963    H    ARG 119           HN       ARG 119  -0.377  -6.145  -7.961
  964    HA   ARG 119           HA       ARG 119  -3.170  -6.124  -8.636
  965   1HB   ARG 119           HB2      ARG 119  -1.818  -7.291  -6.181
  966   2HB   ARG 119           HB1      ARG 119  -3.416  -7.722  -6.793
  967   1HG   ARG 119           HG2      ARG 119  -1.005  -7.941  -8.582
  968   2HG   ARG 119           HG1      ARG 119  -1.377  -9.228  -7.432
  969   1HD   ARG 119           HD2      ARG 119  -3.638  -8.227  -9.087
  970   2HD   ARG 119           HD1      ARG 119  -2.406  -9.176  -9.921
  971    HE   ARG 119           HE       ARG 119  -2.972 -10.672  -7.661
  972   1HH1  ARG 119          HH21      ARG 119  -4.854  -9.297 -10.260
  973   2HH1  ARG 119          HH22      ARG 119  -6.058 -10.534 -10.178
  974   1HH2  ARG 119          HH11      ARG 119  -4.554 -12.259  -7.588
  975   2HH2  ARG 119          HH12      ARG 119  -5.892 -12.196  -8.685
  976    H    LEU 120           HN       LEU 120  -1.312  -4.231  -6.376
  977    HA   LEU 120           HA       LEU 120  -3.487  -3.625  -4.568
  978   1HB   LEU 120           HB2      LEU 120  -0.802  -3.129  -4.537
  979   2HB   LEU 120           HB1      LEU 120  -1.424  -1.547  -4.988
  980    HG   LEU 120           HG       LEU 120  -2.206  -3.181  -2.562
  981   1HD1  LEU 120          HD11      LEU 120  -0.839  -0.492  -2.893
  982   2HD1  LEU 120          HD13      LEU 120  -1.319  -1.199  -1.350
  983   3HD1  LEU 120          HD12      LEU 120  -0.081  -1.981  -2.331
  984   1HD2  LEU 120          HD23      LEU 120  -3.386  -0.703  -3.814
  985   2HD2  LEU 120          HD22      LEU 120  -4.219  -2.146  -3.236
  986   3HD2  LEU 120          HD21      LEU 120  -3.535  -1.001  -2.082
  987    H    LYS 121           HN       LYS 121  -2.101  -1.932  -7.380
  988    HA   LYS 121           HA       LYS 121  -3.945   0.261  -7.362
  989   1HB   LYS 121           HB2      LYS 121  -1.694  -0.206  -8.723
  990   2HB   LYS 121           HB1      LYS 121  -2.841  -0.766  -9.941
  991   1HG   LYS 121           HG2      LYS 121  -3.579   1.790  -8.667
  992   2HG   LYS 121           HG1      LYS 121  -2.093   1.852  -9.614
  993   1HD   LYS 121           HD2      LYS 121  -4.700   0.700 -10.642
  994   2HD   LYS 121           HD1      LYS 121  -4.163   2.351 -10.953
  995   1HE   LYS 121           HE2      LYS 121  -2.183   0.219 -11.535
  996   2HE   LYS 121           HE1      LYS 121  -3.587   0.276 -12.600
  997   1HZ   LYS 121           HZ3      LYS 121  -3.065   2.797 -12.636
  998   2HZ   LYS 121           HZ2      LYS 121  -1.513   2.311 -12.144
  999   3HZ   LYS 121           HZ1      LYS 121  -2.160   1.742 -13.608
 1000    H    THR 122           HN       THR 122  -3.848  -2.681  -9.339
 1001    HA   THR 122           HA       THR 122  -6.196  -2.361 -10.813
 1002    HB   THR 122           HB       THR 122  -6.161  -5.093 -10.077
 1003    HG1  THR 122           HG1      THR 122  -3.901  -5.492 -10.430
 1004   1HG2  THR 122          HG23      THR 122  -5.297  -3.393 -12.368
 1005   2HG2  THR 122          HG22      THR 122  -4.767  -5.074 -12.353
 1006   3HG2  THR 122          HG21      THR 122  -6.489  -4.692 -12.322
 1007    H    ILE 123           HN       ILE 123  -5.914  -3.856  -7.606
 1008    HA   ILE 123           HA       ILE 123  -8.643  -4.484  -7.236
 1009    HB   ILE 123           HB       ILE 123  -6.450  -3.782  -5.284
 1010   1HG1  ILE 123          HG12      ILE 123  -6.313  -5.921  -6.564
 1011   2HG1  ILE 123          HG11      ILE 123  -6.504  -6.184  -4.831
 1012   1HG2  ILE 123          HG22      ILE 123  -9.333  -4.526  -4.763
 1013   2HG2  ILE 123          HG21      ILE 123  -8.061  -4.802  -3.573
 1014   3HG2  ILE 123          HG23      ILE 123  -8.426  -3.162  -4.110
 1015   1HD1  ILE 123          HD11      ILE 123  -9.110  -5.964  -6.004
 1016   2HD1  ILE 123          HD13      ILE 123  -8.173  -7.132  -6.935
 1017   3HD1  ILE 123          HD12      ILE 123  -8.386  -7.355  -5.199
 1018    H    MET 124           HN       MET 124  -6.900  -1.467  -6.489
 1019    HA   MET 124           HA       MET 124  -9.068  -0.151  -5.198
 1020   1HB   MET 124           HB2      MET 124  -6.443   0.534  -6.041
 1021   2HB   MET 124           HB1      MET 124  -7.536   1.759  -6.686
 1022   1HG   MET 124           HG2      MET 124  -7.165   2.631  -4.582
 1023   2HG   MET 124           HG1      MET 124  -8.570   1.623  -4.247
 1024   1HE   MET 124           HE3      MET 124  -5.947   2.941  -3.050
 1025   2HE   MET 124           HE2      MET 124  -6.489   2.197  -1.548
 1026   3HE   MET 124           HE1      MET 124  -4.877   1.846  -2.166
 1027    NH1  ARG 125           NH2      ARG 125  -6.981   4.404 -14.364
 1028    NH2  ARG 125           NH1      ARG 125  -8.816   4.488 -15.680
 1029    H    ARG 125           HN       ARG 125  -8.000   0.257  -8.590
 1030    HA   ARG 125           HA       ARG 125 -10.336   1.765  -9.327
 1031   1HB   ARG 125           HB2      ARG 125  -7.898   1.235 -10.488
 1032   2HB   ARG 125           HB1      ARG 125  -9.005   0.305 -11.500
 1033   1HG   ARG 125           HG2      ARG 125 -10.291   2.227 -12.046
 1034   2HG   ARG 125           HG1      ARG 125  -9.562   3.178 -10.751
 1035   1HD   ARG 125           HD2      ARG 125  -7.738   3.701 -11.998
 1036   2HD   ARG 125           HD1      ARG 125  -7.618   2.075 -12.670
 1037    HE   ARG 125           HE       ARG 125  -9.852   3.147 -13.909
 1038   1HH1  ARG 125          HH21      ARG 125  -6.518   4.105 -13.532
 1039   2HH1  ARG 125          HH22      ARG 125  -6.486   4.952 -15.037
 1040   1HH2  ARG 125          HH11      ARG 125  -9.771   4.249 -15.856
 1041   2HH2  ARG 125          HH12      ARG 125  -8.307   5.035 -16.344
 1042    H    GLU 126           HN       GLU 126 -10.056  -1.562  -8.681
 1043    HA   GLU 126           HA       GLU 126 -11.988  -2.390 -10.734
 1044   1HB   GLU 126           HB2      GLU 126 -10.096  -3.850  -9.868
 1045   2HB   GLU 126           HB1      GLU 126 -11.014  -4.005  -8.371
 1046   1HG   GLU 126           HG2      GLU 126 -11.681  -5.884  -9.638
 1047   2HG   GLU 126           HG1      GLU 126 -12.985  -4.722  -9.886
 1048    H    LYS 127           HN       LYS 127 -11.978  -2.247  -7.140
 1049    HA   LYS 127           HA       LYS 127 -14.896  -2.678  -7.161
 1050   1HB   LYS 127           HB2      LYS 127 -12.836  -3.298  -5.371
 1051   2HB   LYS 127           HB1      LYS 127 -13.779  -2.046  -4.561
 1052   1HG   LYS 127           HG2      LYS 127 -15.219  -4.289  -5.936
 1053   2HG   LYS 127           HG1      LYS 127 -14.497  -4.581  -4.354
 1054   1HD   LYS 127           HD2      LYS 127 -16.143  -3.444  -3.319
 1055   2HD   LYS 127           HD1      LYS 127 -15.920  -2.053  -4.382
 1056   1HE   LYS 127           HE2      LYS 127 -17.207  -3.379  -6.151
 1057   2HE   LYS 127           HE1      LYS 127 -17.641  -4.495  -4.858
 1058   1HZ   LYS 127           HZ1      LYS 127 -18.043  -1.735  -4.171
 1059   2HZ   LYS 127           HZ3      LYS 127 -18.980  -2.231  -5.494
 1060   3HZ   LYS 127           HZ2      LYS 127 -19.097  -3.058  -4.014
 1061    OH   TYR 128           OH       TYR 128 -11.430   0.700  -0.813
 1062    H    TYR 128           HN       TYR 128 -12.735   0.027  -7.011
 1063    HA   TYR 128           HA       TYR 128 -14.768   1.717  -5.703
 1064   1HB   TYR 128           HB2      TYR 128 -11.973   2.307  -6.704
 1065   2HB   TYR 128           HB1      TYR 128 -13.034   3.531  -6.004
 1066    HD1  TYR 128           HD2      TYR 128 -14.401   2.276  -3.856
 1067    HD2  TYR 128           HD1      TYR 128 -10.341   1.677  -5.122
 1068    HE1  TYR 128           HE2      TYR 128 -13.815   1.490  -1.586
 1069    HE2  TYR 128           HE1      TYR 128  -9.757   0.887  -2.844
 1070    HH   TYR 128           HH       TYR 128 -12.159   0.918  -0.228
 1071    H    SER 129           HN       SER 129 -14.850   0.513  -8.621
 1072    HA   SER 129           HA       SER 129 -15.189   3.031 -10.132
 1073   1HB   SER 129           HB2      SER 129 -14.349   0.514 -10.877
 1074   2HB   SER 129           HB1      SER 129 -16.025   0.524 -11.421
 1075    HG   SER 129           HG       SER 129 -15.211   2.825 -12.127
 1076    H    LYS 130           HN       LYS 130 -17.046   1.870  -7.851
 1077    HA   LYS 130           HA       LYS 130 -19.540   2.604  -9.249
 1078   1HB   LYS 130           HB2      LYS 130 -18.904  -0.127  -8.205
 1079   2HB   LYS 130           HB1      LYS 130 -20.544   0.483  -7.984
 1080   1HG   LYS 130           HG2      LYS 130 -20.703   0.941 -10.403
 1081   2HG   LYS 130           HG1      LYS 130 -19.066   0.321 -10.626
 1082   1HD   LYS 130           HD2      LYS 130 -19.704  -1.866 -10.337
 1083   2HD   LYS 130           HD1      LYS 130 -20.982  -1.450  -9.194
 1084   1HE   LYS 130           HE2      LYS 130 -22.041  -2.213 -11.228
 1085   2HE   LYS 130           HE1      LYS 130 -22.278  -0.470 -11.122
 1086   1HZ   LYS 130           HZ2      LYS 130 -19.874  -1.392 -12.485
 1087   2HZ   LYS 130           HZ1      LYS 130 -21.349  -1.651 -13.288
 1088   3HZ   LYS 130           HZ3      LYS 130 -20.891  -0.080 -12.842
 1089    H    CYS 131           HN       CYS 131 -17.951   3.859  -7.137
 1090    HA   CYS 131           HA       CYS 131 -19.358   3.322  -4.624
 1091   1HB   CYS 131           HB2      CYS 131 -16.983   4.083  -4.665
 1092   2HB   CYS 131           HB1      CYS 131 -17.516   5.625  -5.335
 1093    H    SER 132           HN       SER 132 -18.996   6.391  -6.441
 1094    HA   SER 132           HA       SER 132 -21.800   7.030  -5.631
 1095   1HB   SER 132           HB2      SER 132 -19.954   9.121  -6.703
 1096   2HB   SER 132           HB1      SER 132 -21.209   9.258  -5.475
 1097    HG   SER 132           HG       SER 132 -19.337   9.297  -4.355
 1098    H    SER 133           HN       SER 133 -23.293   7.585  -7.220
 1099    HA   SER 133           HA       SER 133 -22.508   8.176  -9.954
 1100   1HB   SER 133           HB2      SER 133 -22.818   5.421  -9.219
 1101   2HB   SER 133           HB1      SER 133 -24.148   5.870 -10.285
 1102    HG   SER 133           HG       SER 133 -22.423   5.277 -11.558
   
  Start of MODEL          18
 Raw file had 1102 H/Q atoms
  Start of MODEL   18
    1   1H    GLU   1           HT2      GLU   1 -25.762  16.459  10.281
    2   2H    GLU   1           HT1      GLU   1 -26.565  17.826   9.668
    3   3H    GLU   1           HT3      GLU   1 -26.905  16.290   9.034
    4    HA   GLU   1           HA       GLU   1 -25.115  16.266   7.702
    5   1HB   GLU   1           HB2      GLU   1 -25.063  19.225   8.347
    6   2HB   GLU   1           HB1      GLU   1 -24.628  18.449   6.823
    7   1HG   GLU   1           HG2      GLU   1 -27.379  18.692   8.059
    8   2HG   GLU   1           HG1      GLU   1 -26.830  19.326   6.506
    9    H    ALA   2           HN       ALA   2 -24.057  15.322   9.956
   10    HA   ALA   2           HA       ALA   2 -21.456  16.775  10.169
   11   1HB   ALA   2           HB1      ALA   2 -22.999  17.077  12.202
   12   2HB   ALA   2           HB3      ALA   2 -22.743  15.359  12.509
   13   3HB   ALA   2           HB2      ALA   2 -21.376  16.472  12.530
   14    H    GLU   3           HN       GLU   3 -22.174  14.511   8.501
   15    HA   GLU   3           HA       GLU   3 -20.008  12.732   9.201
   16   1HB   GLU   3           HB2      GLU   3 -21.709  11.919  10.810
   17   2HB   GLU   3           HB1      GLU   3 -22.826  11.638   9.474
   18   1HG   GLU   3           HG2      GLU   3 -21.907   9.614   9.144
   19   2HG   GLU   3           HG1      GLU   3 -20.359  10.387   8.796
   20    H    ALA   4           HN       ALA   4 -19.381  11.576   7.378
   21    HA   ALA   4           HA       ALA   4 -21.213  11.762   5.019
   22   1HB   ALA   4           HB2      ALA   4 -18.602  12.805   5.337
   23   2HB   ALA   4           HB1      ALA   4 -18.450  11.413   4.264
   24   3HB   ALA   4           HB3      ALA   4 -19.549  12.729   3.851
   25    H    HIS   5           HN       HIS   5 -20.455  10.042   3.293
   26    HA   HIS   5           HA       HIS   5 -20.659   7.443   4.593
   27   1HB   HIS   5           HB2      HIS   5 -20.525   8.408   1.747
   28   2HB   HIS   5           HB1      HIS   5 -20.309   6.694   2.101
   29    HD1  HIS   5           HD1      HIS   5 -22.319   6.106   4.218
   30    HD2  HIS   5           HD2      HIS   5 -23.184   8.695   1.066
   31    HE1  HIS   5           HE1      HIS   5 -24.843   6.184   4.027
   32    H    LYS   6           HN       LYS   6 -19.055   5.715   3.310
   33    HA   LYS   6           HA       LYS   6 -16.335   6.611   4.119
   34   1HB   LYS   6           HB2      LYS   6 -17.749   4.002   3.969
   35   2HB   LYS   6           HB1      LYS   6 -16.007   4.000   3.694
   36   1HG   LYS   6           HG2      LYS   6 -15.723   4.051   5.931
   37   2HG   LYS   6           HG1      LYS   6 -16.404   5.679   5.917
   38   1HD   LYS   6           HD2      LYS   6 -18.066   4.844   7.198
   39   2HD   LYS   6           HD1      LYS   6 -18.644   4.043   5.738
   40   1HE   LYS   6           HE2      LYS   6 -16.500   2.781   7.436
   41   2HE   LYS   6           HE1      LYS   6 -18.205   2.584   7.844
   42   1HZ   LYS   6           HZ2      LYS   6 -17.312   2.085   5.088
   43   2HZ   LYS   6           HZ1      LYS   6 -17.044   0.898   6.274
   44   3HZ   LYS   6           HZ3      LYS   6 -18.624   1.414   5.935
   45    H    CYS   7           HN       CYS   7 -17.528   7.383   1.617
   46    HA   CYS   7           HA       CYS   7 -15.394   6.432  -0.191
   47   1HB   CYS   7           HB2      CYS   7 -17.484   4.943  -0.435
   48   2HB   CYS   7           HB1      CYS   7 -18.267   6.362  -1.129
   49    H    ASP   8           HN       ASP   8 -15.952   8.972   1.098
   50    HA   ASP   8           HA       ASP   8 -17.042  10.670  -1.056
   51   1HB   ASP   8           HB2      ASP   8 -15.999  11.383   1.703
   52   2HB   ASP   8           HB1      ASP   8 -16.779  12.505   0.585
   53    H    ILE   9           HN       ILE   9 -14.583  12.373   0.605
   54    HA   ILE   9           HA       ILE   9 -12.939  12.300  -1.838
   55    HB   ILE   9           HB       ILE   9 -13.222  14.119   0.514
   56   1HG1  ILE   9          HG12      ILE   9 -12.605  15.472  -1.878
   57   2HG1  ILE   9          HG11      ILE   9 -13.640  14.126  -2.354
   58   1HG2  ILE   9          HG22      ILE   9 -10.715  13.794  -1.147
   59   2HG2  ILE   9          HG21      ILE   9 -11.097  15.281  -0.278
   60   3HG2  ILE   9          HG23      ILE   9 -10.854  13.778   0.611
   61   1HD1  ILE   9          HD12      ILE   9 -14.410  15.731   0.051
   62   2HD1  ILE   9          HD11      ILE   9 -14.701  16.418  -1.547
   63   3HD1  ILE   9          HD13      ILE   9 -15.438  14.879  -1.100
   64    H    THR  10           HN       THR  10 -12.906  10.872   1.308
   65    HA   THR  10           HA       THR  10 -10.050  10.669   1.634
   66    HB   THR  10           HB       THR  10 -12.225   8.850   2.702
   67    HG1  THR  10           HG1      THR  10 -12.593  10.387   4.066
   68   1HG2  THR  10          HG22      THR  10  -9.333   9.291   3.488
   69   2HG2  THR  10          HG21      THR  10 -10.495   8.405   4.475
   70   3HG2  THR  10          HG23      THR  10 -10.051   7.800   2.878
   71    H    LEU  11           HN       LEU  11 -12.459   8.650   0.007
   72    HA   LEU  11           HA       LEU  11 -10.576   6.494  -0.524
   73   1HB   LEU  11           HB2      LEU  11 -13.404   7.086  -1.094
   74   2HB   LEU  11           HB1      LEU  11 -12.591   6.164  -2.358
   75    HG   LEU  11           HG       LEU  11 -13.657   4.760  -0.536
   76   1HD1  LEU  11          HD12      LEU  11 -11.745   4.019  -2.016
   77   2HD1  LEU  11          HD11      LEU  11 -10.646   4.481  -0.715
   78   3HD1  LEU  11          HD13      LEU  11 -11.827   3.196  -0.459
   79   1HD2  LEU  11          HD23      LEU  11 -12.898   6.419   1.277
   80   2HD2  LEU  11          HD22      LEU  11 -12.688   4.706   1.639
   81   3HD2  LEU  11          HD21      LEU  11 -11.305   5.675   1.133
   82    H    GLN  12           HN       GLN  12 -12.046   9.038  -2.588
   83    HA   GLN  12           HA       GLN  12 -10.684   8.365  -4.977
   84   1HB   GLN  12           HB2      GLN  12 -11.503  11.110  -3.983
   85   2HB   GLN  12           HB1      GLN  12 -11.084  10.715  -5.650
   86   1HG   GLN  12           HG2      GLN  12 -12.931   9.039  -5.681
   87   2HG   GLN  12           HG1      GLN  12 -13.384   9.550  -4.055
   88   1HE2  GLN  12          HE22      GLN  12 -14.749  12.683  -5.142
   89   2HE2  GLN  12          HE21      GLN  12 -14.058  11.885  -3.811
   90    H    GLU  13           HN       GLU  13  -9.696  10.637  -2.416
   91    HA   GLU  13           HA       GLU  13  -7.236  11.431  -3.611
   92   1HB   GLU  13           HB2      GLU  13  -8.415  12.426  -1.547
   93   2HB   GLU  13           HB1      GLU  13  -7.643  11.131  -0.632
   94   1HG   GLU  13           HG2      GLU  13  -5.532  12.006  -0.903
   95   2HG   GLU  13           HG1      GLU  13  -5.913  12.711  -2.474
   96    H    ILE  14           HN       ILE  14  -8.007   8.773  -1.379
   97    HA   ILE  14           HA       ILE  14  -5.344   7.805  -1.054
   98    HB   ILE  14           HB       ILE  14  -8.080   6.839  -0.552
   99   1HG1  ILE  14          HG12      ILE  14  -5.575   6.121   0.956
  100   2HG1  ILE  14          HG11      ILE  14  -6.220   7.762   1.038
  101   1HG2  ILE  14          HG23      ILE  14  -5.832   4.911  -1.194
  102   2HG2  ILE  14          HG22      ILE  14  -7.245   4.461  -0.240
  103   3HG2  ILE  14          HG21      ILE  14  -7.440   4.966  -1.918
  104   1HD1  ILE  14          HD12      ILE  14  -8.438   6.048   1.368
  105   2HD1  ILE  14          HD11      ILE  14  -7.157   5.379   2.378
  106   3HD1  ILE  14          HD13      ILE  14  -7.674   7.050   2.603
  107    H    ILE  15           HN       ILE  15  -7.627   7.477  -3.683
  108    HA   ILE  15           HA       ILE  15  -6.370   5.184  -4.916
  109    HB   ILE  15           HB       ILE  15  -8.336   7.278  -5.817
  110   1HG1  ILE  15          HG12      ILE  15  -8.567   4.270  -5.911
  111   2HG1  ILE  15          HG11      ILE  15  -8.864   5.158  -4.415
  112   1HG2  ILE  15          HG22      ILE  15  -6.910   5.224  -7.520
  113   2HG2  ILE  15          HG21      ILE  15  -8.453   5.945  -7.980
  114   3HG2  ILE  15          HG23      ILE  15  -7.025   6.963  -7.796
  115   1HD1  ILE  15          HD13      ILE  15 -10.278   6.578  -6.372
  116   2HD1  ILE  15          HD12      ILE  15 -10.571   4.880  -6.751
  117   3HD1  ILE  15          HD11      ILE  15 -10.965   5.507  -5.151
  118    H    LYS  16           HN       LYS  16  -6.165   8.710  -5.498
  119    HA   LYS  16           HA       LYS  16  -4.298   8.560  -7.650
  120   1HB   LYS  16           HB2      LYS  16  -4.819  10.711  -5.586
  121   2HB   LYS  16           HB1      LYS  16  -3.690  10.922  -6.925
  122   1HG   LYS  16           HG2      LYS  16  -5.360  11.241  -8.413
  123   2HG   LYS  16           HG1      LYS  16  -6.274   9.862  -7.797
  124   1HD   LYS  16           HD2      LYS  16  -7.667  11.680  -7.273
  125   2HD   LYS  16           HD1      LYS  16  -6.789  11.413  -5.767
  126   1HE   LYS  16           HE2      LYS  16  -5.914  13.482  -5.867
  127   2HE   LYS  16           HE1      LYS  16  -5.245  13.148  -7.464
  128   1HZ   LYS  16           HZ1      LYS  16  -8.114  13.704  -7.229
  129   2HZ   LYS  16           HZ3      LYS  16  -7.030  15.005  -7.120
  130   3HZ   LYS  16           HZ2      LYS  16  -7.050  14.031  -8.513
  131    H    THR  17           HN       THR  17  -3.782   8.836  -4.141
  132    HA   THR  17           HA       THR  17  -0.935   9.034  -4.252
  133    HB   THR  17           HB       THR  17  -2.167   7.559  -1.974
  134    HG1  THR  17           HG1      THR  17  -3.011   9.592  -1.228
  135   1HG2  THR  17          HG23      THR  17   0.186   8.323  -1.968
  136   2HG2  THR  17          HG22      THR  17  -0.363   9.984  -2.189
  137   3HG2  THR  17          HG21      THR  17  -0.754   9.118  -0.704
  138    H    LEU  18           HN       LEU  18  -3.105   6.223  -4.150
  139    HA   LEU  18           HA       LEU  18  -1.170   4.200  -3.758
  140   1HB   LEU  18           HB2      LEU  18  -3.834   4.163  -4.107
  141   2HB   LEU  18           HB1      LEU  18  -3.348   3.688  -5.733
  142    HG   LEU  18           HG       LEU  18  -3.529   1.634  -4.597
  143   1HD1  LEU  18          HD13      LEU  18  -1.289   2.038  -5.728
  144   2HD1  LEU  18          HD12      LEU  18  -0.629   2.338  -4.120
  145   3HD1  LEU  18          HD11      LEU  18  -1.309   0.761  -4.514
  146   1HD2  LEU  18          HD23      LEU  18  -3.046   3.259  -2.302
  147   2HD2  LEU  18          HD22      LEU  18  -3.599   1.584  -2.351
  148   3HD2  LEU  18          HD21      LEU  18  -1.873   1.942  -2.283
  149    H    ASN  19           HN       ASN  19  -2.367   5.570  -6.841
  150    HA   ASN  19           HA       ASN  19  -0.620   4.051  -8.515
  151   1HB   ASN  19           HB2      ASN  19  -1.982   6.725  -8.912
  152   2HB   ASN  19           HB1      ASN  19  -1.060   5.917 -10.182
  153   1HD2  ASN  19          HD22      ASN  19  -3.984   4.164 -11.077
  154   2HD2  ASN  19          HD21      ASN  19  -2.698   5.154 -11.575
  155    H    SER  20           HN       SER  20  -0.157   7.082  -6.768
  156    HA   SER  20           HA       SER  20   2.269   7.858  -8.104
  157   1HB   SER  20           HB2      SER  20   1.058   8.531  -5.425
  158   2HB   SER  20           HB1      SER  20   2.640   9.148  -5.894
  159    HG   SER  20           HG       SER  20   1.305   9.672  -7.951
  160    H    LEU  21           HN       LEU  21   1.574   5.618  -5.493
  161    HA   LEU  21           HA       LEU  21   4.340   5.391  -4.619
  162   1HB   LEU  21           HB2      LEU  21   1.789   3.903  -4.070
  163   2HB   LEU  21           HB1      LEU  21   3.330   3.186  -3.595
  164    HG   LEU  21           HG       LEU  21   3.135   6.020  -2.883
  165   1HD1  LEU  21          HD11      LEU  21   0.734   5.282  -2.649
  166   2HD1  LEU  21          HD13      LEU  21   1.278   4.079  -1.479
  167   3HD1  LEU  21          HD12      LEU  21   1.481   5.797  -1.136
  168   1HD2  LEU  21          HD21      LEU  21   4.492   3.717  -2.067
  169   2HD2  LEU  21          HD23      LEU  21   4.542   5.288  -1.270
  170   3HD2  LEU  21          HD22      LEU  21   3.393   4.064  -0.733
  171    H    THR  22           HN       THR  22   2.378   3.896  -7.100
  172    HA   THR  22           HA       THR  22   4.185   1.629  -7.473
  173    HB   THR  22           HB       THR  22   2.796   1.486  -9.687
  174    HG1  THR  22           HG1      THR  22   1.381   2.997  -9.913
  175   1HG2  THR  22          HG23      THR  22   2.566   0.256  -7.365
  176   2HG2  THR  22          HG22      THR  22   1.119   1.253  -7.215
  177   3HG2  THR  22          HG21      THR  22   1.279   0.130  -8.566
  178    H    GLU  23           HN       GLU  23   4.468   4.902  -8.258
  179    HA   GLU  23           HA       GLU  23   5.447   4.900 -10.901
  180   1HB   GLU  23           HB2      GLU  23   5.097   6.867  -9.207
  181   2HB   GLU  23           HB1      GLU  23   6.777   6.552  -8.770
  182   1HG   GLU  23           HG2      GLU  23   7.513   6.921 -11.040
  183   2HG   GLU  23           HG1      GLU  23   5.849   7.010 -11.617
  184    H    GLN  24           HN       GLN  24   7.026   3.904  -7.908
  185    HA   GLN  24           HA       GLN  24   9.405   3.112  -9.541
  186   1HB   GLN  24           HB2      GLN  24   9.423   4.821  -7.421
  187   2HB   GLN  24           HB1      GLN  24   9.707   3.287  -6.602
  188   1HG   GLN  24           HG2      GLN  24  11.804   3.118  -7.429
  189   2HG   GLN  24           HG1      GLN  24  11.276   3.547  -9.056
  190   1HE2  GLN  24          HE22      GLN  24  13.136   6.532  -8.523
  191   2HE2  GLN  24          HE21      GLN  24  13.094   5.042  -9.336
  192    H    LYS  25           HN       LYS  25   7.947   1.188  -9.943
  193    HA   LYS  25           HA       LYS  25   8.054  -0.718  -7.652
  194   1HB   LYS  25           HB2      LYS  25   6.252  -1.964  -8.762
  195   2HB   LYS  25           HB1      LYS  25   5.775  -0.288  -8.506
  196   1HG   LYS  25           HG2      LYS  25   6.854  -0.042 -10.963
  197   2HG   LYS  25           HG1      LYS  25   6.353  -1.728 -11.047
  198   1HD   LYS  25           HD2      LYS  25   4.236  -0.246  -9.832
  199   2HD   LYS  25           HD1      LYS  25   4.726   0.604 -11.298
  200   1HE   LYS  25           HE2      LYS  25   4.493  -2.352 -11.503
  201   2HE   LYS  25           HE1      LYS  25   2.984  -1.456 -11.331
  202   1HZ   LYS  25           HZ2      LYS  25   3.811  -0.001 -13.171
  203   2HZ   LYS  25           HZ1      LYS  25   5.062  -1.123 -13.418
  204   3HZ   LYS  25           HZ3      LYS  25   3.446  -1.596 -13.629
  205    H    THR  26           HN       THR  26  10.410  -0.905  -8.382
  206    HA   THR  26           HA       THR  26  10.670  -3.333  -9.959
  207    HB   THR  26           HB       THR  26  11.507  -0.676 -11.117
  208    HG1  THR  26           HG1      THR  26   9.727  -1.291 -12.095
  209   1HG2  THR  26          HG23      THR  26  12.799  -3.358 -11.397
  210   2HG2  THR  26          HG22      THR  26  12.667  -2.340 -12.830
  211   3HG2  THR  26          HG21      THR  26  13.532  -1.754 -11.410
  212    H    LEU  27           HN       LEU  27  12.441  -0.489  -8.713
  213    HA   LEU  27           HA       LEU  27  14.765  -2.206  -8.115
  214   1HB   LEU  27           HB2      LEU  27  14.863   0.216  -9.027
  215   2HB   LEU  27           HB1      LEU  27  14.480   0.706  -7.377
  216    HG   LEU  27           HG       LEU  27  16.605  -1.307  -7.496
  217   1HD1  LEU  27          HD12      LEU  27  16.797   0.303  -9.620
  218   2HD1  LEU  27          HD11      LEU  27  17.480   1.398  -8.418
  219   3HD1  LEU  27          HD13      LEU  27  18.223  -0.177  -8.699
  220   1HD2  LEU  27          HD21      LEU  27  16.025   1.326  -6.177
  221   2HD2  LEU  27          HD23      LEU  27  16.401  -0.231  -5.440
  222   3HD2  LEU  27          HD22      LEU  27  17.683   0.725  -6.183
  223    H    CYS  28           HN       CYS  28  12.339  -0.298  -6.340
  224    HA   CYS  28           HA       CYS  28  13.455  -1.270  -3.782
  225   1HB   CYS  28           HB2      CYS  28  11.624   0.883  -4.618
  226   2HB   CYS  28           HB1      CYS  28  11.172   0.088  -3.110
  227    H    THR  29           HN       THR  29  10.892  -2.079  -5.984
  228    HA   THR  29           HA       THR  29   9.395  -3.577  -3.941
  229    HB   THR  29           HB       THR  29   7.896  -4.165  -5.826
  230    HG1  THR  29           HG1      THR  29  10.061  -3.424  -7.216
  231   1HG2  THR  29          HG23      THR  29   8.663  -1.243  -5.614
  232   2HG2  THR  29          HG22      THR  29   7.144  -1.845  -6.276
  233   3HG2  THR  29          HG21      THR  29   7.525  -2.097  -4.573
  234    H    GLU  30           HN       GLU  30  12.246  -4.269  -5.182
  235    HA   GLU  30           HA       GLU  30  11.701  -6.978  -6.193
  236   1HB   GLU  30           HB2      GLU  30  14.129  -7.095  -6.523
  237   2HB   GLU  30           HB1      GLU  30  13.511  -5.578  -7.175
  238   1HG   GLU  30           HG2      GLU  30  14.177  -4.417  -5.094
  239   2HG   GLU  30           HG1      GLU  30  14.822  -5.925  -4.461
  240    H    LEU  31           HN       LEU  31  10.772  -6.704  -3.531
  241    HA   LEU  31           HA       LEU  31  12.824  -8.131  -1.949
  242   1HB   LEU  31           HB2      LEU  31  10.286  -6.773  -1.007
  243   2HB   LEU  31           HB1      LEU  31  11.566  -7.431   0.014
  244    HG   LEU  31           HG       LEU  31  12.573  -5.527  -1.973
  245   1HD1  LEU  31          HD11      LEU  31  10.619  -4.575   0.146
  246   2HD1  LEU  31          HD13      LEU  31  11.647  -3.529  -0.833
  247   3HD1  LEU  31          HD12      LEU  31  10.377  -4.484  -1.599
  248   1HD2  LEU  31          HD21      LEU  31  12.739  -5.923   1.022
  249   2HD2  LEU  31          HD23      LEU  31  13.995  -6.204  -0.183
  250   3HD2  LEU  31          HD22      LEU  31  13.509  -4.556   0.214
  251    H    THR  32           HN       THR  32  10.286  -8.919  -0.300
  252    HA   THR  32           HA       THR  32   8.847 -10.773  -1.979
  253    HB   THR  32           HB       THR  32   9.715 -12.749  -0.522
  254    HG1  THR  32           HG1      THR  32  12.051 -11.182  -0.599
  255   1HG2  THR  32          HG21      THR  32  10.073 -12.118  -3.069
  256   2HG2  THR  32          HG23      THR  32  11.734 -11.867  -2.535
  257   3HG2  THR  32          HG22      THR  32  10.973 -13.444  -2.335
  258    H    VAL  33           HN       VAL  33   7.625  -9.107  -0.909
  259    HA   VAL  33           HA       VAL  33   6.934  -9.657   1.883
  260    HB   VAL  33           HB       VAL  33   5.432  -7.750   1.673
  261   1HG1  VAL  33          HG13      VAL  33   8.062  -7.538   1.722
  262   2HG1  VAL  33          HG12      VAL  33   7.838  -6.894   0.095
  263   3HG1  VAL  33          HG11      VAL  33   7.067  -6.103   1.470
  264   1HG2  VAL  33          HG22      VAL  33   5.827  -8.320  -1.219
  265   2HG2  VAL  33          HG21      VAL  33   4.400  -7.718  -0.377
  266   3HG2  VAL  33          HG23      VAL  33   5.721  -6.619  -0.768
  267    H    THR  34           HN       THR  34   5.500 -11.051   2.373
  268    HA   THR  34           HA       THR  34   4.133 -12.940   1.007
  269    HB   THR  34           HB       THR  34   3.561 -11.488   3.509
  270    HG1  THR  34           HG1      THR  34   3.734 -14.136   2.580
  271   1HG2  THR  34          HG23      THR  34   1.372 -12.940   2.000
  272   2HG2  THR  34          HG22      THR  34   1.324 -12.662   3.738
  273   3HG2  THR  34          HG21      THR  34   1.332 -11.292   2.632
  274    H    ASP  35           HN       ASP  35   2.551 -13.044  -0.522
  275    HA   ASP  35           HA       ASP  35   1.266 -10.571  -1.432
  276   1HB   ASP  35           HB2      ASP  35   1.932 -12.947  -2.672
  277   2HB   ASP  35           HB1      ASP  35   0.193 -13.126  -2.441
  278    H    ILE  36           HN       ILE  36  -1.171 -10.414  -1.480
  279    HA   ILE  36           HA       ILE  36  -2.475 -12.168   0.525
  280    HB   ILE  36           HB       ILE  36  -3.172 -10.445   1.940
  281   1HG1  ILE  36          HG12      ILE  36  -2.667  -8.672  -0.444
  282   2HG1  ILE  36          HG11      ILE  36  -4.128  -8.821   0.533
  283   1HG2  ILE  36          HG21      ILE  36  -0.653 -10.844   1.912
  284   2HG2  ILE  36          HG23      ILE  36  -0.522  -9.349   0.985
  285   3HG2  ILE  36          HG22      ILE  36  -1.181  -9.320   2.622
  286   1HD1  ILE  36          HD12      ILE  36  -2.780  -7.872   2.474
  287   2HD1  ILE  36          HD11      ILE  36  -1.531  -7.475   1.296
  288   3HD1  ILE  36          HD13      ILE  36  -3.129  -6.743   1.165
  289    H    PHE  37           HN       PHE  37  -2.661 -11.833  -2.405
  290    HA   PHE  37           HA       PHE  37  -5.577 -11.171  -2.540
  291   1HB   PHE  37           HB2      PHE  37  -3.471 -10.678  -4.672
  292   2HB   PHE  37           HB1      PHE  37  -5.202 -10.412  -4.872
  293    HD1  PHE  37           HD2      PHE  37  -6.354  -8.605  -3.675
  294    HD2  PHE  37           HD1      PHE  37  -2.117  -9.198  -3.300
  295    HE1  PHE  37           HE2      PHE  37  -6.127  -6.350  -2.669
  296    HE2  PHE  37           HE1      PHE  37  -1.889  -6.943  -2.296
  297    HZ   PHE  37           HZ       PHE  37  -3.895  -5.520  -1.978
  298    H    ALA  38           HN       ALA  38  -4.123 -13.754  -2.108
  299    HA   ALA  38           HA       ALA  38  -3.978 -15.330  -4.443
  300   1HB   ALA  38           HB1      ALA  38  -4.202 -15.807  -1.566
  301   2HB   ALA  38           HB3      ALA  38  -4.994 -17.060  -2.521
  302   3HB   ALA  38           HB2      ALA  38  -3.288 -16.700  -2.782
  303    H    ALA  39           HN       ALA  39  -6.783 -14.327  -2.561
  304    HA   ALA  39           HA       ALA  39  -8.535 -15.045  -4.795
  305   1HB   ALA  39           HB3      ALA  39  -8.301 -17.194  -3.531
  306   2HB   ALA  39           HB2      ALA  39  -8.948 -16.383  -2.105
  307   3HB   ALA  39           HB1      ALA  39  -9.954 -16.578  -3.541
  308    H    SER  40           HN       SER  40 -10.933 -14.578  -4.019
  309    HA   SER  40           HA       SER  40 -10.874 -12.253  -2.140
  310   1HB   SER  40           HB2      SER  40 -11.160 -11.926  -4.803
  311   2HB   SER  40           HB1      SER  40 -12.839 -12.233  -4.376
  312    HG   SER  40           HG       SER  40 -12.820 -10.207  -3.810
  313    H    LYS  41           HN       LYS  41 -11.882 -13.230  -0.393
  314    HA   LYS  41           HA       LYS  41 -14.607 -14.340  -0.919
  315   1HB   LYS  41           HB2      LYS  41 -12.365 -15.724   0.130
  316   2HB   LYS  41           HB1      LYS  41 -13.466 -15.449   1.482
  317   1HG   LYS  41           HG2      LYS  41 -15.276 -16.205  -0.335
  318   2HG   LYS  41           HG1      LYS  41 -13.880 -17.047  -1.005
  319   1HD   LYS  41           HD2      LYS  41 -14.073 -18.641   0.567
  320   2HD   LYS  41           HD1      LYS  41 -13.871 -17.427   1.830
  321   1HE   LYS  41           HE2      LYS  41 -16.351 -16.878   1.489
  322   2HE   LYS  41           HE1      LYS  41 -16.441 -18.370   0.553
  323   1HZ   LYS  41           HZ1      LYS  41 -15.083 -19.007   2.865
  324   2HZ   LYS  41           HZ3      LYS  41 -16.374 -18.027   3.367
  325   3HZ   LYS  41           HZ2      LYS  41 -16.678 -19.435   2.465
  326    H    ASP  42           HN       ASP  42 -12.771 -13.678   2.079
  327    HA   ASP  42           HA       ASP  42 -15.063 -11.973   2.937
  328   1HB   ASP  42           HB2      ASP  42 -13.536 -13.981   4.258
  329   2HB   ASP  42           HB1      ASP  42 -13.191 -12.445   5.055
  330    H    THR  43           HN       THR  43 -12.462 -11.297   1.280
  331    HA   THR  43           HA       THR  43 -11.704  -8.965   2.986
  332    HB   THR  43           HB       THR  43  -9.603  -8.890   1.708
  333    HG1  THR  43           HG1      THR  43 -10.326 -11.390   0.625
  334   1HG2  THR  43          HG21      THR  43 -10.335 -10.780   3.648
  335   2HG2  THR  43          HG23      THR  43  -9.427 -11.692   2.442
  336   3HG2  THR  43          HG22      THR  43  -8.695 -10.290   3.221
  337    H    THR  44           HN       THR  44 -12.935  -7.319   2.286
  338    HA   THR  44           HA       THR  44 -13.453  -7.065  -0.613
  339    HB   THR  44           HB       THR  44 -14.842  -5.002   0.544
  340    HG1  THR  44           HG1      THR  44 -15.291  -5.475   2.536
  341   1HG2  THR  44          HG22      THR  44 -15.397  -7.354  -0.825
  342   2HG2  THR  44          HG21      THR  44 -16.310  -7.528   0.673
  343   3HG2  THR  44          HG23      THR  44 -16.577  -6.127  -0.364
  344    H    GLU  45           HN       GLU  45 -13.276  -4.299   1.561
  345    HA   GLU  45           HA       GLU  45 -10.847  -3.417   0.070
  346   1HB   GLU  45           HB2      GLU  45 -11.806  -1.060   0.246
  347   2HB   GLU  45           HB1      GLU  45 -12.618  -2.123  -0.899
  348   1HG   GLU  45           HG2      GLU  45 -14.266  -2.676   0.960
  349   2HG   GLU  45           HG1      GLU  45 -13.541  -1.353   1.876
  350    H    LYS  46           HN       LYS  46 -12.902  -2.876   2.930
  351    HA   LYS  46           HA       LYS  46 -10.835  -1.528   4.420
  352   1HB   LYS  46           HB2      LYS  46 -12.307  -1.822   6.335
  353   2HB   LYS  46           HB1      LYS  46 -13.293  -1.397   4.938
  354   1HG   LYS  46           HG2      LYS  46 -13.503  -3.968   4.597
  355   2HG   LYS  46           HG1      LYS  46 -12.975  -4.075   6.277
  356   1HD   LYS  46           HD2      LYS  46 -15.023  -3.500   7.010
  357   2HD   LYS  46           HD1      LYS  46 -15.006  -2.039   6.019
  358   1HE   LYS  46           HE2      LYS  46 -15.546  -4.722   4.766
  359   2HE   LYS  46           HE1      LYS  46 -16.845  -3.829   5.558
  360   1HZ   LYS  46           HZ3      LYS  46 -15.365  -2.092   3.901
  361   2HZ   LYS  46           HZ2      LYS  46 -15.842  -3.449   2.998
  362   3HZ   LYS  46           HZ1      LYS  46 -17.006  -2.510   3.804
  363    H    GLU  47           HN       GLU  47 -11.684  -4.894   3.839
  364    HA   GLU  47           HA       GLU  47 -10.040  -5.923   6.016
  365   1HB   GLU  47           HB2      GLU  47 -11.579  -7.053   3.734
  366   2HB   GLU  47           HB1      GLU  47 -10.230  -8.023   4.328
  367   1HG   GLU  47           HG2      GLU  47 -12.356  -6.864   6.146
  368   2HG   GLU  47           HG1      GLU  47 -12.457  -8.484   5.455
  369    H    THR  48           HN       THR  48  -9.651  -5.561   2.488
  370    HA   THR  48           HA       THR  48  -6.977  -6.621   2.423
  371    HB   THR  48           HB       THR  48  -7.764  -4.545   0.436
  372    HG1  THR  48           HG1      THR  48  -9.095  -6.270  -0.533
  373   1HG2  THR  48          HG21      THR  48  -6.291  -7.124   0.573
  374   2HG2  THR  48          HG23      THR  48  -7.111  -6.759  -0.945
  375   3HG2  THR  48          HG22      THR  48  -5.897  -5.648  -0.309
  376    H    PHE  49           HN       PHE  49  -8.227  -3.532   3.441
  377    HA   PHE  49           HA       PHE  49  -5.669  -2.156   3.040
  378   1HB   PHE  49           HB2      PHE  49  -8.232  -1.358   4.435
  379   2HB   PHE  49           HB1      PHE  49  -6.795  -0.342   4.425
  380    HD1  PHE  49           HD2      PHE  49  -5.804  -0.916   1.606
  381    HD2  PHE  49           HD1      PHE  49  -9.735  -0.087   3.137
  382    HE1  PHE  49           HE2      PHE  49  -6.484  -0.045  -0.607
  383    HE2  PHE  49           HE1      PHE  49 -10.407   0.791   0.922
  384    HZ   PHE  49           HZ       PHE  49  -8.785   0.810  -0.952
  385    H    CYS  50           HN       CYS  50  -7.353  -3.804   5.666
  386    HA   CYS  50           HA       CYS  50  -5.561  -2.855   7.741
  387   1HB   CYS  50           HB2      CYS  50  -7.839  -3.837   8.170
  388   2HB   CYS  50           HB1      CYS  50  -7.195  -5.413   7.712
  389    NH1  ARG  51           NH2      ARG  51  -6.439 -12.274   4.183
  390    NH2  ARG  51           NH1      ARG  51  -4.254 -12.843   4.243
  391    H    ARG  51           HN       ARG  51  -5.748  -5.942   5.926
  392    HA   ARG  51           HA       ARG  51  -3.353  -7.039   7.060
  393   1HB   ARG  51           HB2      ARG  51  -4.600  -7.556   4.337
  394   2HB   ARG  51           HB1      ARG  51  -3.395  -8.577   5.123
  395   1HG   ARG  51           HG2      ARG  51  -4.922  -9.055   6.956
  396   2HG   ARG  51           HG1      ARG  51  -6.109  -7.925   6.306
  397   1HD   ARG  51           HD2      ARG  51  -6.757 -10.189   5.685
  398   2HD   ARG  51           HD1      ARG  51  -6.243  -9.324   4.236
  399    HE   ARG  51           HE       ARG  51  -3.934 -10.577   5.123
  400   1HH1  ARG  51          HH21      ARG  51  -7.174 -11.615   4.337
  401   2HH1  ARG  51          HH22      ARG  51  -6.654 -13.180   3.819
  402   1HH2  ARG  51          HH11      ARG  51  -3.301 -12.615   4.444
  403   2HH2  ARG  51          HH12      ARG  51  -4.486 -13.745   3.881
  404    H    ALA  52           HN       ALA  52  -3.924  -5.345   3.964
  405    HA   ALA  52           HA       ALA  52  -1.170  -5.231   3.194
  406   1HB   ALA  52           HB2      ALA  52  -3.495  -3.411   2.497
  407   2HB   ALA  52           HB1      ALA  52  -1.924  -3.374   1.695
  408   3HB   ALA  52           HB3      ALA  52  -2.942  -4.809   1.575
  409    H    ALA  53           HN       ALA  53  -2.953  -3.485   5.601
  410    HA   ALA  53           HA       ALA  53  -1.298  -1.108   5.616
  411   1HB   ALA  53           HB2      ALA  53  -3.444  -2.258   7.297
  412   2HB   ALA  53           HB1      ALA  53  -2.275  -1.262   8.162
  413   3HB   ALA  53           HB3      ALA  53  -3.175  -0.587   6.804
  414    H    THR  54           HN       THR  54  -1.324  -4.151   7.478
  415    HA   THR  54           HA       THR  54   0.900  -3.491   9.159
  416    HB   THR  54           HB       THR  54  -0.411  -6.046   8.280
  417    HG1  THR  54           HG1      THR  54  -1.204  -4.892  10.057
  418   1HG2  THR  54          HG22      THR  54   2.343  -5.738   9.438
  419   2HG2  THR  54          HG21      THR  54   1.353  -7.121   9.903
  420   3HG2  THR  54          HG23      THR  54   1.773  -6.866   8.209
  421    H    VAL  55           HN       VAL  55   0.680  -5.107   5.994
  422    HA   VAL  55           HA       VAL  55   3.462  -5.665   5.695
  423    HB   VAL  55           HB       VAL  55   1.258  -5.139   3.688
  424   1HG1  VAL  55          HG13      VAL  55   4.195  -5.485   3.303
  425   2HG1  VAL  55          HG12      VAL  55   3.130  -6.355   2.199
  426   3HG1  VAL  55          HG11      VAL  55   3.031  -4.597   2.320
  427   1HG2  VAL  55          HG21      VAL  55   2.375  -7.456   5.119
  428   2HG2  VAL  55          HG23      VAL  55   0.805  -7.270   4.337
  429   3HG2  VAL  55          HG22      VAL  55   2.222  -7.708   3.380
  430    H    LEU  56           HN       LEU  56   1.558  -2.745   5.164
  431    HA   LEU  56           HA       LEU  56   3.605  -1.267   3.774
  432   1HB   LEU  56           HB2      LEU  56   0.953  -0.766   4.821
  433   2HB   LEU  56           HB1      LEU  56   2.037   0.560   5.247
  434    HG   LEU  56           HG       LEU  56   2.795   0.540   2.806
  435   1HD1  LEU  56          HD12      LEU  56   1.871  -1.720   2.303
  436   2HD1  LEU  56          HD11      LEU  56   0.243  -1.074   2.510
  437   3HD1  LEU  56          HD13      LEU  56   1.263  -0.488   1.197
  438   1HD2  LEU  56          HD23      LEU  56  -0.062   1.230   3.555
  439   2HD2  LEU  56          HD22      LEU  56   1.340   2.298   3.617
  440   3HD2  LEU  56          HD21      LEU  56   0.711   1.760   2.060
  441    NH1  ARG  57           NH2      ARG  57   2.802  -2.769  13.902
  442    NH2  ARG  57           NH1      ARG  57   3.039  -0.550  14.247
  443    H    ARG  57           HN       ARG  57   2.835  -1.839   7.155
  444    HA   ARG  57           HA       ARG  57   4.505   0.144   8.332
  445   1HB   ARG  57           HB2      ARG  57   3.402  -0.797  10.078
  446   2HB   ARG  57           HB1      ARG  57   3.128  -2.297   9.195
  447   1HG   ARG  57           HG2      ARG  57   5.338  -3.109   9.759
  448   2HG   ARG  57           HG1      ARG  57   5.778  -1.553  10.466
  449   1HD   ARG  57           HD2      ARG  57   3.504  -3.280  11.477
  450   2HD   ARG  57           HD1      ARG  57   5.131  -3.304  12.158
  451    HE   ARG  57           HE       ARG  57   4.429  -0.628  12.226
  452   1HH1  ARG  57          HH21      ARG  57   2.992  -3.596  13.376
  453   2HH1  ARG  57          HH22      ARG  57   2.222  -2.822  14.715
  454   1HH2  ARG  57          HH11      ARG  57   3.416   0.337  13.979
  455   2HH2  ARG  57          HH12      ARG  57   2.458  -0.621  15.058
  456    H    GLN  58           HN       GLN  58   5.186  -3.242   7.411
  457    HA   GLN  58           HA       GLN  58   7.988  -3.070   8.121
  458   1HB   GLN  58           HB2      GLN  58   6.468  -5.177   7.701
  459   2HB   GLN  58           HB1      GLN  58   6.959  -4.958   6.021
  460   1HG   GLN  58           HG2      GLN  58   9.115  -5.585   6.430
  461   2HG   GLN  58           HG1      GLN  58   9.148  -4.798   8.009
  462   1HE2  GLN  58          HE22      GLN  58   7.999  -8.716   7.728
  463   2HE2  GLN  58          HE21      GLN  58   8.166  -7.776   6.324
  464    H    PHE  59           HN       PHE  59   6.117  -2.016   5.401
  465    HA   PHE  59           HA       PHE  59   8.065  -2.063   3.339
  466   1HB   PHE  59           HB2      PHE  59   5.520  -1.419   3.338
  467   2HB   PHE  59           HB1      PHE  59   6.114   0.208   3.643
  468    HD1  PHE  59           HD2      PHE  59   8.418   0.627   2.033
  469    HD2  PHE  59           HD1      PHE  59   4.963  -1.765   1.131
  470    HE1  PHE  59           HE2      PHE  59   8.861   0.901  -0.383
  471    HE2  PHE  59           HE1      PHE  59   5.406  -1.481  -1.291
  472    HZ   PHE  59           HZ       PHE  59   7.354  -0.149  -2.047
  473    OH   TYR  60           OH       TYR  60   4.765   3.525   9.762
  474    H    TYR  60           HN       TYR  60   7.124   0.875   5.209
  475    HA   TYR  60           HA       TYR  60   9.764   2.005   4.505
  476   1HB   TYR  60           HB2      TYR  60   8.906   4.108   5.277
  477   2HB   TYR  60           HB1      TYR  60   7.627   3.332   4.345
  478    HD1  TYR  60           HD2      TYR  60   5.671   2.343   5.455
  479    HD2  TYR  60           HD1      TYR  60   8.737   4.354   7.691
  480    HE1  TYR  60           HE2      TYR  60   4.166   2.451   7.423
  481    HE2  TYR  60           HE1      TYR  60   7.233   4.463   9.658
  482    HH   TYR  60           HH       TYR  60   4.051   4.132   9.554
  483    H    SER  61           HN       SER  61   8.094   0.912   7.423
  484    HA   SER  61           HA       SER  61   9.839   2.044   9.338
  485   1HB   SER  61           HB2      SER  61   8.556  -0.684   9.561
  486   2HB   SER  61           HB1      SER  61   9.041   0.377  10.879
  487    HG   SER  61           HG       SER  61   6.752   0.416  10.257
  488    H    HIS  62           HN       HIS  62  10.250  -0.878   7.366
  489    HA   HIS  62           HA       HIS  62  12.726  -1.537   8.831
  490   1HB   HIS  62           HB2      HIS  62  10.991  -2.915   6.870
  491   2HB   HIS  62           HB1      HIS  62  12.709  -3.292   6.774
  492    HD1  HIS  62           HD1      HIS  62  11.994  -5.711   7.707
  493    HD2  HIS  62           HD2      HIS  62  11.506  -2.539  10.368
  494    HE1  HIS  62           HE1      HIS  62  11.727  -6.739  10.005
  495    H    HIS  63           HN       HIS  63  12.136  -1.397   5.292
  496    HA   HIS  63           HA       HIS  63  14.916  -0.455   5.013
  497   1HB   HIS  63           HB2      HIS  63  14.622  -0.867   2.608
  498   2HB   HIS  63           HB1      HIS  63  14.181  -2.280   3.561
  499    HD1  HIS  63           HD1      HIS  63  12.784   0.300   1.267
  500    HD2  HIS  63           HD2      HIS  63  11.346  -2.839   3.606
  501    HE1  HIS  63           HE1      HIS  63  10.419  -0.150   0.488
  502    H    GLU  64           HN       GLU  64  13.856   1.613   6.144
  503    HA   GLU  64           HA       GLU  64  12.721   3.451   4.114
  504   1HB   GLU  64           HB2      GLU  64  11.674   4.178   5.983
  505   2HB   GLU  64           HB1      GLU  64  12.813   3.343   7.038
  506   1HG   GLU  64           HG2      GLU  64  14.406   5.155   6.869
  507   2HG   GLU  64           HG1      GLU  64  13.438   5.952   5.625
  508    H    LYS  65           HN       LYS  65  15.657   2.970   6.032
  509    HA   LYS  65           HA       LYS  65  17.038   4.898   4.214
  510   1HB   LYS  65           HB2      LYS  65  16.552   5.795   6.581
  511   2HB   LYS  65           HB1      LYS  65  17.732   4.609   7.140
  512   1HG   LYS  65           HG2      LYS  65  19.451   5.586   5.709
  513   2HG   LYS  65           HG1      LYS  65  18.280   6.715   5.029
  514   1HD   LYS  65           HD2      LYS  65  18.857   8.146   6.675
  515   2HD   LYS  65           HD1      LYS  65  18.044   7.052   7.796
  516   1HE   LYS  65           HE2      LYS  65  20.467   5.800   7.433
  517   2HE   LYS  65           HE1      LYS  65  20.922   7.503   7.375
  518   1HZ   LYS  65           HZ3      LYS  65  19.278   6.255   9.510
  519   2HZ   LYS  65           HZ2      LYS  65  20.937   6.597   9.637
  520   3HZ   LYS  65           HZ1      LYS  65  19.816   7.862   9.466
  521    H    ASP  66           HN       ASP  66  16.900   2.035   3.981
  522    HA   ASP  66           HA       ASP  66  19.509   1.072   4.996
  523   1HB   ASP  66           HB2      ASP  66  17.195  -0.260   3.577
  524   2HB   ASP  66           HB1      ASP  66  18.732  -1.085   3.848
  525    H    THR  67           HN       THR  67  20.760  -0.303   3.261
  526    HA   THR  67           HA       THR  67  21.272   1.526   1.001
  527    HB   THR  67           HB       THR  67  22.846  -0.958   1.170
  528    HG1  THR  67           HG1      THR  67  23.784   0.584   3.092
  529   1HG2  THR  67          HG21      THR  67  23.500   2.001   1.164
  530   2HG2  THR  67          HG23      THR  67  24.697   0.710   1.064
  531   3HG2  THR  67          HG22      THR  67  23.517   0.921  -0.230
  532    NH1  ARG  68           NH2      ARG  68  20.930  -6.759  -0.584
  533    NH2  ARG  68           NH1      ARG  68  22.897  -5.688  -0.860
  534    H    ARG  68           HN       ARG  68  19.818  -1.595   1.605
  535    HA   ARG  68           HA       ARG  68  20.038  -2.808  -0.927
  536   1HB   ARG  68           HB2      ARG  68  18.322  -3.066   1.407
  537   2HB   ARG  68           HB1      ARG  68  17.423  -3.350  -0.085
  538   1HG   ARG  68           HG2      ARG  68  18.287  -5.474   0.329
  539   2HG   ARG  68           HG1      ARG  68  19.524  -4.799  -0.729
  540   1HD   ARG  68           HD2      ARG  68  20.065  -4.052   2.000
  541   2HD   ARG  68           HD1      ARG  68  19.867  -5.799   1.901
  542    HE   ARG  68           HE       ARG  68  22.144  -4.322   1.025
  543   1HH1  ARG  68          HH21      ARG  68  20.072  -6.893  -0.092
  544   2HH1  ARG  68          HH22      ARG  68  21.170  -7.371  -1.337
  545   1HH2  ARG  68          HH11      ARG  68  23.550  -4.985  -0.581
  546   2HH2  ARG  68          HH12      ARG  68  23.123  -6.313  -1.608
  547    H    CYS  69           HN       CYS  69  17.354  -0.702   0.197
  548    HA   CYS  69           HA       CYS  69  16.216  -0.505  -2.454
  549   1HB   CYS  69           HB2      CYS  69  15.559   0.399   0.204
  550   2HB   CYS  69           HB1      CYS  69  15.392   1.735  -0.937
  551    H    LEU  70           HN       LEU  70  18.775   1.203  -0.812
  552    HA   LEU  70           HA       LEU  70  18.610   3.561  -2.529
  553   1HB   LEU  70           HB2      LEU  70  20.721   2.578  -0.592
  554   2HB   LEU  70           HB1      LEU  70  20.856   4.088  -1.492
  555    HG   LEU  70           HG       LEU  70  18.562   3.373   0.357
  556   1HD1  LEU  70          HD13      LEU  70  21.137   4.139   1.059
  557   2HD1  LEU  70          HD12      LEU  70  20.253   5.665   1.040
  558   3HD1  LEU  70          HD11      LEU  70  19.699   4.337   2.061
  559   1HD2  LEU  70          HD23      LEU  70  19.249   5.777  -1.336
  560   2HD2  LEU  70          HD22      LEU  70  17.731   4.884  -1.268
  561   3HD2  LEU  70          HD21      LEU  70  18.203   5.925   0.075
  562    H    GLY  71           HN       GLY  71  21.827   2.183  -2.281
  563   1HA   GLY  71           HA2      GLY  71  23.076   0.978  -3.919
  564   2HA   GLY  71           HA1      GLY  71  21.661   0.988  -4.972
  565    H    ALA  72           HN       ALA  72  21.677   4.074  -4.093
  566    HA   ALA  72           HA       ALA  72  23.924   5.271  -5.358
  567   1HB   ALA  72           HB2      ALA  72  21.436   4.885  -7.060
  568   2HB   ALA  72           HB1      ALA  72  22.691   6.071  -7.423
  569   3HB   ALA  72           HB3      ALA  72  23.073   4.349  -7.438
  570    H    THR  73           HN       THR  73  23.543   6.479  -3.413
  571    HA   THR  73           HA       THR  73  21.030   7.805  -2.907
  572    HB   THR  73           HB       THR  73  22.467   9.100  -1.218
  573    HG1  THR  73           HG1      THR  73  24.495   8.905  -1.831
  574   1HG2  THR  73          HG22      THR  73  21.534   6.382  -1.316
  575   2HG2  THR  73          HG21      THR  73  23.001   6.462  -0.341
  576   3HG2  THR  73          HG23      THR  73  21.614   7.471   0.069
  577    H    ALA  74           HN       ALA  74  22.882   8.531  -5.463
  578    HA   ALA  74           HA       ALA  74  23.203  11.390  -5.065
  579   1HB   ALA  74           HB3      ALA  74  23.335   9.588  -7.495
  580   2HB   ALA  74           HB2      ALA  74  23.503  11.340  -7.616
  581   3HB   ALA  74           HB1      ALA  74  24.668  10.406  -6.679
  582    H    GLN  75           HN       GLN  75  21.245   9.729  -7.548
  583    HA   GLN  75           HA       GLN  75  19.240  11.895  -7.336
  584   1HB   GLN  75           HB2      GLN  75  20.252  10.465  -9.480
  585   2HB   GLN  75           HB1      GLN  75  18.672   9.727  -9.223
  586   1HG   GLN  75           HG2      GLN  75  17.526  11.688  -9.679
  587   2HG   GLN  75           HG1      GLN  75  18.867  12.713  -9.169
  588   1HE2  GLN  75          HE22      GLN  75  20.644  12.012 -12.355
  589   2HE2  GLN  75          HE21      GLN  75  20.992  11.858 -10.701
  590    H    GLN  76           HN       GLN  76  19.466   8.368  -6.906
  591    HA   GLN  76           HA       GLN  76  16.685   7.906  -6.434
  592   1HB   GLN  76           HB2      GLN  76  18.952   6.362  -5.153
  593   2HB   GLN  76           HB1      GLN  76  17.323   5.788  -5.490
  594   1HG   GLN  76           HG2      GLN  76  18.763   6.808  -7.858
  595   2HG   GLN  76           HG1      GLN  76  19.471   5.367  -7.130
  596   1HE2  GLN  76          HE22      GLN  76  16.746   3.255  -8.015
  597   2HE2  GLN  76          HE21      GLN  76  18.128   3.409  -7.040
  598    H    PHE  77           HN       PHE  77  19.250   9.069  -4.327
  599    HA   PHE  77           HA       PHE  77  18.007   8.597  -1.822
  600   1HB   PHE  77           HB2      PHE  77  20.296   9.375  -1.898
  601   2HB   PHE  77           HB1      PHE  77  19.813  10.859  -2.722
  602    HD1  PHE  77           HD1      PHE  77  18.857   8.930   0.357
  603    HD2  PHE  77           HD2      PHE  77  19.629  12.768  -1.411
  604    HE1  PHE  77           HE1      PHE  77  18.440  10.021   2.544
  605    HE2  PHE  77           HE2      PHE  77  19.214  13.859   0.776
  606    HZ   PHE  77           HZ       PHE  77  18.619  12.486   2.754
  607    H    HIS  78           HN       HIS  78  17.787  11.466  -3.951
  608    HA   HIS  78           HA       HIS  78  15.965  12.912  -2.291
  609   1HB   HIS  78           HB2      HIS  78  17.255  13.909  -4.185
  610   2HB   HIS  78           HB1      HIS  78  16.217  13.035  -5.310
  611    HD1  HIS  78           HD1      HIS  78  14.403  14.158  -2.343
  612    HD2  HIS  78           HD2      HIS  78  15.362  15.782  -6.060
  613    HE1  HIS  78           HE1      HIS  78  12.865  16.143  -2.675
  614    NH1  ARG  79           NH2      ARG  79   9.760  10.834  -9.447
  615    NH2  ARG  79           NH1      ARG  79   9.113  12.296  -7.851
  616    H    ARG  79           HN       ARG  79  15.397  10.759  -5.071
  617    HA   ARG  79           HA       ARG  79  12.529  10.979  -4.967
  618   1HB   ARG  79           HB2      ARG  79  14.423   8.965  -6.176
  619   2HB   ARG  79           HB1      ARG  79  12.673   8.764  -6.273
  620   1HG   ARG  79           HG2      ARG  79  13.467  11.476  -6.966
  621   2HG   ARG  79           HG1      ARG  79  14.264  10.289  -7.998
  622   1HD   ARG  79           HD2      ARG  79  12.302  10.437  -9.174
  623   2HD   ARG  79           HD1      ARG  79  11.769   9.255  -7.980
  624    HE   ARG  79           HE       ARG  79  11.244  11.704  -6.786
  625   1HH1  ARG  79          HH21      ARG  79  10.420  10.182  -9.818
  626   2HH1  ARG  79          HH22      ARG  79   8.913  11.019  -9.945
  627   1HH2  ARG  79          HH11      ARG  79   9.280  12.769  -6.986
  628   2HH2  ARG  79          HH12      ARG  79   8.271  12.471  -8.363
  629    H    HIS  80           HN       HIS  80  14.736   9.368  -2.891
  630    HA   HIS  80           HA       HIS  80  12.838   7.265  -2.106
  631   1HB   HIS  80           HB2      HIS  80  15.341   6.928  -2.156
  632   2HB   HIS  80           HB1      HIS  80  15.457   8.041  -0.795
  633    HD1  HIS  80           HD1      HIS  80  12.614   5.589  -1.087
  634    HD2  HIS  80           HD2      HIS  80  16.165   6.010   1.055
  635    HE1  HIS  80           HE1      HIS  80  12.572   3.823   0.724
  636    H    LYS  81           HN       LYS  81  13.970  10.396  -0.937
  637    HA   LYS  81           HA       LYS  81  12.970  10.264   1.716
  638   1HB   LYS  81           HB2      LYS  81  13.610  12.446  -0.208
  639   2HB   LYS  81           HB1      LYS  81  12.595  12.870   1.171
  640   1HG   LYS  81           HG2      LYS  81  14.546  11.338   2.358
  641   2HG   LYS  81           HG1      LYS  81  15.455  12.167   1.094
  642   1HD   LYS  81           HD2      LYS  81  13.822  14.162   2.140
  643   2HD   LYS  81           HD1      LYS  81  14.312  13.240   3.561
  644   1HE   LYS  81           HE2      LYS  81  16.606  13.616   3.166
  645   2HE   LYS  81           HE1      LYS  81  16.335  14.057   1.481
  646   1HZ   LYS  81           HZ1      LYS  81  14.833  15.838   2.905
  647   2HZ   LYS  81           HZ3      LYS  81  16.256  15.695   3.818
  648   3HZ   LYS  81           HZ2      LYS  81  16.339  16.148   2.183
  649    H    GLN  82           HN       GLN  82  11.353  11.238  -1.299
  650    HA   GLN  82           HA       GLN  82   8.828  11.816   0.015
  651   1HB   GLN  82           HB2      GLN  82   9.320  11.194  -2.911
  652   2HB   GLN  82           HB1      GLN  82   7.938  12.052  -2.228
  653   1HG   GLN  82           HG2      GLN  82   9.857  13.612  -1.232
  654   2HG   GLN  82           HG1      GLN  82  10.748  12.995  -2.624
  655   1HE2  GLN  82          HE22      GLN  82   8.816  16.049  -3.665
  656   2HE2  GLN  82          HE21      GLN  82   9.982  15.748  -2.469
  657    H    LEU  83           HN       LEU  83  10.367   8.910  -1.099
  658    HA   LEU  83           HA       LEU  83   7.994   7.350  -1.579
  659   1HB   LEU  83           HB2      LEU  83  10.368   6.789  -2.306
  660   2HB   LEU  83           HB1      LEU  83  10.678   6.313  -0.636
  661    HG   LEU  83           HG       LEU  83   8.251   5.182  -1.951
  662   1HD1  LEU  83          HD13      LEU  83  11.101   4.386  -2.597
  663   2HD1  LEU  83          HD12      LEU  83   9.721   3.319  -2.858
  664   3HD1  LEU  83          HD11      LEU  83   9.832   4.848  -3.732
  665   1HD2  LEU  83          HD21      LEU  83  10.261   4.446   0.149
  666   2HD2  LEU  83          HD23      LEU  83   8.500   4.390   0.218
  667   3HD2  LEU  83          HD22      LEU  83   9.386   3.150  -0.669
  668    H    ILE  84           HN       ILE  84  10.150   7.610   1.268
  669    HA   ILE  84           HA       ILE  84   8.664   5.830   2.927
  670    HB   ILE  84           HB       ILE  84  10.281   8.227   3.835
  671   1HG1  ILE  84          HG12      ILE  84  11.692   6.976   2.347
  672   2HG1  ILE  84          HG11      ILE  84  12.137   6.483   3.980
  673   1HG2  ILE  84          HG21      ILE  84   8.796   6.269   5.235
  674   2HG2  ILE  84          HG23      ILE  84  10.494   5.831   5.429
  675   3HG2  ILE  84          HG22      ILE  84   9.937   7.433   5.912
  676   1HD1  ILE  84          HD13      ILE  84  10.589   4.525   3.755
  677   2HD1  ILE  84          HD12      ILE  84  10.317   4.985   2.074
  678   3HD1  ILE  84          HD11      ILE  84  11.925   4.492   2.605
  679    NH1  ARG  85           NH2      ARG  85   9.159  15.772   2.820
  680    NH2  ARG  85           NH1      ARG  85   7.041  16.505   2.536
  681    H    ARG  85           HN       ARG  85   8.480   9.388   2.617
  682    HA   ARG  85           HA       ARG  85   6.524   9.845   4.604
  683   1HB   ARG  85           HB2      ARG  85   7.433  11.257   2.152
  684   2HB   ARG  85           HB1      ARG  85   5.856  11.728   2.789
  685   1HG   ARG  85           HG2      ARG  85   6.743  12.518   4.784
  686   2HG   ARG  85           HG1      ARG  85   8.153  11.460   4.695
  687   1HD   ARG  85           HD2      ARG  85   9.052  13.571   4.182
  688   2HD   ARG  85           HD1      ARG  85   8.783  12.859   2.592
  689    HE   ARG  85           HE       ARG  85   6.422  14.210   3.138
  690   1HH1  ARG  85          HH21      ARG  85   9.809  15.048   3.043
  691   2HH1  ARG  85          HH22      ARG  85   9.495  16.684   2.581
  692   1HH2  ARG  85          HH11      ARG  85   6.054  16.339   2.542
  693   2HH2  ARG  85          HH12      ARG  85   7.394  17.412   2.303
  694    H    PHE  86           HN       PHE  86   5.996   9.309   1.115
  695    HA   PHE  86           HA       PHE  86   3.192   9.373   1.101
  696   1HB   PHE  86           HB2      PHE  86   5.294   8.332  -0.632
  697   2HB   PHE  86           HB1      PHE  86   3.836   7.342  -0.698
  698    HD1  PHE  86           HD1      PHE  86   4.629  11.008  -0.430
  699    HD2  PHE  86           HD2      PHE  86   2.341   7.935  -2.372
  700    HE1  PHE  86           HE1      PHE  86   3.523  12.722  -1.840
  701    HE2  PHE  86           HE2      PHE  86   1.236   9.649  -3.783
  702    HZ   PHE  86           HZ       PHE  86   1.827  12.042  -3.517
  703    H    LEU  87           HN       LEU  87   5.334   6.675   1.976
  704    HA   LEU  87           HA       LEU  87   3.226   4.720   2.196
  705   1HB   LEU  87           HB2      LEU  87   6.057   4.923   3.162
  706   2HB   LEU  87           HB1      LEU  87   5.018   3.657   3.817
  707    HG   LEU  87           HG       LEU  87   5.136   4.075   0.846
  708   1HD1  LEU  87          HD13      LEU  87   7.488   3.925   1.848
  709   2HD1  LEU  87          HD12      LEU  87   7.055   2.295   2.356
  710   3HD1  LEU  87          HD11      LEU  87   7.081   2.706   0.641
  711   1HD2  LEU  87          HD22      LEU  87   3.654   2.428   2.395
  712   2HD2  LEU  87          HD21      LEU  87   4.188   1.979   0.776
  713   3HD2  LEU  87          HD23      LEU  87   5.083   1.415   2.187
  714    H    LYS  88           HN       LYS  88   4.631   7.036   4.476
  715    HA   LYS  88           HA       LYS  88   3.369   5.965   6.822
  716   1HB   LYS  88           HB2      LYS  88   4.272   8.800   6.232
  717   2HB   LYS  88           HB1      LYS  88   3.879   8.164   7.830
  718   1HG   LYS  88           HG2      LYS  88   5.643   6.307   7.196
  719   2HG   LYS  88           HG1      LYS  88   6.222   7.532   6.068
  720   1HD   LYS  88           HD2      LYS  88   5.715   8.766   8.616
  721   2HD   LYS  88           HD1      LYS  88   6.755   7.360   8.849
  722   1HE   LYS  88           HE2      LYS  88   8.441   8.211   7.473
  723   2HE   LYS  88           HE1      LYS  88   7.334   9.280   6.611
  724   1HZ   LYS  88           HZ1      LYS  88   7.076  10.297   9.003
  725   2HZ   LYS  88           HZ3      LYS  88   8.628   9.644   9.207
  726   3HZ   LYS  88           HZ2      LYS  88   8.340  10.773   7.971
  727    NH1  ARG  89           NH2      ARG  89   0.065  14.175   2.333
  728    NH2  ARG  89           NH1      ARG  89   0.858  13.523   0.321
  729    H    ARG  89           HN       ARG  89   2.265   8.125   4.283
  730    HA   ARG  89           HA       ARG  89  -0.089   9.008   5.773
  731   1HB   ARG  89           HB2      ARG  89   0.216   9.134   2.776
  732   2HB   ARG  89           HB1      ARG  89  -0.650  10.242   3.841
  733   1HG   ARG  89           HG2      ARG  89   1.885  10.394   4.860
  734   2HG   ARG  89           HG1      ARG  89   2.215  10.161   3.143
  735   1HD   ARG  89           HD2      ARG  89   0.096  12.127   3.901
  736   2HD   ARG  89           HD1      ARG  89   1.780  12.593   4.144
  737    HE   ARG  89           HE       ARG  89   1.735  11.597   1.561
  738   1HH1  ARG  89          HH21      ARG  89  -0.049  14.031   3.315
  739   2HH1  ARG  89          HH22      ARG  89  -0.326  14.990   1.905
  740   1HH2  ARG  89          HH11      ARG  89   1.359  12.869  -0.246
  741   2HH2  ARG  89          HH12      ARG  89   0.459  14.342  -0.093
  742    H    LEU  90           HN       LEU  90   0.598   6.611   3.255
  743    HA   LEU  90           HA       LEU  90  -2.172   5.815   2.942
  744   1HB   LEU  90           HB2      LEU  90   0.473   4.924   1.940
  745   2HB   LEU  90           HB1      LEU  90  -0.785   3.692   1.993
  746    HG   LEU  90           HG       LEU  90  -0.629   5.076  -0.165
  747   1HD1  LEU  90          HD12      LEU  90  -3.220   5.001   1.415
  748   2HD1  LEU  90          HD11      LEU  90  -3.112   5.265  -0.325
  749   3HD1  LEU  90          HD13      LEU  90  -2.599   3.726   0.366
  750   1HD2  LEU  90          HD21      LEU  90  -0.375   7.221   1.290
  751   2HD2  LEU  90          HD23      LEU  90  -1.384   7.305  -0.153
  752   3HD2  LEU  90          HD22      LEU  90  -2.131   7.143   1.435
  753    H    ASP  91           HN       ASP  91   0.266   5.065   5.281
  754    HA   ASP  91           HA       ASP  91  -0.581   2.418   5.981
  755   1HB   ASP  91           HB2      ASP  91   1.541   3.155   6.795
  756   2HB   ASP  91           HB1      ASP  91   0.836   4.595   7.531
  757    NH1  ARG  92           NH2      ARG  92  -4.837   5.879  13.787
  758    NH2  ARG  92           NH1      ARG  92  -3.832   7.775  14.492
  759    H    ARG  92           HN       ARG  92  -1.444   5.604   7.374
  760    HA   ARG  92           HA       ARG  92  -3.510   4.315   9.041
  761   1HB   ARG  92           HB2      ARG  92  -2.443   7.123   8.797
  762   2HB   ARG  92           HB1      ARG  92  -3.903   6.775   9.723
  763   1HG   ARG  92           HG2      ARG  92  -1.560   5.022  10.243
  764   2HG   ARG  92           HG1      ARG  92  -1.438   6.688  10.813
  765   1HD   ARG  92           HD2      ARG  92  -4.039   5.423  11.365
  766   2HD   ARG  92           HD1      ARG  92  -2.679   4.658  12.189
  767    HE   ARG  92           HE       ARG  92  -2.295   7.370  12.625
  768   1HH1  ARG  92          HH21      ARG  92  -4.898   5.106  13.158
  769   2HH1  ARG  92          HH22      ARG  92  -5.504   5.970  14.526
  770   1HH2  ARG  92          HH11      ARG  92  -3.113   8.464  14.399
  771   2HH2  ARG  92          HH12      ARG  92  -4.507   7.852  15.225
  772    H    ASN  93           HN       ASN  93  -3.328   6.033   6.012
  773    HA   ASN  93           HA       ASN  93  -6.124   6.851   6.049
  774   1HB   ASN  93           HB2      ASN  93  -3.945   6.832   3.972
  775   2HB   ASN  93           HB1      ASN  93  -5.614   7.192   3.521
  776   1HD2  ASN  93          HD22      ASN  93  -5.252  10.526   4.558
  777   2HD2  ASN  93          HD21      ASN  93  -5.916   9.418   3.458
  778    H    LEU  94           HN       LEU  94  -4.361   4.026   4.953
  779    HA   LEU  94           HA       LEU  94  -6.543   3.038   3.302
  780   1HB   LEU  94           HB2      LEU  94  -3.968   1.865   4.325
  781   2HB   LEU  94           HB1      LEU  94  -5.161   0.852   3.514
  782    HG   LEU  94           HG       LEU  94  -4.106   3.422   2.321
  783   1HD1  LEU  94          HD12      LEU  94  -2.794   0.869   2.622
  784   2HD1  LEU  94          HD11      LEU  94  -3.122   1.170   0.916
  785   3HD1  LEU  94          HD13      LEU  94  -2.191   2.335   1.854
  786   1HD2  LEU  94          HD22      LEU  94  -6.307   1.890   1.682
  787   2HD2  LEU  94          HD21      LEU  94  -5.457   2.950   0.557
  788   3HD2  LEU  94          HD23      LEU  94  -5.071   1.230   0.612
  789    CH2  TRP  95           CH2      TRP  95  -7.086  -1.262  13.208
  790    H    TRP  95           HN       TRP  95  -5.188   1.838   6.413
  791    HA   TRP  95           HA       TRP  95  -7.658   0.268   6.789
  792   1HB   TRP  95           HB2      TRP  95  -6.335  -1.112   7.940
  793   2HB   TRP  95           HB1      TRP  95  -4.973  -0.077   7.530
  794    HD1  TRP  95           HD1      TRP  95  -4.579   2.026   9.284
  795    HE1  TRP  95           HE1      TRP  95  -4.777   2.030  11.859
  796    HE3  TRP  95           HE3      TRP  95  -7.437  -2.137   9.931
  797    HZ2  TRP  95           HZ2      TRP  95  -5.989   0.450  13.920
  798    HZ3  TRP  95           HZ3      TRP  95  -8.091  -2.876  12.197
  799    HH2  TRP  95           HH2      TRP  95  -7.376  -1.591  14.195
  800    H    GLY  96           HN       GLY  96  -6.226   3.208   8.003
  801   1HA   GLY  96           HA2      GLY  96  -7.585   3.481  10.467
  802   2HA   GLY  96           HA1      GLY  96  -7.157   4.843   9.432
  803    H    LEU  97           HN       LEU  97  -8.753   3.822   7.172
  804    HA   LEU  97           HA       LEU  97 -11.360   4.876   8.045
  805   1HB   LEU  97           HB2      LEU  97 -10.436   5.639   5.908
  806   2HB   LEU  97           HB1      LEU  97 -10.342   3.977   5.330
  807    HG   LEU  97           HG       LEU  97 -13.007   4.411   6.242
  808   1HD1  LEU  97          HD11      LEU  97 -12.523   6.828   5.967
  809   2HD1  LEU  97          HD13      LEU  97 -12.012   6.528   4.307
  810   3HD1  LEU  97          HD12      LEU  97 -13.692   6.265   4.773
  811   1HD2  LEU  97          HD22      LEU  97 -11.620   3.955   3.603
  812   2HD2  LEU  97          HD21      LEU  97 -12.628   2.841   4.525
  813   3HD2  LEU  97          HD23      LEU  97 -13.367   4.191   3.665
  814    H    ALA  98           HN       ALA  98  -9.889   1.813   7.172
  815    HA   ALA  98           HA       ALA  98 -12.154   0.248   6.606
  816   1HB   ALA  98           HB3      ALA  98  -9.567  -0.415   8.028
  817   2HB   ALA  98           HB2      ALA  98 -10.783  -1.638   7.657
  818   3HB   ALA  98           HB1      ALA  98  -9.998  -0.751   6.351
  819    H    GLY  99           HN       GLY  99 -10.582   0.577   9.801
  820   1HA   GLY  99           HA2      GLY  99 -11.693   0.888  11.895
  821   2HA   GLY  99           HA1      GLY  99 -13.240   0.645  11.083
  822    H    LEU 100           HN       LEU 100 -10.365  -1.061  12.273
  823    HA   LEU 100           HA       LEU 100 -12.055  -3.327  13.063
  824   1HB   LEU 100           HB2      LEU 100 -10.850  -3.413  10.538
  825   2HB   LEU 100           HB1      LEU 100  -9.775  -4.360  11.565
  826    HG   LEU 100           HG       LEU 100 -12.528  -5.005  12.172
  827   1HD1  LEU 100          HD11      LEU 100 -11.707  -4.934   9.282
  828   2HD1  LEU 100          HD13      LEU 100 -12.778  -6.215   9.854
  829   3HD1  LEU 100          HD12      LEU 100 -13.263  -4.526  10.007
  830   1HD2  LEU 100          HD23      LEU 100 -10.026  -6.396  11.272
  831   2HD2  LEU 100          HD22      LEU 100 -10.970  -6.637  12.742
  832   3HD2  LEU 100          HD21      LEU 100 -11.554  -7.273  11.206
  833    H    ASN 101           HN       ASN 101  -9.873  -5.157  13.441
  834    HA   ASN 101           HA       ASN 101  -8.317  -3.678  15.517
  835   1HB   ASN 101           HB2      ASN 101  -8.334  -5.633  16.851
  836   2HB   ASN 101           HB1      ASN 101  -9.966  -5.564  16.185
  837   1HD2  ASN 101          HD22      ASN 101  -7.759  -8.800  15.440
  838   2HD2  ASN 101          HD21      ASN 101  -7.419  -7.680  16.670
  839    H    SER 102           HN       SER 102  -6.437  -5.773  15.975
  840    HA   SER 102           HA       SER 102  -4.420  -5.189  14.090
  841   1HB   SER 102           HB2      SER 102  -3.530  -6.142  15.997
  842   2HB   SER 102           HB1      SER 102  -4.842  -7.307  16.152
  843    HG   SER 102           HG       SER 102  -2.964  -8.354  15.481
  844    H    CYS 103           HN       CYS 103  -3.357  -6.931  12.639
  845    HA   CYS 103           HA       CYS 103  -5.303  -8.805  11.433
  846   1HB   CYS 103           HB2      CYS 103  -4.082  -6.440  10.003
  847   2HB   CYS 103           HB1      CYS 103  -4.662  -7.860   9.131
  848    HA   PRO 104           HA       PRO 104  -0.970 -10.385  11.881
  849   1HB   PRO 104           HB2      PRO 104  -2.216 -12.977  12.144
  850   2HB   PRO 104           HB1      PRO 104  -1.320 -12.064  13.366
  851   1HG   PRO 104           HG2      PRO 104  -4.164 -12.503  13.243
  852   2HG   PRO 104           HG1      PRO 104  -3.266 -11.566  14.445
  853   1HD   PRO 104           HD2      PRO 104  -4.985 -10.566  12.366
  854   2HD   PRO 104           HD1      PRO 104  -4.059  -9.628  13.554
  855    H    VAL 105           HN       VAL 105  -0.682  -9.957   9.592
  856    HA   VAL 105           HA       VAL 105  -1.969 -11.473   7.523
  857    HB   VAL 105           HB       VAL 105   0.778 -10.201   7.392
  858   1HG1  VAL 105          HG11      VAL 105  -0.458 -11.722   5.530
  859   2HG1  VAL 105          HG13      VAL 105  -1.164 -10.151   5.143
  860   3HG1  VAL 105          HG12      VAL 105   0.587 -10.364   5.115
  861   1HG2  VAL 105          HG21      VAL 105  -1.892  -9.028   7.736
  862   2HG2  VAL 105          HG23      VAL 105  -0.306  -8.279   7.920
  863   3HG2  VAL 105          HG22      VAL 105  -1.039  -8.409   6.321
  864    H    LYS 106           HN       LYS 106  -1.631 -13.572   6.951
  865    HA   LYS 106           HA       LYS 106   0.982 -14.782   6.912
  866   1HB   LYS 106           HB2      LYS 106   0.206 -14.706   9.433
  867   2HB   LYS 106           HB1      LYS 106  -0.783 -16.087   8.957
  868   1HG   LYS 106           HG2      LYS 106   1.320 -17.123   7.985
  869   2HG   LYS 106           HG1      LYS 106   2.229 -15.829   8.768
  870   1HD   LYS 106           HD2      LYS 106   1.233 -16.508  10.956
  871   2HD   LYS 106           HD1      LYS 106   0.448 -17.863  10.142
  872   1HE   LYS 106           HE2      LYS 106   2.470 -18.959   9.724
  873   2HE   LYS 106           HE1      LYS 106   3.414 -17.475   9.855
  874   1HZ   LYS 106           HZ1      LYS 106   2.522 -17.516  12.281
  875   2HZ   LYS 106           HZ3      LYS 106   2.315 -19.174  11.984
  876   3HZ   LYS 106           HZ2      LYS 106   3.858 -18.473  11.850
  877    H    GLU 107           HN       GLU 107   0.449 -15.570   4.883
  878    HA   GLU 107           HA       GLU 107  -1.081 -18.002   4.736
  879   1HB   GLU 107           HB2      GLU 107  -2.951 -16.325   4.801
  880   2HB   GLU 107           HB1      GLU 107  -2.298 -15.613   3.325
  881   1HG   GLU 107           HG2      GLU 107  -3.965 -17.118   2.564
  882   2HG   GLU 107           HG1      GLU 107  -2.445 -17.982   2.324
  883    H    ALA 108           HN       ALA 108  -0.344 -15.283   2.525
  884    HA   ALA 108           HA       ALA 108   0.591 -17.169   0.521
  885   1HB   ALA 108           HB2      ALA 108  -0.329 -14.737   0.196
  886   2HB   ALA 108           HB1      ALA 108   1.338 -14.258   0.517
  887   3HB   ALA 108           HB3      ALA 108   0.970 -15.312  -0.848
  888    H    ASP 109           HN       ASP 109   2.878 -17.004  -0.276
  889    HA   ASP 109           HA       ASP 109   4.710 -17.038   2.052
  890   1HB   ASP 109           HB2      ASP 109   4.379 -18.762  -0.140
  891   2HB   ASP 109           HB1      ASP 109   5.882 -17.898  -0.466
  892    H    GLN 110           HN       GLN 110   7.098 -16.479   1.087
  893    HA   GLN 110           HA       GLN 110   7.320 -13.711   0.895
  894   1HB   GLN 110           HB2      GLN 110   9.024 -16.025   0.429
  895   2HB   GLN 110           HB1      GLN 110   9.426 -14.705  -0.667
  896   1HG   GLN 110           HG2      GLN 110  10.637 -13.887   1.063
  897   2HG   GLN 110           HG1      GLN 110   9.082 -13.381   1.723
  898   1HE2  GLN 110          HE22      GLN 110   9.919 -15.322   4.571
  899   2HE2  GLN 110          HE21      GLN 110   9.631 -13.764   3.961
  900    H    SER 111           HN       SER 111   5.951 -12.623  -0.593
  901    HA   SER 111           HA       SER 111   6.226 -13.459  -3.452
  902   1HB   SER 111           HB2      SER 111   3.948 -12.815  -1.893
  903   2HB   SER 111           HB1      SER 111   4.171 -11.483  -3.020
  904    HG   SER 111           HG       SER 111   3.722 -12.778  -4.633
  905    H    THR 112           HN       THR 112   7.381 -12.100  -4.734
  906    HA   THR 112           HA       THR 112   8.832  -9.919  -3.781
  907    HB   THR 112           HB       THR 112   9.289  -9.345  -6.069
  908    HG1  THR 112           HG1      THR 112   7.324  -9.268  -7.008
  909   1HG2  THR 112          HG23      THR 112   9.909 -11.677  -5.042
  910   2HG2  THR 112          HG22      THR 112   8.763 -12.294  -6.232
  911   3HG2  THR 112          HG21      THR 112  10.178 -11.383  -6.760
  912    H    LEU 113           HN       LEU 113   8.485  -7.770  -3.540
  913    HA   LEU 113           HA       LEU 113   5.885  -6.809  -3.032
  914   1HB   LEU 113           HB2      LEU 113   7.818  -5.775  -2.031
  915   2HB   LEU 113           HB1      LEU 113   8.458  -5.330  -3.610
  916    HG   LEU 113           HG       LEU 113   6.640  -3.779  -3.981
  917   1HD1  LEU 113          HD11      LEU 113   4.858  -5.121  -2.878
  918   2HD1  LEU 113          HD13      LEU 113   5.554  -4.720  -1.309
  919   3HD1  LEU 113          HD12      LEU 113   4.864  -3.451  -2.317
  920   1HD2  LEU 113          HD21      LEU 113   8.616  -3.418  -2.151
  921   2HD2  LEU 113          HD23      LEU 113   7.457  -2.162  -2.582
  922   3HD2  LEU 113          HD22      LEU 113   7.202  -3.143  -1.138
  923    H    GLU 114           HN       GLU 114   7.464  -7.115  -6.100
  924    HA   GLU 114           HA       GLU 114   6.174  -4.940  -7.451
  925   1HB   GLU 114           HB2      GLU 114   7.607  -7.415  -8.238
  926   2HB   GLU 114           HB1      GLU 114   6.486  -6.761  -9.434
  927   1HG   GLU 114           HG2      GLU 114   7.624  -4.476  -8.910
  928   2HG   GLU 114           HG1      GLU 114   8.919  -5.461  -8.227
  929    H    ASN 115           HN       ASN 115   5.213  -8.311  -6.889
  930    HA   ASN 115           HA       ASN 115   2.784  -8.089  -8.467
  931   1HB   ASN 115           HB2      ASN 115   3.840 -10.264  -8.127
  932   2HB   ASN 115           HB1      ASN 115   3.626 -10.121  -6.382
  933   1HD2  ASN 115          HD22      ASN 115   0.157 -10.499  -8.571
  934   2HD2  ASN 115          HD21      ASN 115   1.398  -9.503  -9.160
  935    H    PHE 116           HN       PHE 116   3.557  -7.635  -5.037
  936    HA   PHE 116           HA       PHE 116   0.810  -7.612  -4.151
  937   1HB   PHE 116           HB2      PHE 116   2.417  -7.921  -2.440
  938   2HB   PHE 116           HB1      PHE 116   3.376  -6.540  -2.979
  939    HD1  PHE 116           HD1      PHE 116   0.088  -7.493  -1.496
  940    HD2  PHE 116           HD2      PHE 116   2.939  -4.354  -2.168
  941    HE1  PHE 116           HE1      PHE 116  -1.192  -6.002   0.018
  942    HE2  PHE 116           HE2      PHE 116   1.664  -2.867  -0.651
  943    HZ   PHE 116           HZ       PHE 116  -0.404  -3.692   0.444
  944    H    LEU 117           HN       LEU 117   3.095  -4.887  -4.581
  945    HA   LEU 117           HA       LEU 117   1.217  -2.812  -4.281
  946   1HB   LEU 117           HB2      LEU 117   3.925  -3.084  -5.265
  947   2HB   LEU 117           HB1      LEU 117   3.022  -1.944  -6.266
  948    HG   LEU 117           HG       LEU 117   3.018  -1.833  -3.241
  949   1HD1  LEU 117          HD12      LEU 117   5.250  -1.399  -4.770
  950   2HD1  LEU 117          HD11      LEU 117   4.528   0.210  -4.745
  951   3HD1  LEU 117          HD13      LEU 117   4.930  -0.600  -3.230
  952   1HD2  LEU 117          HD21      LEU 117   1.242  -0.724  -4.865
  953   2HD2  LEU 117          HD23      LEU 117   1.877   0.179  -3.489
  954   3HD2  LEU 117          HD22      LEU 117   2.523   0.464  -5.105
  955    H    GLU 118           HN       GLU 118   1.977  -4.773  -7.138
  956    HA   GLU 118           HA       GLU 118   0.509  -3.231  -9.035
  957   1HB   GLU 118           HB2      GLU 118   1.607  -4.826 -10.223
  958   2HB   GLU 118           HB1      GLU 118   1.612  -5.956  -8.869
  959   1HG   GLU 118           HG2      GLU 118  -0.627  -6.673  -9.348
  960   2HG   GLU 118           HG1      GLU 118  -0.864  -5.364 -10.508
  961    NH1  ARG 119           NH2      ARG 119  -5.455  -8.972 -10.113
  962    NH2  ARG 119           NH1      ARG 119  -4.194  -7.688 -11.477
  963    H    ARG 119           HN       ARG 119  -0.512  -6.042  -7.087
  964    HA   ARG 119           HA       ARG 119  -3.251  -6.013  -7.927
  965   1HB   ARG 119           HB2      ARG 119  -1.807  -7.116  -5.518
  966   2HB   ARG 119           HB1      ARG 119  -3.564  -7.218  -5.643
  967   1HG   ARG 119           HG2      ARG 119  -1.669  -8.203  -7.792
  968   2HG   ARG 119           HG1      ARG 119  -2.353  -9.240  -6.540
  969   1HD   ARG 119           HD2      ARG 119  -4.046  -9.551  -8.028
  970   2HD   ARG 119           HD1      ARG 119  -4.595  -7.971  -7.467
  971    HE   ARG 119           HE       ARG 119  -2.797  -7.369  -9.486
  972   1HH1  ARG 119          HH21      ARG 119  -5.639  -9.377  -9.220
  973   2HH1  ARG 119          HH22      ARG 119  -6.075  -9.154 -10.877
  974   1HH2  ARG 119          HH11      ARG 119  -3.399  -7.101 -11.629
  975   2HH2  ARG 119          HH12      ARG 119  -4.825  -7.881 -12.229
  976    H    LEU 120           HN       LEU 120  -1.520  -3.893  -5.804
  977    HA   LEU 120           HA       LEU 120  -3.834  -3.118  -4.212
  978   1HB   LEU 120           HB2      LEU 120  -1.156  -2.783  -3.891
  979   2HB   LEU 120           HB1      LEU 120  -1.596  -1.200  -4.532
  980    HG   LEU 120           HG       LEU 120  -2.704  -2.570  -2.072
  981   1HD1  LEU 120          HD11      LEU 120  -0.822  -0.379  -2.649
  982   2HD1  LEU 120          HD13      LEU 120  -2.054   0.030  -1.455
  983   3HD1  LEU 120          HD12      LEU 120  -0.996  -1.357  -1.192
  984   1HD2  LEU 120          HD21      LEU 120  -3.732  -0.203  -3.650
  985   2HD2  LEU 120          HD23      LEU 120  -4.627  -1.624  -3.110
  986   3HD2  LEU 120          HD22      LEU 120  -4.105  -0.413  -1.939
  987    H    LYS 121           HN       LYS 121  -2.043  -1.621  -6.923
  988    HA   LYS 121           HA       LYS 121  -3.779   0.638  -7.218
  989   1HB   LYS 121           HB2      LYS 121  -1.443   0.147  -8.284
  990   2HB   LYS 121           HB1      LYS 121  -2.377  -0.659  -9.545
  991   1HG   LYS 121           HG2      LYS 121  -3.668   1.396  -9.927
  992   2HG   LYS 121           HG1      LYS 121  -2.769   2.212  -8.649
  993   1HD   LYS 121           HD2      LYS 121  -1.864   2.755 -10.894
  994   2HD   LYS 121           HD1      LYS 121  -0.677   1.910  -9.899
  995   1HE   LYS 121           HE2      LYS 121  -0.606   0.149 -11.313
  996   2HE   LYS 121           HE1      LYS 121  -2.365   0.063 -11.408
  997   1HZ   LYS 121           HZ3      LYS 121  -1.023   2.280 -12.766
  998   2HZ   LYS 121           HZ2      LYS 121  -0.916   0.739 -13.473
  999   3HZ   LYS 121           HZ1      LYS 121  -2.436   1.445 -13.194
 1000    H    THR 122           HN       THR 122  -3.867  -2.624  -8.504
 1001    HA   THR 122           HA       THR 122  -5.973  -2.171 -10.410
 1002    HB   THR 122           HB       THR 122  -6.148  -4.862  -9.587
 1003    HG1  THR 122           HG1      THR 122  -3.565  -4.842 -10.031
 1004   1HG2  THR 122          HG21      THR 122  -6.051  -3.678 -11.894
 1005   2HG2  THR 122          HG23      THR 122  -4.303  -3.856 -11.739
 1006   3HG2  THR 122          HG22      THR 122  -5.337  -5.285 -11.753
 1007    H    ILE 123           HN       ILE 123  -6.048  -3.596  -7.150
 1008    HA   ILE 123           HA       ILE 123  -8.828  -4.014  -6.974
 1009    HB   ILE 123           HB       ILE 123  -6.836  -3.266  -4.820
 1010   1HG1  ILE 123          HG12      ILE 123  -6.595  -5.429  -6.212
 1011   2HG1  ILE 123          HG11      ILE 123  -6.619  -5.601  -4.457
 1012   1HG2  ILE 123          HG23      ILE 123  -9.756  -3.812  -4.749
 1013   2HG2  ILE 123          HG22      ILE 123  -8.782  -4.627  -3.525
 1014   3HG2  ILE 123          HG21      ILE 123  -8.759  -2.868  -3.642
 1015   1HD1  ILE 123          HD13      ILE 123  -9.139  -5.796  -6.109
 1016   2HD1  ILE 123          HD12      ILE 123  -8.124  -7.202  -5.789
 1017   3HD1  ILE 123          HD11      ILE 123  -8.878  -6.337  -4.451
 1018    H    MET 124           HN       MET 124  -6.945  -1.078  -6.352
 1019    HA   MET 124           HA       MET 124  -9.096   0.446  -5.242
 1020   1HB   MET 124           HB2      MET 124  -6.684   1.445  -6.772
 1021   2HB   MET 124           HB1      MET 124  -7.699   2.400  -5.690
 1022   1HG   MET 124           HG2      MET 124  -6.469  -0.126  -4.651
 1023   2HG   MET 124           HG1      MET 124  -5.459   1.309  -4.804
 1024   1HE   MET 124           HE3      MET 124  -5.119   2.773  -3.508
 1025   2HE   MET 124           HE2      MET 124  -6.457   3.894  -3.294
 1026   3HE   MET 124           HE1      MET 124  -5.773   3.067  -1.896
 1027    NH1  ARG 125           NH2      ARG 125  -7.515   3.719 -14.866
 1028    NH2  ARG 125           NH1      ARG 125  -6.403   1.769 -15.107
 1029    H    ARG 125           HN       ARG 125  -7.736   0.546  -8.550
 1030    HA   ARG 125           HA       ARG 125  -9.918   2.177  -9.538
 1031   1HB   ARG 125           HB2      ARG 125  -7.621   0.704 -10.795
 1032   2HB   ARG 125           HB1      ARG 125  -8.893   1.385 -11.808
 1033   1HG   ARG 125           HG2      ARG 125  -8.396   3.478 -10.122
 1034   2HG   ARG 125           HG1      ARG 125  -6.790   2.757 -10.250
 1035   1HD   ARG 125           HD2      ARG 125  -8.552   3.752 -12.500
 1036   2HD   ARG 125           HD1      ARG 125  -6.957   4.343 -12.039
 1037    HE   ARG 125           HE       ARG 125  -6.529   1.674 -12.657
 1038   1HH1  ARG 125          HH21      ARG 125  -7.946   4.413 -14.292
 1039   2HH1  ARG 125          HH22      ARG 125  -7.505   3.835 -15.859
 1040   1HH2  ARG 125          HH11      ARG 125  -5.975   0.958 -14.711
 1041   2HH2  ARG 125          HH12      ARG 125  -6.405   1.900 -16.099
 1042    H    GLU 126           HN       GLU 126  -9.902  -1.088  -8.715
 1043    HA   GLU 126           HA       GLU 126 -11.613  -1.934 -10.960
 1044   1HB   GLU 126           HB2      GLU 126 -10.132  -3.257  -8.780
 1045   2HB   GLU 126           HB1      GLU 126 -11.689  -3.994  -9.158
 1046   1HG   GLU 126           HG2      GLU 126 -11.076  -4.465 -11.372
 1047   2HG   GLU 126           HG1      GLU 126  -9.793  -3.254 -11.375
 1048    H    LYS 127           HN       LYS 127 -11.950  -1.725  -7.385
 1049    HA   LYS 127           HA       LYS 127 -14.873  -2.016  -7.682
 1050   1HB   LYS 127           HB2      LYS 127 -13.094  -1.763  -5.242
 1051   2HB   LYS 127           HB1      LYS 127 -14.844  -1.980  -5.177
 1052   1HG   LYS 127           HG2      LYS 127 -14.469  -4.046  -6.668
 1053   2HG   LYS 127           HG1      LYS 127 -12.765  -3.893  -6.242
 1054   1HD   LYS 127           HD2      LYS 127 -13.332  -4.043  -3.854
 1055   2HD   LYS 127           HD1      LYS 127 -15.045  -4.159  -4.259
 1056   1HE   LYS 127           HE2      LYS 127 -14.197  -6.168  -5.778
 1057   2HE   LYS 127           HE1      LYS 127 -12.871  -6.185  -4.615
 1058   1HZ   LYS 127           HZ1      LYS 127 -15.293  -5.907  -3.227
 1059   2HZ   LYS 127           HZ3      LYS 127 -15.446  -7.211  -4.301
 1060   3HZ   LYS 127           HZ2      LYS 127 -14.181  -7.190  -3.167
 1061    OH   TYR 128           OH       TYR 128 -11.579   0.851  -0.983
 1062    H    TYR 128           HN       TYR 128 -12.548   0.550  -6.997
 1063    HA   TYR 128           HA       TYR 128 -14.672   2.374  -6.109
 1064   1HB   TYR 128           HB2      TYR 128 -11.762   2.911  -6.762
 1065   2HB   TYR 128           HB1      TYR 128 -12.872   4.070  -6.037
 1066    HD1  TYR 128           HD2      TYR 128 -14.377   2.674  -4.082
 1067    HD2  TYR 128           HD1      TYR 128 -10.258   2.100  -5.163
 1068    HE1  TYR 128           HE2      TYR 128 -13.919   1.726  -1.836
 1069    HE2  TYR 128           HE1      TYR 128  -9.804   1.153  -2.916
 1070    HH   TYR 128           HH       TYR 128 -12.389   0.901  -0.471
 1071    H    SER 129           HN       SER 129 -14.093   1.181  -9.093
 1072    HA   SER 129           HA       SER 129 -13.939   3.588 -10.683
 1073   1HB   SER 129           HB2      SER 129 -13.654   0.946 -11.245
 1074   2HB   SER 129           HB1      SER 129 -15.297   1.210 -11.823
 1075    HG   SER 129           HG       SER 129 -12.888   2.447 -12.618
 1076    H    LYS 130           HN       LYS 130 -16.542   1.787  -9.175
 1077    HA   LYS 130           HA       LYS 130 -18.436   3.880 -10.138
 1078   1HB   LYS 130           HB2      LYS 130 -18.513   0.991 -10.639
 1079   2HB   LYS 130           HB1      LYS 130 -19.999   1.601  -9.912
 1080   1HG   LYS 130           HG2      LYS 130 -20.541   2.856 -11.745
 1081   2HG   LYS 130           HG1      LYS 130 -18.860   3.269 -12.082
 1082   1HD   LYS 130           HD2      LYS 130 -20.099   0.551 -12.601
 1083   2HD   LYS 130           HD1      LYS 130 -19.854   1.791 -13.830
 1084   1HE   LYS 130           HE2      LYS 130 -17.406   1.407 -12.364
 1085   2HE   LYS 130           HE1      LYS 130 -17.987  -0.150 -12.953
 1086   1HZ   LYS 130           HZ3      LYS 130 -17.985   2.184 -14.743
 1087   2HZ   LYS 130           HZ2      LYS 130 -16.543   1.327 -14.478
 1088   3HZ   LYS 130           HZ1      LYS 130 -17.896   0.536 -15.131
 1089    H    CYS 131           HN       CYS 131 -17.017   3.590  -7.601
 1090    HA   CYS 131           HA       CYS 131 -18.541   2.400  -5.544
 1091   1HB   CYS 131           HB2      CYS 131 -16.288   3.379  -5.212
 1092   2HB   CYS 131           HB1      CYS 131 -16.970   4.993  -5.417
 1093    H    SER 132           HN       SER 132 -18.704   5.789  -6.701
 1094    HA   SER 132           HA       SER 132 -21.063   6.357  -5.109
 1095   1HB   SER 132           HB2      SER 132 -19.623   8.199  -5.707
 1096   2HB   SER 132           HB1      SER 132 -19.758   7.814  -7.421
 1097    HG   SER 132           HG       SER 132 -21.152   9.534  -6.718
 1098    H    SER 133           HN       SER 133 -23.223   6.633  -5.896
 1099    HA   SER 133           HA       SER 133 -23.800   5.717  -8.653
 1100   1HB   SER 133           HB2      SER 133 -25.237   4.454  -6.315
 1101   2HB   SER 133           HB1      SER 133 -25.255   3.953  -8.003
 1102    HG   SER 133           HG       SER 133 -23.541   2.820  -7.609
   
  Start of MODEL          19
 Raw file had 1102 H/Q atoms
  Start of MODEL   19
    1   1H    GLU   1           HT1      GLU   1 -12.868   7.462   8.794
    2   2H    GLU   1           HT3      GLU   1 -13.050   8.135  10.340
    3   3H    GLU   1           HT2      GLU   1 -12.013   6.810  10.109
    4    HA   GLU   1           HA       GLU   1 -13.716   5.304   9.913
    5   1HB   GLU   1           HB2      GLU   1 -14.955   7.437  11.675
    6   2HB   GLU   1           HB1      GLU   1 -15.183   5.691  11.790
    7   1HG   GLU   1           HG2      GLU   1 -13.488   5.706  13.284
    8   2HG   GLU   1           HG1      GLU   1 -12.422   5.990  11.907
    9    H    ALA   2           HN       ALA   2 -15.776   4.751   9.059
   10    HA   ALA   2           HA       ALA   2 -17.619   6.835   8.166
   11   1HB   ALA   2           HB1      ALA   2 -15.840   6.836   6.392
   12   2HB   ALA   2           HB3      ALA   2 -16.226   5.145   6.069
   13   3HB   ALA   2           HB2      ALA   2 -17.436   6.396   5.785
   14    H    GLU   3           HN       GLU   3 -19.128   5.607   9.399
   15    HA   GLU   3           HA       GLU   3 -19.691   2.858   8.381
   16   1HB   GLU   3           HB2      GLU   3 -19.404   3.745  10.974
   17   2HB   GLU   3           HB1      GLU   3 -21.156   3.764  10.765
   18   1HG   GLU   3           HG2      GLU   3 -21.050   1.424   9.915
   19   2HG   GLU   3           HG1      GLU   3 -19.316   1.411  10.243
   20    H    ALA   4           HN       ALA   4 -20.514   5.149   6.860
   21    HA   ALA   4           HA       ALA   4 -23.478   4.993   7.237
   22   1HB   ALA   4           HB2      ALA   4 -21.678   7.287   6.650
   23   2HB   ALA   4           HB1      ALA   4 -23.216   7.248   5.788
   24   3HB   ALA   4           HB3      ALA   4 -23.193   7.248   7.552
   25    H    HIS   5           HN       HIS   5 -21.489   6.241   4.557
   26    HA   HIS   5           HA       HIS   5 -21.813   3.992   2.835
   27   1HB   HIS   5           HB2      HIS   5 -24.211   5.393   3.196
   28   2HB   HIS   5           HB1      HIS   5 -23.591   5.967   1.647
   29    HD1  HIS   5           HD1      HIS   5 -24.097   4.492  -0.298
   30    HD2  HIS   5           HD2      HIS   5 -24.144   2.364   3.285
   31    HE1  HIS   5           HE1      HIS   5 -24.783   2.123  -0.880
   32    H    LYS   6           HN       LYS   6 -21.644   7.536   3.049
   33    HA   LYS   6           HA       LYS   6 -20.419   7.909   0.479
   34   1HB   LYS   6           HB2      LYS   6 -20.179   9.597   2.973
   35   2HB   LYS   6           HB1      LYS   6 -19.714  10.095   1.347
   36   1HG   LYS   6           HG2      LYS   6 -22.247   9.286   0.861
   37   2HG   LYS   6           HG1      LYS   6 -22.423   9.816   2.534
   38   1HD   LYS   6           HD2      LYS   6 -22.424  11.964   1.871
   39   2HD   LYS   6           HD1      LYS   6 -20.835  11.748   1.136
   40   1HE   LYS   6           HE2      LYS   6 -22.089  10.671  -0.841
   41   2HE   LYS   6           HE1      LYS   6 -23.549  11.369  -0.136
   42   1HZ   LYS   6           HZ1      LYS   6 -22.301  13.539  -0.136
   43   2HZ   LYS   6           HZ3      LYS   6 -21.141  12.787  -1.117
   44   3HZ   LYS   6           HZ2      LYS   6 -22.742  12.942  -1.663
   45    H    CYS   7           HN       CYS   7 -18.759   6.483   0.211
   46    HA   CYS   7           HA       CYS   7 -16.370   6.843   1.972
   47   1HB   CYS   7           HB2      CYS   7 -16.012   4.588   2.030
   48   2HB   CYS   7           HB1      CYS   7 -17.741   4.511   1.687
   49    H    ASP   8           HN       ASP   8 -17.583   7.438  -1.101
   50    HA   ASP   8           HA       ASP   8 -15.391   6.731  -2.787
   51   1HB   ASP   8           HB2      ASP   8 -16.406   8.138  -4.405
   52   2HB   ASP   8           HB1      ASP   8 -17.749   7.528  -3.437
   53    H    ILE   9           HN       ILE   9 -15.912   9.430  -0.615
   54    HA   ILE   9           HA       ILE   9 -13.941  11.203  -1.684
   55    HB   ILE   9           HB       ILE   9 -15.007  10.864   1.129
   56   1HG1  ILE   9          HG12      ILE   9 -16.372  11.702  -1.004
   57   2HG1  ILE   9          HG11      ILE   9 -16.567  12.480   0.567
   58   1HG2  ILE   9          HG22      ILE   9 -13.102  12.893  -0.053
   59   2HG2  ILE   9          HG21      ILE   9 -14.062  13.234   1.387
   60   3HG2  ILE   9          HG23      ILE   9 -12.889  11.918   1.402
   61   1HD1  ILE   9          HD13      ILE   9 -14.523  13.419  -1.452
   62   2HD1  ILE   9          HD12      ILE   9 -16.171  14.046  -1.416
   63   3HD1  ILE   9          HD11      ILE   9 -15.111  14.272  -0.025
   64    H    THR  10           HN       THR  10 -13.592   9.276   1.317
   65    HA   THR  10           HA       THR  10 -10.796   9.606   1.530
   66    HB   THR  10           HB       THR  10 -12.317   7.151   2.420
   67    HG1  THR  10           HG1      THR  10 -12.293   9.797   3.349
   68   1HG2  THR  10          HG23      THR  10  -9.811   8.577   3.329
   69   2HG2  THR  10          HG22      THR  10 -10.655   7.412   4.351
   70   3HG2  THR  10          HG21      THR  10  -9.979   6.901   2.804
   71    H    LEU  11           HN       LEU  11 -12.636   7.224  -0.327
   72    HA   LEU  11           HA       LEU  11 -10.306   5.591  -0.907
   73   1HB   LEU  11           HB2      LEU  11 -13.092   5.352  -1.238
   74   2HB   LEU  11           HB1      LEU  11 -12.405   5.285  -2.862
   75    HG   LEU  11           HG       LEU  11 -10.819   3.541  -2.118
   76   1HD1  LEU  11          HD13      LEU  11 -12.050   4.217   0.509
   77   2HD1  LEU  11          HD12      LEU  11 -11.676   2.518   0.218
   78   3HD1  LEU  11          HD11      LEU  11 -10.397   3.729   0.134
   79   1HD2  LEU  11          HD22      LEU  11 -13.239   3.080  -2.929
   80   2HD2  LEU  11          HD21      LEU  11 -12.378   1.765  -2.130
   81   3HD2  LEU  11          HD23      LEU  11 -13.581   2.700  -1.242
   82    H    GLN  12           HN       GLN  12 -11.701   8.443  -2.387
   83    HA   GLN  12           HA       GLN  12 -10.357   8.022  -4.944
   84   1HB   GLN  12           HB2      GLN  12 -11.383   9.960  -5.655
   85   2HB   GLN  12           HB1      GLN  12 -12.455   9.558  -4.318
   86   1HG   GLN  12           HG2      GLN  12 -10.905  10.985  -2.853
   87   2HG   GLN  12           HG1      GLN  12 -10.208  11.576  -4.360
   88   1HE2  GLN  12          HE22      GLN  12 -12.747  14.062  -4.152
   89   2HE2  GLN  12          HE21      GLN  12 -11.089  13.748  -3.968
   90    H    GLU  13           HN       GLU  13  -9.665   9.715  -1.934
   91    HA   GLU  13           HA       GLU  13  -7.255  10.993  -2.989
   92   1HB   GLU  13           HB2      GLU  13  -8.768  11.628  -0.896
   93   2HB   GLU  13           HB1      GLU  13  -7.676  10.527  -0.057
   94   1HG   GLU  13           HG2      GLU  13  -5.861  11.960  -1.443
   95   2HG   GLU  13           HG1      GLU  13  -7.121  13.184  -1.273
   96    H    ILE  14           HN       ILE  14  -8.097   8.031  -1.303
   97    HA   ILE  14           HA       ILE  14  -5.395   7.250  -0.653
   98    HB   ILE  14           HB       ILE  14  -8.088   6.140  -0.446
   99   1HG1  ILE  14          HG12      ILE  14  -5.774   5.103   1.115
  100   2HG1  ILE  14          HG11      ILE  14  -6.123   6.825   1.261
  101   1HG2  ILE  14          HG23      ILE  14  -5.800   4.294  -1.188
  102   2HG2  ILE  14          HG22      ILE  14  -7.292   3.751  -0.420
  103   3HG2  ILE  14          HG21      ILE  14  -7.343   4.476  -2.024
  104   1HD1  ILE  14          HD13      ILE  14  -8.629   5.576   1.394
  105   2HD1  ILE  14          HD12      ILE  14  -7.567   4.566   2.376
  106   3HD1  ILE  14          HD11      ILE  14  -7.734   6.285   2.740
  107    H    ILE  15           HN       ILE  15  -7.459   6.902  -3.483
  108    HA   ILE  15           HA       ILE  15  -5.803   4.919  -4.801
  109    HB   ILE  15           HB       ILE  15  -8.148   6.579  -5.486
  110   1HG1  ILE  15          HG12      ILE  15  -8.685   4.413  -6.720
  111   2HG1  ILE  15          HG11      ILE  15  -7.163   3.778  -6.093
  112   1HG2  ILE  15          HG21      ILE  15  -6.076   5.791  -7.549
  113   2HG2  ILE  15          HG23      ILE  15  -7.758   6.121  -7.960
  114   3HG2  ILE  15          HG22      ILE  15  -6.756   7.393  -7.264
  115   1HD1  ILE  15          HD12      ILE  15  -8.187   4.714  -3.797
  116   2HD1  ILE  15          HD11      ILE  15  -9.695   4.395  -4.652
  117   3HD1  ILE  15          HD13      ILE  15  -8.540   3.090  -4.386
  118    H    LYS  16           HN       LYS  16  -6.166   8.456  -5.205
  119    HA   LYS  16           HA       LYS  16  -4.154   8.817  -7.154
  120   1HB   LYS  16           HB2      LYS  16  -5.583  10.494  -5.237
  121   2HB   LYS  16           HB1      LYS  16  -3.924  11.041  -5.486
  122   1HG   LYS  16           HG2      LYS  16  -4.976  12.134  -7.239
  123   2HG   LYS  16           HG1      LYS  16  -4.528  10.625  -8.039
  124   1HD   LYS  16           HD2      LYS  16  -6.757  10.633  -8.593
  125   2HD   LYS  16           HD1      LYS  16  -6.896   9.868  -7.010
  126   1HE   LYS  16           HE2      LYS  16  -7.602  11.853  -5.970
  127   2HE   LYS  16           HE1      LYS  16  -6.966  12.867  -7.266
  128   1HZ   LYS  16           HZ2      LYS  16  -8.680  11.493  -8.669
  129   2HZ   LYS  16           HZ1      LYS  16  -9.447  11.318  -7.164
  130   3HZ   LYS  16           HZ3      LYS  16  -9.165  12.867  -7.795
  131    H    THR  17           HN       THR  17  -3.890   8.431  -3.650
  132    HA   THR  17           HA       THR  17  -1.076   9.074  -3.510
  133    HB   THR  17           HB       THR  17  -2.464   7.211  -1.591
  134    HG1  THR  17           HG1      THR  17  -3.666   8.791  -0.862
  135   1HG2  THR  17          HG23      THR  17  -0.058   8.871  -1.667
  136   2HG2  THR  17          HG22      THR  17  -1.043   9.177  -0.237
  137   3HG2  THR  17          HG21      THR  17  -0.472   7.544  -0.581
  138    H    LEU  18           HN       LEU  18  -2.908   6.078  -4.010
  139    HA   LEU  18           HA       LEU  18  -0.793   4.228  -3.720
  140   1HB   LEU  18           HB2      LEU  18  -3.428   4.029  -4.442
  141   2HB   LEU  18           HB1      LEU  18  -2.635   3.708  -5.982
  142    HG   LEU  18           HG       LEU  18  -2.440   2.164  -3.400
  143   1HD1  LEU  18          HD11      LEU  18  -3.988   1.717  -5.491
  144   2HD1  LEU  18          HD13      LEU  18  -2.511   1.039  -6.177
  145   3HD1  LEU  18          HD12      LEU  18  -3.175   0.375  -4.686
  146   1HD2  LEU  18          HD23      LEU  18  -0.383   2.397  -5.594
  147   2HD2  LEU  18          HD22      LEU  18  -0.133   2.366  -3.849
  148   3HD2  LEU  18          HD21      LEU  18  -0.570   0.887  -4.704
  149    H    ASN  19           HN       ASN  19  -1.839   6.053  -6.601
  150    HA   ASN  19           HA       ASN  19   0.179   4.985  -8.349
  151   1HB   ASN  19           HB2      ASN  19  -1.584   7.427  -8.414
  152   2HB   ASN  19           HB1      ASN  19  -0.335   7.188  -9.637
  153   1HD2  ASN  19          HD22      ASN  19  -3.322   5.562 -11.052
  154   2HD2  ASN  19          HD21      ASN  19  -2.775   7.141 -10.749
  155    H    SER  20           HN       SER  20   0.117   7.785  -6.173
  156    HA   SER  20           HA       SER  20   2.505   9.032  -7.108
  157   1HB   SER  20           HB2      SER  20   1.645   8.962  -4.212
  158   2HB   SER  20           HB1      SER  20   2.513  10.241  -5.055
  159    HG   SER  20           HG       SER  20   0.534  10.998  -5.218
  160    H    LEU  21           HN       LEU  21   1.979   6.256  -5.021
  161    HA   LEU  21           HA       LEU  21   4.725   6.149  -4.068
  162   1HB   LEU  21           HB2      LEU  21   2.489   4.102  -4.089
  163   2HB   LEU  21           HB1      LEU  21   4.066   3.817  -3.352
  164    HG   LEU  21           HG       LEU  21   2.482   6.269  -2.620
  165   1HD1  LEU  21          HD11      LEU  21   1.601   3.589  -2.214
  166   2HD1  LEU  21          HD13      LEU  21   2.159   4.205  -0.657
  167   3HD1  LEU  21          HD12      LEU  21   0.908   5.070  -1.553
  168   1HD2  LEU  21          HD23      LEU  21   4.698   4.605  -1.435
  169   2HD2  LEU  21          HD22      LEU  21   4.665   6.341  -1.740
  170   3HD2  LEU  21          HD21      LEU  21   3.729   5.661  -0.409
  171    H    THR  22           HN       THR  22   2.994   4.930  -6.861
  172    HA   THR  22           HA       THR  22   4.786   2.873  -7.657
  173    HB   THR  22           HB       THR  22   3.220   4.728  -9.467
  174    HG1  THR  22           HG1      THR  22   2.509   2.345  -8.109
  175   1HG2  THR  22          HG22      THR  22   4.963   2.499  -9.941
  176   2HG2  THR  22          HG21      THR  22   3.317   2.039 -10.373
  177   3HG2  THR  22          HG23      THR  22   4.060   3.457 -11.114
  178    H    GLU  23           HN       GLU  23   5.264   6.304  -7.624
  179    HA   GLU  23           HA       GLU  23   6.999   6.711  -9.796
  180   1HB   GLU  23           HB2      GLU  23   6.266   8.543  -8.348
  181   2HB   GLU  23           HB1      GLU  23   7.181   7.871  -6.999
  182   1HG   GLU  23           HG2      GLU  23   9.276   8.142  -8.315
  183   2HG   GLU  23           HG1      GLU  23   8.341   8.884  -9.613
  184    H    GLN  24           HN       GLN  24   7.601   5.047  -6.761
  185    HA   GLN  24           HA       GLN  24  10.253   4.203  -7.836
  186   1HB   GLN  24           HB2      GLN  24  10.387   6.117  -6.096
  187   2HB   GLN  24           HB1      GLN  24   9.893   4.896  -4.923
  188   1HG   GLN  24           HG2      GLN  24  12.297   4.930  -4.917
  189   2HG   GLN  24           HG1      GLN  24  11.809   3.463  -5.766
  190   1HE2  GLN  24          HE22      GLN  24  14.338   4.942  -7.972
  191   2HE2  GLN  24          HE21      GLN  24  14.273   4.111  -6.494
  192    H    LYS  25           HN       LYS  25   8.101   2.585  -8.055
  193    HA   LYS  25           HA       LYS  25   8.369   0.689  -5.757
  194   1HB   LYS  25           HB2      LYS  25   6.052   1.268  -7.606
  195   2HB   LYS  25           HB1      LYS  25   6.129  -0.204  -6.637
  196   1HG   LYS  25           HG2      LYS  25   6.641   2.411  -5.284
  197   2HG   LYS  25           HG1      LYS  25   4.974   1.990  -5.680
  198   1HD   LYS  25           HD2      LYS  25   5.229  -0.148  -4.475
  199   2HD   LYS  25           HD1      LYS  25   6.896   0.274  -4.080
  200   1HE   LYS  25           HE2      LYS  25   5.915   1.070  -2.166
  201   2HE   LYS  25           HE1      LYS  25   5.666   2.495  -3.176
  202   1HZ   LYS  25           HZ2      LYS  25   3.706   0.281  -2.956
  203   2HZ   LYS  25           HZ1      LYS  25   3.648   1.684  -1.997
  204   3HZ   LYS  25           HZ3      LYS  25   3.474   1.801  -3.680
  205    H    THR  26           HN       THR  26  10.282   0.689  -7.807
  206    HA   THR  26           HA       THR  26   9.579  -1.816  -9.285
  207    HB   THR  26           HB       THR  26  11.807  -0.640 -10.536
  208    HG1  THR  26           HG1      THR  26  11.125   1.456 -10.899
  209   1HG2  THR  26          HG23      THR  26   8.907  -1.036 -11.131
  210   2HG2  THR  26          HG22      THR  26   9.842  -0.012 -12.222
  211   3HG2  THR  26          HG21      THR  26  10.322  -1.689 -11.958
  212    H    LEU  27           HN       LEU  27  12.171   0.012  -7.691
  213    HA   LEU  27           HA       LEU  27  13.848  -2.420  -7.510
  214   1HB   LEU  27           HB2      LEU  27  14.319   0.398  -7.544
  215   2HB   LEU  27           HB1      LEU  27  14.894  -0.222  -5.997
  216    HG   LEU  27           HG       LEU  27  16.026  -2.090  -7.381
  217   1HD1  LEU  27          HD11      LEU  27  14.748  -1.530  -9.470
  218   2HD1  LEU  27          HD13      LEU  27  15.648  -0.016  -9.561
  219   3HD1  LEU  27          HD12      LEU  27  16.496  -1.555  -9.703
  220   1HD2  LEU  27          HD21      LEU  27  16.956   0.789  -7.648
  221   2HD2  LEU  27          HD23      LEU  27  17.266  -0.270  -6.273
  222   3HD2  LEU  27          HD22      LEU  27  17.978  -0.635  -7.843
  223    H    CYS  28           HN       CYS  28  12.088  -0.177  -5.396
  224    HA   CYS  28           HA       CYS  28  12.792  -1.638  -2.975
  225   1HB   CYS  28           HB2      CYS  28  11.153   0.725  -3.678
  226   2HB   CYS  28           HB1      CYS  28  10.600  -0.186  -2.272
  227    H    THR  29           HN       THR  29  10.580  -2.229  -5.505
  228    HA   THR  29           HA       THR  29   8.601  -3.571  -3.796
  229    HB   THR  29           HB       THR  29   7.694  -4.252  -6.118
  230    HG1  THR  29           HG1      THR  29   8.852  -3.655  -7.741
  231   1HG2  THR  29          HG21      THR  29   6.848  -2.384  -4.651
  232   2HG2  THR  29          HG23      THR  29   7.923  -1.293  -5.527
  233   3HG2  THR  29          HG22      THR  29   6.613  -2.114  -6.378
  234    H    GLU  30           HN       GLU  30  11.631  -4.447  -4.488
  235    HA   GLU  30           HA       GLU  30  11.003  -7.215  -5.342
  236   1HB   GLU  30           HB2      GLU  30  13.298  -5.425  -5.564
  237   2HB   GLU  30           HB1      GLU  30  13.764  -6.999  -4.923
  238   1HG   GLU  30           HG2      GLU  30  11.953  -7.554  -7.005
  239   2HG   GLU  30           HG1      GLU  30  13.005  -6.282  -7.625
  240    H    LEU  31           HN       LEU  31   9.887  -7.381  -3.148
  241    HA   LEU  31           HA       LEU  31  11.800  -8.528  -1.202
  242   1HB   LEU  31           HB2      LEU  31   9.593  -6.643  -0.335
  243   2HB   LEU  31           HB1      LEU  31  10.861  -7.341   0.670
  244    HG   LEU  31           HG       LEU  31  11.389  -5.451  -1.642
  245   1HD1  LEU  31          HD12      LEU  31  10.929  -4.984   1.295
  246   2HD1  LEU  31          HD11      LEU  31  11.972  -3.903   0.370
  247   3HD1  LEU  31          HD13      LEU  31  10.278  -4.096  -0.082
  248   1HD2  LEU  31          HD21      LEU  31  13.084  -7.214  -0.370
  249   2HD2  LEU  31          HD23      LEU  31  13.600  -5.732  -1.174
  250   3HD2  LEU  31          HD22      LEU  31  13.318  -5.739   0.567
  251    H    THR  32           HN       THR  32  10.979 -10.570  -1.691
  252    HA   THR  32           HA       THR  32   8.331 -11.377  -2.100
  253    HB   THR  32           HB       THR  32   9.064 -13.593  -1.122
  254    HG1  THR  32           HG1      THR  32  11.374 -13.600  -0.632
  255   1HG2  THR  32          HG21      THR  32   9.868 -12.297  -3.459
  256   2HG2  THR  32          HG23      THR  32  11.363 -12.954  -2.797
  257   3HG2  THR  32          HG22      THR  32  10.001 -14.023  -3.128
  258    H    VAL  33           HN       VAL  33   6.928 -10.242  -0.836
  259    HA   VAL  33           HA       VAL  33   7.022 -10.593   2.089
  260    HB   VAL  33           HB       VAL  33   4.856  -9.106   1.886
  261   1HG1  VAL  33          HG12      VAL  33   7.739  -8.361   1.557
  262   2HG1  VAL  33          HG11      VAL  33   6.517  -7.092   1.482
  263   3HG1  VAL  33          HG13      VAL  33   6.661  -8.091   2.927
  264   1HG2  VAL  33          HG21      VAL  33   5.119  -9.458  -0.767
  265   2HG2  VAL  33          HG23      VAL  33   4.493  -7.956  -0.087
  266   3HG2  VAL  33          HG22      VAL  33   6.179  -8.064  -0.582
  267    H    THR  34           HN       THR  34   3.910 -10.454   0.432
  268    HA   THR  34           HA       THR  34   3.480 -13.334   0.660
  269    HB   THR  34           HB       THR  34   2.894 -11.597   2.870
  270    HG1  THR  34           HG1      THR  34   2.351 -13.617   3.785
  271   1HG2  THR  34          HG23      THR  34   0.470 -12.917   1.606
  272   2HG2  THR  34          HG22      THR  34   0.517 -12.202   3.215
  273   3HG2  THR  34          HG21      THR  34   0.729 -11.181   1.795
  274    H    ASP  35           HN       ASP  35   1.482 -13.977  -0.334
  275    HA   ASP  35           HA       ASP  35   0.354 -11.876  -2.112
  276   1HB   ASP  35           HB2      ASP  35   1.114 -14.512  -2.586
  277   2HB   ASP  35           HB1      ASP  35  -0.644 -14.608  -2.478
  278    H    ILE  36           HN       ILE  36  -1.292 -10.833  -1.031
  279    HA   ILE  36           HA       ILE  36  -3.063 -12.383   0.755
  280    HB   ILE  36           HB       ILE  36  -3.819 -10.316   1.586
  281   1HG1  ILE  36          HG12      ILE  36  -2.916  -9.214  -1.082
  282   2HG1  ILE  36          HG11      ILE  36  -4.539  -9.196  -0.390
  283   1HG2  ILE  36          HG22      ILE  36  -1.207 -10.837   1.633
  284   2HG2  ILE  36          HG21      ILE  36  -1.138  -9.351   0.687
  285   3HG2  ILE  36          HG23      ILE  36  -1.854  -9.338   2.299
  286   1HD1  ILE  36          HD11      ILE  36  -3.586  -7.762   1.489
  287   2HD1  ILE  36          HD13      ILE  36  -2.131  -7.597   0.505
  288   3HD1  ILE  36          HD12      ILE  36  -3.673  -6.984  -0.091
  289    H    PHE  37           HN       PHE  37  -3.092 -12.511  -2.358
  290    HA   PHE  37           HA       PHE  37  -6.007 -11.902  -2.644
  291   1HB   PHE  37           HB2      PHE  37  -3.855 -11.988  -4.784
  292   2HB   PHE  37           HB1      PHE  37  -5.570 -11.708  -5.081
  293    HD1  PHE  37           HD2      PHE  37  -6.685  -9.670  -4.141
  294    HD2  PHE  37           HD1      PHE  37  -2.434 -10.252  -3.953
  295    HE1  PHE  37           HE2      PHE  37  -6.375  -7.257  -3.662
  296    HE2  PHE  37           HE1      PHE  37  -2.125  -7.842  -3.476
  297    HZ   PHE  37           HZ       PHE  37  -4.093  -6.344  -3.327
  298    H    ALA  38           HN       ALA  38  -4.792 -14.364  -1.567
  299    HA   ALA  38           HA       ALA  38  -5.295 -16.308  -3.762
  300   1HB   ALA  38           HB1      ALA  38  -4.202 -16.731  -0.963
  301   2HB   ALA  38           HB3      ALA  38  -4.350 -17.977  -2.201
  302   3HB   ALA  38           HB2      ALA  38  -3.241 -16.626  -2.438
  303    H    ALA  39           HN       ALA  39  -6.609 -15.180  -0.707
  304    HA   ALA  39           HA       ALA  39  -8.921 -17.031  -1.132
  305   1HB   ALA  39           HB2      ALA  39  -7.398 -16.382   1.379
  306   2HB   ALA  39           HB1      ALA  39  -9.105 -16.813   1.477
  307   3HB   ALA  39           HB3      ALA  39  -7.946 -17.951   0.789
  308    H    SER  40           HN       SER  40 -10.950 -16.169  -0.076
  309    HA   SER  40           HA       SER  40 -11.025 -13.319   0.562
  310   1HB   SER  40           HB2      SER  40 -10.947 -13.292  -1.927
  311   2HB   SER  40           HB1      SER  40 -12.390 -14.302  -1.963
  312    HG   SER  40           HG       SER  40 -12.614 -11.893  -2.090
  313    H    LYS  41           HN       LYS  41 -11.869 -14.673   2.443
  314    HA   LYS  41           HA       LYS  41 -14.590 -15.757   2.066
  315   1HB   LYS  41           HB2      LYS  41 -12.730 -15.583   4.451
  316   2HB   LYS  41           HB1      LYS  41 -14.381 -16.195   4.569
  317   1HG   LYS  41           HG2      LYS  41 -13.873 -17.917   2.880
  318   2HG   LYS  41           HG1      LYS  41 -12.222 -17.307   2.752
  319   1HD   LYS  41           HD2      LYS  41 -12.573 -17.677   5.488
  320   2HD   LYS  41           HD1      LYS  41 -13.392 -19.064   4.771
  321   1HE   LYS  41           HE2      LYS  41 -11.454 -19.912   3.850
  322   2HE   LYS  41           HE1      LYS  41 -10.723 -18.319   3.660
  323   1HZ   LYS  41           HZ3      LYS  41 -11.222 -19.401   6.352
  324   2HZ   LYS  41           HZ2      LYS  41  -9.851 -19.897   5.482
  325   3HZ   LYS  41           HZ1      LYS  41 -10.075 -18.255   5.856
  326    H    ASP  42           HN       ASP  42 -12.966 -13.010   3.602
  327    HA   ASP  42           HA       ASP  42 -15.537 -11.560   3.630
  328   1HB   ASP  42           HB2      ASP  42 -15.117 -12.854   5.876
  329   2HB   ASP  42           HB1      ASP  42 -13.944 -11.572   6.178
  330    H    THR  43           HN       THR  43 -12.719 -11.415   2.407
  331    HA   THR  43           HA       THR  43 -11.870  -8.802   3.518
  332    HB   THR  43           HB       THR  43  -9.894  -9.035   2.115
  333    HG1  THR  43           HG1      THR  43 -11.111 -11.443   1.239
  334   1HG2  THR  43          HG21      THR  43 -10.264 -10.353   4.348
  335   2HG2  THR  43          HG23      THR  43 -10.290 -11.767   3.296
  336   3HG2  THR  43          HG22      THR  43  -8.864 -10.732   3.344
  337    H    THR  44           HN       THR  44 -13.035  -7.158   2.691
  338    HA   THR  44           HA       THR  44 -13.678  -7.244  -0.207
  339    HB   THR  44           HB       THR  44 -15.127  -5.141   0.964
  340    HG1  THR  44           HG1      THR  44 -16.220  -6.745   2.526
  341   1HG2  THR  44          HG23      THR  44 -15.639  -7.032  -0.812
  342   2HG2  THR  44          HG22      THR  44 -16.323  -7.858   0.587
  343   3HG2  THR  44          HG21      THR  44 -16.949  -6.283   0.101
  344    H    GLU  45           HN       GLU  45 -13.550  -4.411   1.901
  345    HA   GLU  45           HA       GLU  45 -11.286  -3.419   0.229
  346   1HB   GLU  45           HB2      GLU  45 -12.278  -1.263   0.023
  347   2HB   GLU  45           HB1      GLU  45 -13.570  -2.401  -0.352
  348   1HG   GLU  45           HG2      GLU  45 -14.332  -2.239   2.029
  349   2HG   GLU  45           HG1      GLU  45 -13.117  -0.987   2.290
  350    H    LYS  46           HN       LYS  46 -13.057  -3.147   3.303
  351    HA   LYS  46           HA       LYS  46 -11.004  -1.567   4.591
  352   1HB   LYS  46           HB2      LYS  46 -12.249  -1.982   6.627
  353   2HB   LYS  46           HB1      LYS  46 -13.414  -1.711   5.330
  354   1HG   LYS  46           HG2      LYS  46 -13.228  -4.340   5.054
  355   2HG   LYS  46           HG1      LYS  46 -12.703  -4.261   6.735
  356   1HD   LYS  46           HD2      LYS  46 -14.778  -2.834   7.172
  357   2HD   LYS  46           HD1      LYS  46 -15.326  -3.316   5.566
  358   1HE   LYS  46           HE2      LYS  46 -14.422  -5.649   6.982
  359   2HE   LYS  46           HE1      LYS  46 -15.574  -4.774   7.992
  360   1HZ   LYS  46           HZ2      LYS  46 -16.237  -5.086   5.167
  361   2HZ   LYS  46           HZ1      LYS  46 -16.340  -6.473   6.143
  362   3HZ   LYS  46           HZ3      LYS  46 -17.252  -5.096   6.529
  363    H    GLU  47           HN       GLU  47 -11.578  -5.015   4.112
  364    HA   GLU  47           HA       GLU  47  -9.533  -5.766   6.092
  365   1HB   GLU  47           HB2      GLU  47 -11.599  -7.108   4.593
  366   2HB   GLU  47           HB1      GLU  47 -10.062  -7.939   4.354
  367   1HG   GLU  47           HG2      GLU  47  -9.810  -8.411   6.629
  368   2HG   GLU  47           HG1      GLU  47 -10.877  -7.095   7.120
  369    H    THR  48           HN       THR  48  -9.783  -5.351   2.600
  370    HA   THR  48           HA       THR  48  -7.202  -6.530   2.013
  371    HB   THR  48           HB       THR  48  -8.130  -4.445   0.154
  372    HG1  THR  48           HG1      THR  48 -10.143  -4.986   0.701
  373   1HG2  THR  48          HG21      THR  48  -6.463  -6.392  -0.183
  374   2HG2  THR  48          HG23      THR  48  -7.895  -7.413  -0.310
  375   3HG2  THR  48          HG22      THR  48  -7.646  -6.099  -1.458
  376    H    PHE  49           HN       PHE  49  -8.269  -3.293   2.919
  377    HA   PHE  49           HA       PHE  49  -5.674  -2.100   2.271
  378   1HB   PHE  49           HB2      PHE  49  -8.035  -0.992   3.815
  379   2HB   PHE  49           HB1      PHE  49  -6.600  -0.069   3.377
  380    HD1  PHE  49           HD2      PHE  49  -6.124  -1.238   0.608
  381    HD2  PHE  49           HD1      PHE  49  -9.709   0.126   2.550
  382    HE1  PHE  49           HE2      PHE  49  -7.138  -0.759  -1.596
  383    HE2  PHE  49           HE1      PHE  49 -10.718   0.608   0.338
  384    HZ   PHE  49           HZ       PHE  49  -9.434   0.166  -1.734
  385    H    CYS  50           HN       CYS  50  -7.281  -3.368   5.154
  386    HA   CYS  50           HA       CYS  50  -5.344  -2.299   7.017
  387   1HB   CYS  50           HB2      CYS  50  -7.499  -3.046   7.843
  388   2HB   CYS  50           HB1      CYS  50  -7.232  -4.667   7.202
  389    NH1  ARG  51           NH2      ARG  51  -5.782 -10.561   4.267
  390    NH2  ARG  51           NH1      ARG  51  -6.712 -12.195   5.517
  391    H    ARG  51           HN       ARG  51  -5.725  -5.582   5.613
  392    HA   ARG  51           HA       ARG  51  -3.314  -6.629   6.722
  393   1HB   ARG  51           HB2      ARG  51  -5.130  -7.369   4.472
  394   2HB   ARG  51           HB1      ARG  51  -3.519  -8.086   4.477
  395   1HG   ARG  51           HG2      ARG  51  -4.364  -9.614   5.915
  396   2HG   ARG  51           HG1      ARG  51  -4.312  -8.331   7.120
  397   1HD   ARG  51           HD2      ARG  51  -6.558  -8.187   7.185
  398   2HD   ARG  51           HD1      ARG  51  -6.678  -8.101   5.432
  399    HE   ARG  51           HE       ARG  51  -7.282 -10.375   7.044
  400   1HH1  ARG  51          HH21      ARG  51  -5.578  -9.599   4.105
  401   2HH1  ARG  51          HH22      ARG  51  -5.524 -11.244   3.584
  402   1HH2  ARG  51          HH11      ARG  51  -7.219 -12.488   6.328
  403   2HH2  ARG  51          HH12      ARG  51  -6.451 -12.866   4.822
  404    H    ALA  52           HN       ALA  52  -3.926  -5.231   3.475
  405    HA   ALA  52           HA       ALA  52  -1.205  -5.362   2.611
  406   1HB   ALA  52           HB3      ALA  52  -3.546  -3.637   1.814
  407   2HB   ALA  52           HB2      ALA  52  -1.955  -3.412   1.088
  408   3HB   ALA  52           HB1      ALA  52  -2.796  -4.953   0.912
  409    H    ALA  53           HN       ALA  53  -2.825  -3.219   4.824
  410    HA   ALA  53           HA       ALA  53  -0.911  -1.043   4.608
  411   1HB   ALA  53           HB3      ALA  53  -3.031  -1.787   6.630
  412   2HB   ALA  53           HB2      ALA  53  -1.935  -0.434   6.903
  413   3HB   ALA  53           HB1      ALA  53  -3.019  -0.424   5.512
  414    H    THR  54           HN       THR  54  -1.220  -3.978   6.539
  415    HA   THR  54           HA       THR  54   0.871  -3.365   8.416
  416    HB   THR  54           HB       THR  54  -0.083  -6.063   7.392
  417    HG1  THR  54           HG1      THR  54  -0.734  -4.889   9.857
  418   1HG2  THR  54          HG23      THR  54   1.755  -5.203   9.610
  419   2HG2  THR  54          HG22      THR  54   0.795  -6.673   9.784
  420   3HG2  THR  54          HG21      THR  54   1.949  -6.525   8.457
  421    H    VAL  55           HN       VAL  55   0.814  -5.077   5.292
  422    HA   VAL  55           HA       VAL  55   3.623  -5.658   5.206
  423    HB   VAL  55           HB       VAL  55   1.596  -5.222   2.988
  424   1HG1  VAL  55          HG11      VAL  55   4.525  -5.751   2.945
  425   2HG1  VAL  55          HG13      VAL  55   3.536  -6.710   1.844
  426   3HG1  VAL  55          HG12      VAL  55   3.508  -4.949   1.747
  427   1HG2  VAL  55          HG22      VAL  55   1.709  -7.250   4.784
  428   2HG2  VAL  55          HG21      VAL  55   1.171  -7.471   3.119
  429   3HG2  VAL  55          HG23      VAL  55   2.830  -7.862   3.569
  430    H    LEU  56           HN       LEU  56   1.707  -2.812   4.429
  431    HA   LEU  56           HA       LEU  56   3.760  -1.358   3.031
  432   1HB   LEU  56           HB2      LEU  56   1.287  -0.501   4.553
  433   2HB   LEU  56           HB1      LEU  56   2.348   0.655   3.747
  434    HG   LEU  56           HG       LEU  56   1.295  -1.729   2.243
  435   1HD1  LEU  56          HD11      LEU  56  -0.293   0.400   3.369
  436   2HD1  LEU  56          HD13      LEU  56  -0.285   0.532   1.610
  437   3HD1  LEU  56          HD12      LEU  56  -0.817  -0.963   2.381
  438   1HD2  LEU  56          HD22      LEU  56   2.415   0.993   1.624
  439   2HD2  LEU  56          HD21      LEU  56   2.920  -0.581   1.005
  440   3HD2  LEU  56          HD23      LEU  56   1.421   0.152   0.434
  441    NH1  ARG  57           NH2      ARG  57   5.838  -3.925  12.736
  442    NH2  ARG  57           NH1      ARG  57   7.493  -4.495  11.309
  443    H    ARG  57           HN       ARG  57   2.970  -1.825   6.423
  444    HA   ARG  57           HA       ARG  57   4.573   0.281   7.511
  445   1HB   ARG  57           HB2      ARG  57   2.910  -0.997   8.841
  446   2HB   ARG  57           HB1      ARG  57   3.916  -2.437   8.696
  447   1HG   ARG  57           HG2      ARG  57   5.739  -0.644   9.654
  448   2HG   ARG  57           HG1      ARG  57   4.264  -0.062  10.423
  449   1HD   ARG  57           HD2      ARG  57   4.870  -1.659  11.970
  450   2HD   ARG  57           HD1      ARG  57   3.918  -2.668  10.883
  451    HE   ARG  57           HE       ARG  57   6.485  -2.803   9.845
  452   1HH1  ARG  57          HH21      ARG  57   5.033  -3.380  12.967
  453   2HH1  ARG  57          HH22      ARG  57   6.185  -4.595  13.391
  454   1HH2  ARG  57          HH11      ARG  57   7.961  -4.385  10.433
  455   2HH2  ARG  57          HH12      ARG  57   7.826  -5.162  11.975
  456    H    GLN  58           HN       GLN  58   5.287  -3.193   7.009
  457    HA   GLN  58           HA       GLN  58   8.029  -3.049   7.776
  458   1HB   GLN  58           HB2      GLN  58   6.433  -4.910   6.040
  459   2HB   GLN  58           HB1      GLN  58   8.190  -5.067   6.101
  460   1HG   GLN  58           HG2      GLN  58   6.794  -4.783   8.710
  461   2HG   GLN  58           HG1      GLN  58   6.560  -6.308   7.856
  462   1HE2  GLN  58          HE22      GLN  58   9.588  -7.310   9.419
  463   2HE2  GLN  58          HE21      GLN  58   7.902  -7.513   9.369
  464    H    PHE  59           HN       PHE  59   6.392  -2.122   4.829
  465    HA   PHE  59           HA       PHE  59   8.627  -2.085   3.057
  466   1HB   PHE  59           HB2      PHE  59   6.188  -1.811   2.434
  467   2HB   PHE  59           HB1      PHE  59   6.277  -0.168   3.062
  468    HD1  PHE  59           HD2      PHE  59   8.192   1.344   2.098
  469    HD2  PHE  59           HD1      PHE  59   6.755  -2.237   0.206
  470    HE1  PHE  59           HE2      PHE  59   9.109   2.120  -0.072
  471    HE2  PHE  59           HE1      PHE  59   7.671  -1.456  -1.963
  472    HZ   PHE  59           HZ       PHE  59   8.845   0.722  -2.100
  473    OH   TYR  60           OH       TYR  60   5.524   3.976  10.128
  474    H    TYR  60           HN       TYR  60   7.142   0.709   4.760
  475    HA   TYR  60           HA       TYR  60   9.644   2.221   4.361
  476   1HB   TYR  60           HB2      TYR  60   8.399   4.111   4.709
  477   2HB   TYR  60           HB1      TYR  60   7.080   3.028   4.270
  478    HD1  TYR  60           HD2      TYR  60   5.963   1.690   6.209
  479    HD2  TYR  60           HD1      TYR  60   8.382   5.193   6.792
  480    HE1  TYR  60           HE2      TYR  60   4.947   2.020   8.447
  481    HE2  TYR  60           HE1      TYR  60   7.366   5.521   9.030
  482    HH   TYR  60           HH       TYR  60   4.867   4.672  10.054
  483    H    SER  61           HN       SER  61   8.953  -0.076   6.524
  484    HA   SER  61           HA       SER  61   9.739   1.427   8.942
  485   1HB   SER  61           HB2      SER  61   8.067  -0.253   9.319
  486   2HB   SER  61           HB1      SER  61   8.997  -1.462   8.440
  487    HG   SER  61           HG       SER  61   9.454  -0.329  10.978
  488    H    HIS  62           HN       HIS  62  10.908  -1.528   7.298
  489    HA   HIS  62           HA       HIS  62  13.577  -1.094   8.484
  490   1HB   HIS  62           HB2      HIS  62  12.123  -3.346   7.206
  491   2HB   HIS  62           HB1      HIS  62  13.877  -3.329   7.005
  492    HD1  HIS  62           HD1      HIS  62  14.867  -4.785   8.779
  493    HD2  HIS  62           HD2      HIS  62  11.701  -2.511  10.256
  494    HE1  HIS  62           HE1      HIS  62  14.722  -5.282  11.259
  495    H    HIS  63           HN       HIS  63  12.091  -1.186   5.245
  496    HA   HIS  63           HA       HIS  63  14.711  -0.687   3.991
  497   1HB   HIS  63           HB2      HIS  63  12.017  -0.711   2.631
  498   2HB   HIS  63           HB1      HIS  63  13.599  -1.011   1.911
  499    HD1  HIS  63           HD1      HIS  63  14.851  -3.055   3.672
  500    HD2  HIS  63           HD2      HIS  63  10.783  -3.171   2.771
  501    HE1  HIS  63           HE1      HIS  63  14.100  -5.442   4.061
  502    H    GLU  64           HN       GLU  64  13.157   1.414   5.713
  503    HA   GLU  64           HA       GLU  64  12.796   3.515   3.664
  504   1HB   GLU  64           HB2      GLU  64  12.158   4.943   5.637
  505   2HB   GLU  64           HB1      GLU  64  11.146   3.516   5.424
  506   1HG   GLU  64           HG2      GLU  64  12.074   2.420   7.251
  507   2HG   GLU  64           HG1      GLU  64  13.576   3.342   7.166
  508    H    LYS  65           HN       LYS  65  15.144   2.478   6.036
  509    HA   LYS  65           HA       LYS  65  16.801   4.864   5.313
  510   1HB   LYS  65           HB2      LYS  65  16.017   4.804   7.711
  511   2HB   LYS  65           HB1      LYS  65  16.933   3.311   7.912
  512   1HG   LYS  65           HG2      LYS  65  18.577   5.320   6.639
  513   2HG   LYS  65           HG1      LYS  65  17.908   5.950   8.143
  514   1HD   LYS  65           HD2      LYS  65  18.666   3.370   8.830
  515   2HD   LYS  65           HD1      LYS  65  19.947   3.888   7.735
  516   1HE   LYS  65           HE2      LYS  65  19.027   5.812   9.831
  517   2HE   LYS  65           HE1      LYS  65  20.049   4.463  10.331
  518   1HZ   LYS  65           HZ3      LYS  65  21.602   5.121   8.528
  519   2HZ   LYS  65           HZ2      LYS  65  20.661   6.514   8.277
  520   3HZ   LYS  65           HZ1      LYS  65  21.452   6.275   9.762
  521    H    ASP  66           HN       ASP  66  16.651   2.171   4.031
  522    HA   ASP  66           HA       ASP  66  19.348   1.105   4.728
  523   1HB   ASP  66           HB2      ASP  66  17.035  -0.085   3.177
  524   2HB   ASP  66           HB1      ASP  66  18.620  -0.852   3.302
  525    H    THR  67           HN       THR  67  20.927   0.846   3.087
  526    HA   THR  67           HA       THR  67  20.598   2.703   0.811
  527    HB   THR  67           HB       THR  67  22.980   2.530   0.546
  528    HG1  THR  67           HG1      THR  67  24.023   0.801   1.116
  529   1HG2  THR  67          HG23      THR  67  22.207   3.862   2.476
  530   2HG2  THR  67          HG22      THR  67  22.295   2.426   3.497
  531   3HG2  THR  67          HG21      THR  67  23.767   3.108   2.805
  532    NH1  ARG  68           NH2      ARG  68  20.038  -7.130   2.200
  533    NH2  ARG  68           NH1      ARG  68  22.089  -6.785   3.084
  534    H    ARG  68           HN       ARG  68  19.466  -0.249   1.093
  535    HA   ARG  68           HA       ARG  68  20.787  -1.580  -1.155
  536   1HB   ARG  68           HB2      ARG  68  18.224  -2.266   0.320
  537   2HB   ARG  68           HB1      ARG  68  19.051  -3.310  -0.837
  538   1HG   ARG  68           HG2      ARG  68  21.118  -2.796   0.800
  539   2HG   ARG  68           HG1      ARG  68  19.802  -2.612   1.960
  540   1HD   ARG  68           HD2      ARG  68  19.029  -4.829   1.602
  541   2HD   ARG  68           HD1      ARG  68  19.981  -5.007   0.129
  542    HE   ARG  68           HE       ARG  68  21.883  -4.559   2.088
  543   1HH1  ARG  68          HH21      ARG  68  19.248  -6.812   1.679
  544   2HH1  ARG  68          HH22      ARG  68  20.043  -8.057   2.577
  545   1HH2  ARG  68          HH11      ARG  68  22.879  -6.193   3.239
  546   2HH2  ARG  68          HH12      ARG  68  22.078  -7.713   3.455
  547    H    CYS  69           HN       CYS  69  17.937   0.397  -0.611
  548    HA   CYS  69           HA       CYS  69  16.952  -0.089  -3.353
  549   1HB   CYS  69           HB2      CYS  69  15.679   0.525  -0.990
  550   2HB   CYS  69           HB1      CYS  69  15.727   2.091  -1.801
  551    H    LEU  70           HN       LEU  70  18.713   2.326  -1.514
  552    HA   LEU  70           HA       LEU  70  18.441   4.583  -3.173
  553   1HB   LEU  70           HB2      LEU  70  20.916   3.609  -1.707
  554   2HB   LEU  70           HB1      LEU  70  20.697   5.237  -2.351
  555    HG   LEU  70           HG       LEU  70  18.876   3.938  -0.305
  556   1HD1  LEU  70          HD13      LEU  70  21.419   4.821   0.165
  557   2HD1  LEU  70          HD12      LEU  70  20.496   6.303   0.415
  558   3HD1  LEU  70          HD11      LEU  70  20.124   4.862   1.362
  559   1HD2  LEU  70          HD22      LEU  70  18.901   6.531  -1.794
  560   2HD2  LEU  70          HD21      LEU  70  17.531   5.542  -1.287
  561   3HD2  LEU  70          HD23      LEU  70  18.371   6.556  -0.112
  562    H    GLY  71           HN       GLY  71  21.206   2.302  -3.321
  563   1HA   GLY  71           HA2      GLY  71  21.876   1.247  -5.431
  564   2HA   GLY  71           HA1      GLY  71  21.143   2.604  -6.287
  565    H    ALA  72           HN       ALA  72  23.013   3.260  -7.391
  566    HA   ALA  72           HA       ALA  72  25.295   4.136  -5.669
  567   1HB   ALA  72           HB1      ALA  72  25.191   3.334  -8.587
  568   2HB   ALA  72           HB3      ALA  72  26.602   4.079  -7.837
  569   3HB   ALA  72           HB2      ALA  72  26.036   2.504  -7.280
  570    H    THR  73           HN       THR  73  22.913   5.146  -8.029
  571    HA   THR  73           HA       THR  73  24.160   7.711  -8.587
  572    HB   THR  73           HB       THR  73  22.518   6.590 -10.119
  573    HG1  THR  73           HG1      THR  73  22.857   9.051  -9.671
  574   1HG2  THR  73          HG23      THR  73  20.989   6.449  -7.748
  575   2HG2  THR  73          HG22      THR  73  20.139   7.569  -8.813
  576   3HG2  THR  73          HG21      THR  73  20.505   5.934  -9.363
  577    H    ALA  74           HN       ALA  74  23.401   9.778  -7.814
  578    HA   ALA  74           HA       ALA  74  22.524   9.672  -5.007
  579   1HB   ALA  74           HB2      ALA  74  23.911  11.575  -6.743
  580   2HB   ALA  74           HB1      ALA  74  22.695  12.347  -5.724
  581   3HB   ALA  74           HB3      ALA  74  23.985  11.395  -4.990
  582    H    GLN  75           HN       GLN  75  21.123  10.336  -8.129
  583    HA   GLN  75           HA       GLN  75  18.959  12.014  -7.331
  584   1HB   GLN  75           HB2      GLN  75  18.955   9.884  -9.493
  585   2HB   GLN  75           HB1      GLN  75  17.861  11.262  -9.381
  586   1HG   GLN  75           HG2      GLN  75  19.344  12.497 -10.534
  587   2HG   GLN  75           HG1      GLN  75  20.496  12.297  -9.213
  588   1HE2  GLN  75          HE22      GLN  75  20.715   9.469 -12.203
  589   2HE2  GLN  75          HE21      GLN  75  19.190   9.989 -11.669
  590    H    GLN  76           HN       GLN  76  19.466   8.545  -7.082
  591    HA   GLN  76           HA       GLN  76  16.741   7.834  -6.503
  592   1HB   GLN  76           HB2      GLN  76  19.238   6.501  -6.734
  593   2HB   GLN  76           HB1      GLN  76  18.585   6.099  -5.144
  594   1HG   GLN  76           HG2      GLN  76  16.764   5.000  -6.014
  595   2HG   GLN  76           HG1      GLN  76  16.678   6.045  -7.432
  596   1HE2  GLN  76          HE22      GLN  76  17.957   2.651  -8.454
  597   2HE2  GLN  76          HE21      GLN  76  16.561   3.178  -7.644
  598    H    PHE  77           HN       PHE  77  19.390   9.053  -4.541
  599    HA   PHE  77           HA       PHE  77  18.264   8.426  -1.975
  600   1HB   PHE  77           HB2      PHE  77  20.654   9.365  -2.714
  601   2HB   PHE  77           HB1      PHE  77  19.888  10.908  -2.334
  602    HD1  PHE  77           HD2      PHE  77  18.338  10.714  -0.074
  603    HD2  PHE  77           HD1      PHE  77  21.845   8.400  -0.969
  604    HE1  PHE  77           HE2      PHE  77  18.674  10.286   2.346
  605    HE2  PHE  77           HE1      PHE  77  22.181   7.973   1.450
  606    HZ   PHE  77           HZ       PHE  77  20.595   8.916   3.108
  607    H    HIS  78           HN       HIS  78  18.155  11.425  -3.933
  608    HA   HIS  78           HA       HIS  78  16.494  12.884  -2.132
  609   1HB   HIS  78           HB2      HIS  78  17.624  13.289  -4.709
  610   2HB   HIS  78           HB1      HIS  78  15.895  13.613  -4.843
  611    HD1  HIS  78           HD1      HIS  78  14.903  15.395  -3.103
  612    HD2  HIS  78           HD2      HIS  78  19.063  15.244  -3.326
  613    HE1  HIS  78           HE1      HIS  78  15.758  17.504  -1.991
  614    NH1  ARG  79           NH2      ARG  79  11.880  11.614  -9.196
  615    NH2  ARG  79           NH1      ARG  79  13.523  12.288 -10.587
  616    H    ARG  79           HN       ARG  79  15.731  10.562  -4.676
  617    HA   ARG  79           HA       ARG  79  12.872  11.079  -4.605
  618   1HB   ARG  79           HB2      ARG  79  14.676   9.080  -5.885
  619   2HB   ARG  79           HB1      ARG  79  12.985   8.622  -5.674
  620   1HG   ARG  79           HG2      ARG  79  12.258  10.635  -6.847
  621   2HG   ARG  79           HG1      ARG  79  13.928  11.181  -7.003
  622   1HD   ARG  79           HD2      ARG  79  14.238   8.790  -8.112
  623   2HD   ARG  79           HD1      ARG  79  12.516   8.955  -8.434
  624    HE   ARG  79           HE       ARG  79  14.646  10.242  -9.857
  625   1HH1  ARG  79          HH21      ARG  79  11.495  10.946  -8.566
  626   2HH1  ARG  79          HH22      ARG  79  11.347  12.421  -9.448
  627   1HH2  ARG  79          HH11      ARG  79  14.412  12.136 -11.019
  628   2HH2  ARG  79          HH12      ARG  79  12.975  13.087 -10.837
  629    H    HIS  80           HN       HIS  80  15.072   9.130  -2.728
  630    HA   HIS  80           HA       HIS  80  13.029   7.349  -1.663
  631   1HB   HIS  80           HB2      HIS  80  15.777   7.304  -1.724
  632   2HB   HIS  80           HB1      HIS  80  15.462   7.765  -0.052
  633    HD1  HIS  80           HD1      HIS  80  13.500   6.160   1.129
  634    HD2  HIS  80           HD2      HIS  80  15.612   4.577  -2.099
  635    HE1  HIS  80           HE1      HIS  80  13.201   3.646   1.240
  636    H    LYS  81           HN       LYS  81  14.433  10.449  -0.755
  637    HA   LYS  81           HA       LYS  81  13.490  10.517   1.947
  638   1HB   LYS  81           HB2      LYS  81  14.769  12.319   0.107
  639   2HB   LYS  81           HB1      LYS  81  13.432  13.154   0.896
  640   1HG   LYS  81           HG2      LYS  81  14.577  11.781   2.996
  641   2HG   LYS  81           HG1      LYS  81  15.982  12.219   2.025
  642   1HD   LYS  81           HD2      LYS  81  13.957  14.355   2.397
  643   2HD   LYS  81           HD1      LYS  81  14.858  13.889   3.840
  644   1HE   LYS  81           HE2      LYS  81  16.324  14.378   1.263
  645   2HE   LYS  81           HE1      LYS  81  15.838  15.743   2.267
  646   1HZ   LYS  81           HZ1      LYS  81  17.394  13.414   3.251
  647   2HZ   LYS  81           HZ3      LYS  81  18.084  14.889   2.773
  648   3HZ   LYS  81           HZ2      LYS  81  17.034  14.836   4.108
  649    H    GLN  82           HN       GLN  82  11.953  11.306  -1.127
  650    HA   GLN  82           HA       GLN  82   9.558  12.357   0.230
  651   1HB   GLN  82           HB2      GLN  82   9.996  11.790  -2.715
  652   2HB   GLN  82           HB1      GLN  82   8.714  12.776  -2.010
  653   1HG   GLN  82           HG2      GLN  82  11.132  13.803  -0.976
  654   2HG   GLN  82           HG1      GLN  82  11.414  13.541  -2.698
  655   1HE2  GLN  82          HE22      GLN  82   8.436  16.168  -1.599
  656   2HE2  GLN  82          HE21      GLN  82   8.848  14.903  -0.544
  657    H    LEU  83           HN       LEU  83  10.695   9.313  -1.005
  658    HA   LEU  83           HA       LEU  83   8.107   8.139  -1.519
  659   1HB   LEU  83           HB2      LEU  83  10.263   7.246  -2.420
  660   2HB   LEU  83           HB1      LEU  83  10.703   6.750  -0.787
  661    HG   LEU  83           HG       LEU  83   8.401   5.517  -0.805
  662   1HD1  LEU  83          HD13      LEU  83   8.621   6.533  -3.533
  663   2HD1  LEU  83          HD12      LEU  83   8.423   4.781  -3.494
  664   3HD1  LEU  83          HD11      LEU  83   7.231   5.822  -2.715
  665   1HD2  LEU  83          HD23      LEU  83  10.771   4.539  -0.899
  666   2HD2  LEU  83          HD22      LEU  83   9.486   3.528  -1.560
  667   3HD2  LEU  83          HD21      LEU  83  10.543   4.430  -2.644
  668    H    ILE  84           HN       ILE  84  10.380   7.731   1.238
  669    HA   ILE  84           HA       ILE  84   8.699   6.126   2.840
  670    HB   ILE  84           HB       ILE  84  10.569   8.295   3.837
  671   1HG1  ILE  84          HG12      ILE  84  12.020   7.022   2.538
  672   2HG1  ILE  84          HG11      ILE  84  12.080   6.126   4.051
  673   1HG2  ILE  84          HG21      ILE  84   9.341   5.831   5.075
  674   2HG2  ILE  84          HG23      ILE  84  10.794   6.576   5.739
  675   3HG2  ILE  84          HG22      ILE  84   9.289   7.492   5.664
  676   1HD1  ILE  84          HD13      ILE  84  10.206   4.674   3.138
  677   2HD1  ILE  84          HD12      ILE  84  10.462   5.459   1.581
  678   3HD1  ILE  84          HD11      ILE  84  11.753   4.510   2.310
  679    NH1  ARG  85           NH2      ARG  85   8.713  16.543   3.546
  680    NH2  ARG  85           NH1      ARG  85   6.581  17.042   2.987
  681    H    ARG  85           HN       ARG  85   8.669   9.624   2.366
  682    HA   ARG  85           HA       ARG  85   6.861  10.216   4.519
  683   1HB   ARG  85           HB2      ARG  85   8.165  11.649   2.422
  684   2HB   ARG  85           HB1      ARG  85   6.446  12.036   2.358
  685   1HG   ARG  85           HG2      ARG  85   6.422  12.819   4.594
  686   2HG   ARG  85           HG1      ARG  85   7.969  12.058   4.963
  687   1HD   ARG  85           HD2      ARG  85   8.724  14.202   4.626
  688   2HD   ARG  85           HD1      ARG  85   8.771  13.646   2.953
  689    HE   ARG  85           HE       ARG  85   6.202  14.635   3.248
  690   1HH1  ARG  85          HH21      ARG  85   9.415  15.881   3.802
  691   2HH1  ARG  85          HH22      ARG  85   8.952  17.510   3.461
  692   1HH2  ARG  85          HH11      ARG  85   5.638  16.757   2.814
  693   2HH2  ARG  85          HH12      ARG  85   6.836  18.005   2.907
  694    H    PHE  86           HN       PHE  86   6.268   9.843   1.019
  695    HA   PHE  86           HA       PHE  86   3.467  10.087   1.050
  696   1HB   PHE  86           HB2      PHE  86   5.475   9.199  -0.785
  697   2HB   PHE  86           HB1      PHE  86   4.153   8.030  -0.805
  698    HD1  PHE  86           HD2      PHE  86   1.738   9.410  -0.460
  699    HD2  PHE  86           HD1      PHE  86   5.276  10.797  -2.461
  700    HE1  PHE  86           HE2      PHE  86   0.364  10.977  -1.802
  701    HE2  PHE  86           HE1      PHE  86   3.903  12.364  -3.803
  702    HZ   PHE  86           HZ       PHE  86   1.445  12.457  -3.474
  703    H    LEU  87           HN       LEU  87   5.477   7.350   1.974
  704    HA   LEU  87           HA       LEU  87   3.314   5.422   2.034
  705   1HB   LEU  87           HB2      LEU  87   6.008   5.193   2.096
  706   2HB   LEU  87           HB1      LEU  87   5.655   5.031   3.818
  707    HG   LEU  87           HG       LEU  87   3.958   3.491   1.903
  708   1HD1  LEU  87          HD13      LEU  87   6.880   3.154   2.268
  709   2HD1  LEU  87          HD12      LEU  87   5.920   1.684   2.428
  710   3HD1  LEU  87          HD11      LEU  87   5.842   2.628   0.941
  711   1HD2  LEU  87          HD22      LEU  87   5.049   3.171   4.701
  712   2HD2  LEU  87          HD21      LEU  87   3.365   3.251   4.184
  713   3HD2  LEU  87          HD23      LEU  87   4.325   1.813   3.840
  714    H    LYS  88           HN       LYS  88   4.932   7.385   4.533
  715    HA   LYS  88           HA       LYS  88   3.558   6.391   6.784
  716   1HB   LYS  88           HB2      LYS  88   4.496   9.220   6.221
  717   2HB   LYS  88           HB1      LYS  88   4.041   8.606   7.812
  718   1HG   LYS  88           HG2      LYS  88   5.885   7.161   7.926
  719   2HG   LYS  88           HG1      LYS  88   6.117   7.167   6.177
  720   1HD   LYS  88           HD2      LYS  88   7.862   8.541   6.993
  721   2HD   LYS  88           HD1      LYS  88   6.634   9.684   6.445
  722   1HE   LYS  88           HE2      LYS  88   5.779   9.374   8.964
  723   2HE   LYS  88           HE1      LYS  88   7.483   8.997   9.222
  724   1HZ   LYS  88           HZ3      LYS  88   8.025  11.092   8.061
  725   2HZ   LYS  88           HZ2      LYS  88   6.368  11.462   8.001
  726   3HZ   LYS  88           HZ1      LYS  88   7.159  11.334   9.499
  727    NH1  ARG  89           NH2      ARG  89  -1.913  14.122   4.888
  728    NH2  ARG  89           NH1      ARG  89  -2.073  14.346   2.646
  729    H    ARG  89           HN       ARG  89   2.583   8.891   4.453
  730    HA   ARG  89           HA       ARG  89   0.185   9.672   5.824
  731   1HB   ARG  89           HB2      ARG  89   0.953   9.777   2.894
  732   2HB   ARG  89           HB1      ARG  89  -0.513  10.509   3.547
  733   1HG   ARG  89           HG2      ARG  89   1.982  11.184   4.990
  734   2HG   ARG  89           HG1      ARG  89   1.866  11.820   3.348
  735   1HD   ARG  89           HD2      ARG  89  -0.362  12.113   5.375
  736   2HD   ARG  89           HD1      ARG  89   0.908  13.320   5.172
  737    HE   ARG  89           HE       ARG  89  -0.069  12.932   2.605
  738   1HH1  ARG  89          HH21      ARG  89  -1.456  13.760   5.698
  739   2HH1  ARG  89          HH22      ARG  89  -2.728  14.693   4.993
  740   1HH2  ARG  89          HH11      ARG  89  -1.732  14.151   1.726
  741   2HH2  ARG  89          HH12      ARG  89  -2.886  14.915   2.768
  742    H    LEU  90           HN       LEU  90   0.743   7.364   3.163
  743    HA   LEU  90           HA       LEU  90  -2.010   6.503   3.055
  744   1HB   LEU  90           HB2      LEU  90  -0.322   6.259   1.200
  745   2HB   LEU  90           HB1      LEU  90   0.428   4.965   2.134
  746    HG   LEU  90           HG       LEU  90  -2.423   4.541   2.009
  747   1HD1  LEU  90          HD11      LEU  90  -1.843   5.935  -0.164
  748   2HD1  LEU  90          HD13      LEU  90  -1.185   4.396  -0.718
  749   3HD1  LEU  90          HD12      LEU  90  -2.886   4.517  -0.269
  750   1HD2  LEU  90          HD21      LEU  90  -0.078   3.057   2.055
  751   2HD2  LEU  90          HD23      LEU  90  -1.699   2.399   1.835
  752   3HD2  LEU  90          HD22      LEU  90  -0.698   2.769   0.430
  753    H    ASP  91           HN       ASP  91   0.419   5.858   5.364
  754    HA   ASP  91           HA       ASP  91  -0.244   3.110   5.948
  755   1HB   ASP  91           HB2      ASP  91   1.723   4.835   6.774
  756   2HB   ASP  91           HB1      ASP  91   0.687   4.775   8.199
  757    NH1  ARG  92           NH2      ARG  92  -6.206   7.601  12.118
  758    NH2  ARG  92           NH1      ARG  92  -7.616   5.859  11.871
  759    H    ARG  92           HN       ARG  92  -1.306   6.223   7.320
  760    HA   ARG  92           HA       ARG  92  -3.253   4.827   9.047
  761   1HB   ARG  92           HB2      ARG  92  -1.948   6.780   9.882
  762   2HB   ARG  92           HB1      ARG  92  -2.746   7.793   8.681
  763   1HG   ARG  92           HG2      ARG  92  -3.969   8.088  10.711
  764   2HG   ARG  92           HG1      ARG  92  -4.959   7.039   9.699
  765   1HD   ARG  92           HD2      ARG  92  -3.408   5.209  11.002
  766   2HD   ARG  92           HD1      ARG  92  -3.573   6.446  12.243
  767    HE   ARG  92           HE       ARG  92  -5.575   4.567  11.491
  768   1HH1  ARG  92          HH21      ARG  92  -5.283   7.976  12.159
  769   2HH1  ARG  92          HH22      ARG  92  -6.989   8.197  12.297
  770   1HH2  ARG  92          HH11      ARG  92  -7.775   4.885  11.713
  771   2HH2  ARG  92          HH12      ARG  92  -8.388   6.467  12.057
  772    H    ASN  93           HN       ASN  93  -3.200   6.516   5.985
  773    HA   ASN  93           HA       ASN  93  -6.060   7.101   6.002
  774   1HB   ASN  93           HB2      ASN  93  -3.775   7.542   4.200
  775   2HB   ASN  93           HB1      ASN  93  -5.309   7.264   3.374
  776   1HD2  ASN  93          HD22      ASN  93  -4.817  10.921   4.497
  777   2HD2  ASN  93          HD21      ASN  93  -3.701   9.843   3.807
  778    H    LEU  94           HN       LEU  94  -4.040   4.508   4.670
  779    HA   LEU  94           HA       LEU  94  -6.075   3.384   2.994
  780   1HB   LEU  94           HB2      LEU  94  -3.435   2.878   3.334
  781   2HB   LEU  94           HB1      LEU  94  -4.127   1.511   4.207
  782    HG   LEU  94           HG       LEU  94  -5.628   1.163   2.158
  783   1HD1  LEU  94          HD11      LEU  94  -3.712   3.262   1.168
  784   2HD1  LEU  94          HD13      LEU  94  -4.381   2.073   0.051
  785   3HD1  LEU  94          HD12      LEU  94  -5.456   3.156   0.933
  786   1HD2  LEU  94          HD23      LEU  94  -3.083   0.243   2.787
  787   2HD2  LEU  94          HD22      LEU  94  -4.144  -0.439   1.555
  788   3HD2  LEU  94          HD21      LEU  94  -2.925   0.755   1.108
  789    CH2  TRP  95           CH2      TRP  95  -6.502  -0.648  13.029
  790    H    TRP  95           HN       TRP  95  -4.933   2.175   6.186
  791    HA   TRP  95           HA       TRP  95  -7.401   0.571   6.382
  792   1HB   TRP  95           HB2      TRP  95  -6.220  -0.764   7.738
  793   2HB   TRP  95           HB1      TRP  95  -4.814   0.148   7.197
  794    HD1  TRP  95           HD1      TRP  95  -4.450   2.514   8.748
  795    HE1  TRP  95           HE1      TRP  95  -4.486   2.674  11.325
  796    HE3  TRP  95           HE3      TRP  95  -7.005  -1.755   9.843
  797    HZ2  TRP  95           HZ2      TRP  95  -5.471   1.165  13.559
  798    HZ3  TRP  95           HZ3      TRP  95  -7.469  -2.380  12.192
  799    HH2  TRP  95           HH2      TRP  95  -6.709  -0.926  14.052
  800    H    GLY  96           HN       GLY  96  -6.271   3.610   7.523
  801   1HA   GLY  96           HA2      GLY  96  -7.547   3.887  10.007
  802   2HA   GLY  96           HA1      GLY  96  -7.361   5.215   8.864
  803    H    LEU  97           HN       LEU  97  -8.959   4.119   6.753
  804    HA   LEU  97           HA       LEU  97 -11.598   4.849   7.748
  805   1HB   LEU  97           HB2      LEU  97 -11.061   5.496   5.496
  806   2HB   LEU  97           HB1      LEU  97 -10.608   3.846   5.068
  807    HG   LEU  97           HG       LEU  97 -13.347   4.152   6.144
  808   1HD1  LEU  97          HD13      LEU  97 -12.778   6.182   4.563
  809   2HD1  LEU  97          HD12      LEU  97 -12.919   4.973   3.288
  810   3HD1  LEU  97          HD11      LEU  97 -14.290   5.300   4.348
  811   1HD2  LEU  97          HD21      LEU  97 -11.838   2.557   4.131
  812   2HD2  LEU  97          HD23      LEU  97 -13.040   2.031   5.310
  813   3HD2  LEU  97          HD22      LEU  97 -13.555   2.807   3.813
  814    H    ALA  98           HN       ALA  98  -9.908   1.866   6.987
  815    HA   ALA  98           HA       ALA  98 -12.021   0.039   6.781
  816   1HB   ALA  98           HB3      ALA  98  -9.511  -0.415   6.610
  817   2HB   ALA  98           HB2      ALA  98  -9.510  -0.509   8.371
  818   3HB   ALA  98           HB1      ALA  98 -10.463  -1.653   7.428
  819    H    GLY  99           HN       GLY  99 -10.497   1.293   9.745
  820   1HA   GLY  99           HA2      GLY  99 -11.380   1.458  11.919
  821   2HA   GLY  99           HA1      GLY  99 -12.962   1.083  11.236
  822    H    LEU 100           HN       LEU 100  -9.887  -0.744  11.457
  823    HA   LEU 100           HA       LEU 100 -11.470  -2.979  12.668
  824   1HB   LEU 100           HB2      LEU 100  -9.627  -2.912  10.414
  825   2HB   LEU 100           HB1      LEU 100  -9.104  -4.068  11.639
  826    HG   LEU 100           HG       LEU 100 -10.677  -5.038   9.929
  827   1HD1  LEU 100          HD13      LEU 100 -10.430  -5.915  12.285
  828   2HD1  LEU 100          HD12      LEU 100 -11.842  -4.953  12.725
  829   3HD1  LEU 100          HD11      LEU 100 -11.994  -6.256  11.546
  830   1HD2  LEU 100          HD22      LEU 100 -12.045  -2.668  10.301
  831   2HD2  LEU 100          HD21      LEU 100 -12.697  -4.099   9.501
  832   3HD2  LEU 100          HD23      LEU 100 -13.022  -3.819  11.212
  833    H    ASN 101           HN       ASN 101  -9.586  -4.570  13.696
  834    HA   ASN 101           HA       ASN 101  -7.966  -2.783  15.470
  835   1HB   ASN 101           HB2      ASN 101  -9.853  -4.954  16.084
  836   2HB   ASN 101           HB1      ASN 101  -8.298  -5.120  16.899
  837   1HD2  ASN 101          HD22      ASN 101 -10.589  -1.799  17.727
  838   2HD2  ASN 101          HD21      ASN 101 -10.773  -2.574  16.228
  839    H    SER 102           HN       SER 102  -8.023  -6.326  15.101
  840    HA   SER 102           HA       SER 102  -5.089  -6.279  14.775
  841   1HB   SER 102           HB2      SER 102  -6.161  -7.921  16.310
  842   2HB   SER 102           HB1      SER 102  -7.000  -8.631  14.934
  843    HG   SER 102           HG       SER 102  -4.402  -8.897  15.757
  844    H    CYS 103           HN       CYS 103  -4.143  -7.726  13.033
  845    HA   CYS 103           HA       CYS 103  -5.842  -8.042  10.632
  846   1HB   CYS 103           HB2      CYS 103  -4.303  -5.739  10.960
  847   2HB   CYS 103           HB1      CYS 103  -3.313  -6.768   9.926
  848    HA   PRO 104           HA       PRO 104  -2.934 -11.535  11.431
  849   1HB   PRO 104           HB2      PRO 104  -4.771 -13.083   9.810
  850   2HB   PRO 104           HB1      PRO 104  -4.408 -13.258  11.532
  851   1HG   PRO 104           HG2      PRO 104  -6.800 -12.188  10.361
  852   2HG   PRO 104           HG1      PRO 104  -6.398 -12.296  12.080
  853   1HD   PRO 104           HD2      PRO 104  -6.510  -9.928  10.439
  854   2HD   PRO 104           HD1      PRO 104  -6.102 -10.041  12.164
  855    H    VAL 105           HN       VAL 105  -1.351 -10.609  10.009
  856    HA   VAL 105           HA       VAL 105  -1.797 -11.074   7.093
  857    HB   VAL 105           HB       VAL 105   0.216  -9.572   6.831
  858   1HG1  VAL 105          HG13      VAL 105  -2.390  -8.919   7.122
  859   2HG1  VAL 105          HG12      VAL 105  -1.709  -8.007   8.470
  860   3HG1  VAL 105          HG11      VAL 105  -1.132  -7.719   6.830
  861   1HG2  VAL 105          HG23      VAL 105   0.862 -10.125   9.328
  862   2HG2  VAL 105          HG22      VAL 105   1.204  -8.524   8.671
  863   3HG2  VAL 105          HG21      VAL 105  -0.208  -8.772   9.698
  864    H    LYS 106           HN       LYS 106  -1.306 -13.380   8.480
  865    HA   LYS 106           HA       LYS 106   1.500 -13.996   7.665
  866   1HB   LYS 106           HB2      LYS 106   0.494 -13.984  10.324
  867   2HB   LYS 106           HB1      LYS 106   0.711 -15.673   9.862
  868   1HG   LYS 106           HG2      LYS 106   3.022 -15.012   9.010
  869   2HG   LYS 106           HG1      LYS 106   2.779 -13.465   9.824
  870   1HD   LYS 106           HD2      LYS 106   3.868 -14.705  11.479
  871   2HD   LYS 106           HD1      LYS 106   2.173 -14.957  11.896
  872   1HE   LYS 106           HE2      LYS 106   3.148 -17.127  11.941
  873   2HE   LYS 106           HE1      LYS 106   2.279 -17.046  10.410
  874   1HZ   LYS 106           HZ1      LYS 106   4.991 -16.079  10.287
  875   2HZ   LYS 106           HZ3      LYS 106   4.868 -17.725  10.674
  876   3HZ   LYS 106           HZ2      LYS 106   4.165 -17.136   9.244
  877    H    GLU 107           HN       GLU 107  -1.312 -14.481   6.516
  878    HA   GLU 107           HA       GLU 107  -1.091 -17.459   6.366
  879   1HB   GLU 107           HB2      GLU 107  -3.547 -17.342   5.691
  880   2HB   GLU 107           HB1      GLU 107  -3.202 -16.922   7.370
  881   1HG   GLU 107           HG2      GLU 107  -3.637 -14.675   7.046
  882   2HG   GLU 107           HG1      GLU 107  -3.165 -14.722   5.347
  883    H    ALA 108           HN       ALA 108   0.484 -17.135   4.715
  884    HA   ALA 108           HA       ALA 108  -0.606 -17.342   2.086
  885   1HB   ALA 108           HB2      ALA 108   0.793 -14.729   2.730
  886   2HB   ALA 108           HB1      ALA 108   0.300 -15.249   1.122
  887   3HB   ALA 108           HB3      ALA 108  -0.916 -14.904   2.349
  888    H    ASP 109           HN       ASP 109   1.616 -16.594   0.619
  889    HA   ASP 109           HA       ASP 109   3.852 -18.093   1.916
  890   1HB   ASP 109           HB2      ASP 109   2.340 -18.819  -0.413
  891   2HB   ASP 109           HB1      ASP 109   3.987 -18.434  -0.910
  892    H    GLN 110           HN       GLN 110   5.998 -17.565   0.891
  893    HA   GLN 110           HA       GLN 110   6.489 -14.789   0.806
  894   1HB   GLN 110           HB2      GLN 110   8.013 -17.167   0.491
  895   2HB   GLN 110           HB1      GLN 110   8.377 -16.142  -0.897
  896   1HG   GLN 110           HG2      GLN 110   9.892 -15.281   0.619
  897   2HG   GLN 110           HG1      GLN 110   8.504 -14.258   0.985
  898   1HE2  GLN 110          HE22      GLN 110   7.951 -15.694   4.188
  899   2HE2  GLN 110          HE21      GLN 110   7.314 -14.690   2.976
  900    H    SER 111           HN       SER 111   5.462 -13.447  -0.616
  901    HA   SER 111           HA       SER 111   5.466 -14.269  -3.502
  902   1HB   SER 111           HB2      SER 111   3.227 -14.011  -3.452
  903   2HB   SER 111           HB1      SER 111   3.290 -13.431  -1.791
  904    HG   SER 111           HG       SER 111   3.050 -12.049  -4.134
  905    H    THR 112           HN       THR 112   6.717 -12.983  -4.730
  906    HA   THR 112           HA       THR 112   8.313 -10.873  -3.991
  907    HB   THR 112           HB       THR 112   8.345 -10.176  -6.350
  908    HG1  THR 112           HG1      THR 112   5.882 -11.418  -6.268
  909   1HG2  THR 112          HG23      THR 112   9.177 -12.537  -5.396
  910   2HG2  THR 112          HG22      THR 112   7.985 -13.127  -6.553
  911   3HG2  THR 112          HG21      THR 112   9.321 -12.117  -7.104
  912    H    LEU 113           HN       LEU 113   7.915  -8.909  -3.114
  913    HA   LEU 113           HA       LEU 113   5.389  -7.761  -2.695
  914   1HB   LEU 113           HB2      LEU 113   7.510  -7.012  -1.591
  915   2HB   LEU 113           HB1      LEU 113   7.963  -6.210  -3.092
  916    HG   LEU 113           HG       LEU 113   5.750  -4.958  -2.956
  917   1HD1  LEU 113          HD12      LEU 113   5.826  -6.134  -0.161
  918   2HD1  LEU 113          HD11      LEU 113   4.742  -4.843  -0.679
  919   3HD1  LEU 113          HD13      LEU 113   4.604  -6.450  -1.393
  920   1HD2  LEU 113          HD21      LEU 113   8.170  -4.287  -2.015
  921   2HD2  LEU 113          HD23      LEU 113   6.767  -3.244  -1.791
  922   3HD2  LEU 113          HD22      LEU 113   7.296  -4.304  -0.486
  923    H    GLU 114           HN       GLU 114   7.398  -7.676  -5.564
  924    HA   GLU 114           HA       GLU 114   6.316  -5.424  -6.884
  925   1HB   GLU 114           HB2      GLU 114   8.239  -6.946  -7.634
  926   2HB   GLU 114           HB1      GLU 114   6.994  -8.018  -8.276
  927   1HG   GLU 114           HG2      GLU 114   6.367  -6.533  -9.929
  928   2HG   GLU 114           HG1      GLU 114   6.842  -5.119  -8.987
  929    H    ASN 115           HN       ASN 115   5.343  -8.805  -7.491
  930    HA   ASN 115           HA       ASN 115   3.020  -8.242  -8.955
  931   1HB   ASN 115           HB2      ASN 115   3.130 -10.488  -9.032
  932   2HB   ASN 115           HB1      ASN 115   4.144 -10.538  -7.589
  933   1HD2  ASN 115          HD22      ASN 115   0.090 -11.028  -7.215
  934   2HD2  ASN 115          HD21      ASN 115   0.733 -10.416  -8.662
  935    H    PHE 116           HN       PHE 116   3.402  -8.441  -5.419
  936    HA   PHE 116           HA       PHE 116   0.687  -8.332  -4.675
  937   1HB   PHE 116           HB2      PHE 116   2.193  -8.608  -2.890
  938   2HB   PHE 116           HB1      PHE 116   3.193  -7.248  -3.402
  939    HD1  PHE 116           HD1      PHE 116  -0.398  -7.887  -2.508
  940    HD2  PHE 116           HD2      PHE 116   3.015  -5.308  -2.139
  941    HE1  PHE 116           HE1      PHE 116  -1.709  -6.363  -1.052
  942    HE2  PHE 116           HE2      PHE 116   1.708  -3.785  -0.682
  943    HZ   PHE 116           HZ       PHE 116  -0.654  -4.312  -0.140
  944    H    LEU 117           HN       LEU 117   2.833  -5.472  -4.782
  945    HA   LEU 117           HA       LEU 117   0.864  -3.491  -4.620
  946   1HB   LEU 117           HB2      LEU 117   3.645  -3.620  -5.248
  947   2HB   LEU 117           HB1      LEU 117   2.868  -2.623  -6.477
  948    HG   LEU 117           HG       LEU 117   3.554  -1.219  -4.601
  949   1HD1  LEU 117          HD12      LEU 117   0.902  -1.470  -5.605
  950   2HD1  LEU 117          HD11      LEU 117   0.780  -1.074  -3.890
  951   3HD1  LEU 117          HD13      LEU 117   1.689  -0.023  -4.974
  952   1HD2  LEU 117          HD22      LEU 117   1.857  -3.123  -2.956
  953   2HD2  LEU 117          HD21      LEU 117   3.596  -2.866  -2.814
  954   3HD2  LEU 117          HD23      LEU 117   2.473  -1.582  -2.362
  955    H    GLU 118           HN       GLU 118   1.784  -5.473  -7.365
  956    HA   GLU 118           HA       GLU 118   0.622  -3.925  -9.450
  957   1HB   GLU 118           HB2      GLU 118   2.015  -6.190  -9.471
  958   2HB   GLU 118           HB1      GLU 118   0.408  -6.913  -9.495
  959   1HG   GLU 118           HG2      GLU 118   1.174  -6.595 -11.788
  960   2HG   GLU 118           HG1      GLU 118  -0.162  -5.489 -11.464
  961    NH1  ARG 119           NH2      ARG 119  -4.562 -10.075 -11.353
  962    NH2  ARG 119           NH1      ARG 119  -3.283 -11.934 -11.269
  963    H    ARG 119           HN       ARG 119  -0.797  -6.672  -7.667
  964    HA   ARG 119           HA       ARG 119  -3.449  -6.282  -8.710
  965   1HB   ARG 119           HB2      ARG 119  -2.636  -7.608  -6.104
  966   2HB   ARG 119           HB1      ARG 119  -4.152  -7.846  -6.975
  967   1HG   ARG 119           HG2      ARG 119  -1.415  -8.482  -8.118
  968   2HG   ARG 119           HG1      ARG 119  -2.478  -9.672  -7.370
  969   1HD   ARG 119           HD2      ARG 119  -4.256  -8.830  -9.072
  970   2HD   ARG 119           HD1      ARG 119  -2.881  -8.138  -9.931
  971    HE   ARG 119           HE       ARG 119  -2.142 -10.776  -9.434
  972   1HH1  ARG 119          HH21      ARG 119  -4.802  -9.165 -11.020
  973   2HH1  ARG 119          HH22      ARG 119  -5.076 -10.476 -12.112
  974   1HH2  ARG 119          HH11      ARG 119  -2.531 -12.456 -10.862
  975   2HH2  ARG 119          HH12      ARG 119  -3.807 -12.322 -12.026
  976    H    LEU 120           HN       LEU 120  -1.646  -4.546  -6.328
  977    HA   LEU 120           HA       LEU 120  -3.901  -3.706  -4.708
  978   1HB   LEU 120           HB2      LEU 120  -1.138  -3.500  -4.515
  979   2HB   LEU 120           HB1      LEU 120  -1.648  -1.838  -4.816
  980    HG   LEU 120           HG       LEU 120  -2.575  -3.676  -2.597
  981   1HD1  LEU 120          HD12      LEU 120  -0.404  -2.109  -2.637
  982   2HD1  LEU 120          HD11      LEU 120  -1.599  -0.885  -2.203
  983   3HD1  LEU 120          HD13      LEU 120  -1.380  -2.307  -1.181
  984   1HD2  LEU 120          HD21      LEU 120  -3.850  -1.302  -3.841
  985   2HD2  LEU 120          HD23      LEU 120  -4.580  -2.618  -2.921
  986   3HD2  LEU 120          HD22      LEU 120  -3.776  -1.294  -2.079
  987    H    LYS 121           HN       LYS 121  -2.094  -2.224  -7.414
  988    HA   LYS 121           HA       LYS 121  -3.723   0.170  -7.477
  989   1HB   LYS 121           HB2      LYS 121  -1.347  -0.446  -8.572
  990   2HB   LYS 121           HB1      LYS 121  -2.381  -0.800  -9.957
  991   1HG   LYS 121           HG2      LYS 121  -3.453   1.558  -9.248
  992   2HG   LYS 121           HG1      LYS 121  -1.818   1.809  -8.630
  993   1HD   LYS 121           HD2      LYS 121  -1.570   2.543 -10.823
  994   2HD   LYS 121           HD1      LYS 121  -1.114   0.846 -10.987
  995   1HE   LYS 121           HE2      LYS 121  -3.649   0.451 -11.440
  996   2HE   LYS 121           HE1      LYS 121  -3.695   2.184 -11.765
  997   1HZ   LYS 121           HZ1      LYS 121  -1.493   1.314 -13.109
  998   2HZ   LYS 121           HZ3      LYS 121  -2.616   0.066 -13.353
  999   3HZ   LYS 121           HZ2      LYS 121  -3.009   1.659 -13.795
 1000    H    THR 122           HN       THR 122  -3.625  -2.746  -9.485
 1001    HA   THR 122           HA       THR 122  -5.745  -2.195 -11.242
 1002    HB   THR 122           HB       THR 122  -6.052  -4.912 -10.640
 1003    HG1  THR 122           HG1      THR 122  -4.241  -4.574  -9.207
 1004   1HG2  THR 122          HG21      THR 122  -4.440  -3.324 -12.616
 1005   2HG2  THR 122          HG23      THR 122  -4.310  -5.083 -12.593
 1006   3HG2  THR 122          HG22      THR 122  -5.871  -4.319 -12.891
 1007    H    ILE 123           HN       ILE 123  -5.961  -3.862  -8.109
 1008    HA   ILE 123           HA       ILE 123  -8.821  -4.073  -8.086
 1009    HB   ILE 123           HB       ILE 123  -6.851  -4.025  -5.789
 1010   1HG1  ILE 123          HG12      ILE 123  -6.565  -5.783  -7.626
 1011   2HG1  ILE 123          HG11      ILE 123  -6.791  -6.409  -5.993
 1012   1HG2  ILE 123          HG21      ILE 123  -9.751  -4.884  -5.976
 1013   2HG2  ILE 123          HG23      ILE 123  -8.690  -5.340  -4.643
 1014   3HG2  ILE 123          HG22      ILE 123  -9.067  -3.640  -4.927
 1015   1HD1  ILE 123          HD13      ILE 123  -9.297  -5.945  -7.480
 1016   2HD1  ILE 123          HD12      ILE 123  -8.265  -7.203  -8.160
 1017   3HD1  ILE 123          HD11      ILE 123  -8.816  -7.321  -6.488
 1018    H    MET 124           HN       MET 124  -6.638  -1.513  -7.085
 1019    HA   MET 124           HA       MET 124  -8.612  -0.101  -5.502
 1020   1HB   MET 124           HB2      MET 124  -5.935   0.649  -6.662
 1021   2HB   MET 124           HB1      MET 124  -6.937   1.828  -5.818
 1022   1HG   MET 124           HG2      MET 124  -6.631  -0.758  -4.425
 1023   2HG   MET 124           HG1      MET 124  -5.150   0.185  -4.570
 1024   1HE   MET 124           HE3      MET 124  -5.508   2.731  -4.695
 1025   2HE   MET 124           HE2      MET 124  -6.209   3.638  -3.360
 1026   3HE   MET 124           HE1      MET 124  -4.793   2.632  -3.081
 1027    NH1  ARG 125           NH2      ARG 125  -7.301   6.459 -11.765
 1028    NH2  ARG 125           NH1      ARG 125  -5.703   5.804 -13.221
 1029    H    ARG 125           HN       ARG 125  -7.804  -0.103  -8.923
 1030    HA   ARG 125           HA       ARG 125  -9.318   2.379  -9.374
 1031   1HB   ARG 125           HB2      ARG 125  -7.240   1.744 -10.679
 1032   2HB   ARG 125           HB1      ARG 125  -8.208   0.495 -11.463
 1033   1HG   ARG 125           HG2      ARG 125  -8.470   2.272 -12.950
 1034   2HG   ARG 125           HG1      ARG 125  -9.879   2.480 -11.910
 1035   1HD   ARG 125           HD2      ARG 125  -9.101   4.606 -11.673
 1036   2HD   ARG 125           HD1      ARG 125  -7.992   3.877 -10.513
 1037    HE   ARG 125           HE       ARG 125  -6.703   3.583 -12.950
 1038   1HH1  ARG 125          HH21      ARG 125  -8.084   6.256 -11.181
 1039   2HH1  ARG 125          HH22      ARG 125  -6.955   7.396 -11.822
 1040   1HH2  ARG 125          HH11      ARG 125  -5.258   5.088 -13.759
 1041   2HH2  ARG 125          HH12      ARG 125  -5.366   6.744 -13.265
 1042    H    GLU 126           HN       GLU 126  -9.860  -1.087  -9.624
 1043    HA   GLU 126           HA       GLU 126 -12.332  -0.640 -11.174
 1044   1HB   GLU 126           HB2      GLU 126 -10.577  -2.880 -10.640
 1045   2HB   GLU 126           HB1      GLU 126 -12.256  -3.314 -10.309
 1046   1HG   GLU 126           HG2      GLU 126 -12.944  -2.628 -12.520
 1047   2HG   GLU 126           HG1      GLU 126 -11.353  -1.943 -12.854
 1048    H    LYS 127           HN       LYS 127 -11.386  -1.340  -7.857
 1049    HA   LYS 127           HA       LYS 127 -14.193  -1.820  -7.098
 1050   1HB   LYS 127           HB2      LYS 127 -11.679  -2.601  -6.045
 1051   2HB   LYS 127           HB1      LYS 127 -12.475  -1.619  -4.815
 1052   1HG   LYS 127           HG2      LYS 127 -13.211  -3.882  -4.472
 1053   2HG   LYS 127           HG1      LYS 127 -14.560  -3.017  -5.210
 1054   1HD   LYS 127           HD2      LYS 127 -13.932  -3.893  -7.423
 1055   2HD   LYS 127           HD1      LYS 127 -12.560  -4.739  -6.705
 1056   1HE   LYS 127           HE2      LYS 127 -15.048  -5.331  -5.305
 1057   2HE   LYS 127           HE1      LYS 127 -15.140  -5.757  -7.014
 1058   1HZ   LYS 127           HZ1      LYS 127 -13.073  -6.991  -6.775
 1059   2HZ   LYS 127           HZ3      LYS 127 -13.004  -6.593  -5.128
 1060   3HZ   LYS 127           HZ2      LYS 127 -14.258  -7.580  -5.711
 1061    OH   TYR 128           OH       TYR 128 -10.947   6.228 -10.367
 1062    H    TYR 128           HN       TYR 128 -11.720   0.733  -6.625
 1063    HA   TYR 128           HA       TYR 128 -13.304   2.195  -4.719
 1064   1HB   TYR 128           HB2      TYR 128 -11.669   3.795  -4.790
 1065   2HB   TYR 128           HB1      TYR 128 -10.772   2.469  -5.518
 1066    HD1  TYR 128           HD2      TYR 128 -11.507   2.246  -8.219
 1067    HD2  TYR 128           HD1      TYR 128 -11.336   5.822  -5.846
 1068    HE1  TYR 128           HE2      TYR 128 -11.218   3.602 -10.277
 1069    HE2  TYR 128           HE1      TYR 128 -11.044   7.173  -7.903
 1070    HH   TYR 128           HH       TYR 128 -11.805   6.321 -10.786
 1071    H    SER 129           HN       SER 129 -13.770   1.727  -8.084
 1072    HA   SER 129           HA       SER 129 -15.232   4.275  -8.411
 1073   1HB   SER 129           HB2      SER 129 -13.778   3.061 -10.216
 1074   2HB   SER 129           HB1      SER 129 -15.206   2.054 -10.438
 1075    HG   SER 129           HG       SER 129 -15.232   3.888 -11.803
 1076    H    LYS 130           HN       LYS 130 -16.151   1.996  -6.562
 1077    HA   LYS 130           HA       LYS 130 -18.881   1.758  -7.747
 1078   1HB   LYS 130           HB2      LYS 130 -17.344  -0.392  -7.581
 1079   2HB   LYS 130           HB1      LYS 130 -17.827  -0.346  -5.886
 1080   1HG   LYS 130           HG2      LYS 130 -20.171  -0.440  -6.483
 1081   2HG   LYS 130           HG1      LYS 130 -19.788  -0.268  -8.196
 1082   1HD   LYS 130           HD2      LYS 130 -19.089  -2.447  -8.404
 1083   2HD   LYS 130           HD1      LYS 130 -18.486  -2.522  -6.748
 1084   1HE   LYS 130           HE2      LYS 130 -21.442  -2.288  -7.260
 1085   2HE   LYS 130           HE1      LYS 130 -20.649  -3.858  -7.372
 1086   1HZ   LYS 130           HZ3      LYS 130 -19.658  -2.841  -5.072
 1087   2HZ   LYS 130           HZ2      LYS 130 -21.259  -2.274  -5.051
 1088   3HZ   LYS 130           HZ1      LYS 130 -20.946  -3.939  -5.177
 1089    H    CYS 131           HN       CYS 131 -17.693   3.706  -5.805
 1090    HA   CYS 131           HA       CYS 131 -19.412   3.047  -3.444
 1091   1HB   CYS 131           HB2      CYS 131 -16.852   3.308  -3.135
 1092   2HB   CYS 131           HB1      CYS 131 -17.136   5.027  -3.396
 1093    H    SER 132           HN       SER 132 -20.518   4.222  -5.768
 1094    HA   SER 132           HA       SER 132 -21.331   6.845  -4.638
 1095   1HB   SER 132           HB2      SER 132 -20.106   6.381  -7.346
 1096   2HB   SER 132           HB1      SER 132 -21.277   7.677  -7.119
 1097    HG   SER 132           HG       SER 132 -19.925   8.387  -5.356
 1098    H    SER 133           HN       SER 133 -23.531   6.918  -4.627
 1099    HA   SER 133           HA       SER 133 -25.046   4.868  -6.074
 1100   1HB   SER 133           HB2      SER 133 -26.974   5.738  -4.889
 1101   2HB   SER 133           HB1      SER 133 -25.633   5.633  -3.752
 1102    HG   SER 133           HG       SER 133 -27.058   7.735  -4.285
   
  Start of MODEL          20
 Raw file had 1102 H/Q atoms
  Start of MODEL   20
    1   1H    GLU   1           HT3      GLU   1 -22.483  19.885  -3.168
    2   2H    GLU   1           HT2      GLU   1 -22.540  20.787  -4.607
    3   3H    GLU   1           HT1      GLU   1 -23.843  20.836  -3.517
    4    HA   GLU   1           HA       GLU   1 -24.766  18.998  -4.336
    5   1HB   GLU   1           HB2      GLU   1 -22.649  19.634  -6.398
    6   2HB   GLU   1           HB1      GLU   1 -23.843  18.359  -6.648
    7   1HG   GLU   1           HG2      GLU   1 -25.574  20.214  -5.988
    8   2HG   GLU   1           HG1      GLU   1 -24.269  21.325  -6.410
    9    H    ALA   2           HN       ALA   2 -24.048  17.585  -2.583
   10    HA   ALA   2           HA       ALA   2 -22.495  15.314  -3.578
   11   1HB   ALA   2           HB1      ALA   2 -21.321  17.318  -1.745
   12   2HB   ALA   2           HB3      ALA   2 -21.140  15.641  -1.228
   13   3HB   ALA   2           HB2      ALA   2 -20.521  16.152  -2.799
   14    H    GLU   3           HN       GLU   3 -23.022  13.436  -2.431
   15    HA   GLU   3           HA       GLU   3 -24.889  13.820  -0.123
   16   1HB   GLU   3           HB2      GLU   3 -25.045  11.326  -1.739
   17   2HB   GLU   3           HB1      GLU   3 -26.336  12.258  -0.981
   18   1HG   GLU   3           HG2      GLU   3 -26.031  14.024  -2.720
   19   2HG   GLU   3           HG1      GLU   3 -24.837  12.993  -3.511
   20    H    ALA   4           HN       ALA   4 -24.967  11.745   1.267
   21    HA   ALA   4           HA       ALA   4 -22.195  11.043   1.936
   22   1HB   ALA   4           HB1      ALA   4 -24.681  11.185   3.332
   23   2HB   ALA   4           HB3      ALA   4 -24.086   9.530   3.463
   24   3HB   ALA   4           HB2      ALA   4 -23.078  10.875   3.997
   25    H    HIS   5           HN       HIS   5 -21.198   9.282   1.107
   26    HA   HIS   5           HA       HIS   5 -22.827   6.881   0.449
   27   1HB   HIS   5           HB2      HIS   5 -21.048   8.437  -1.421
   28   2HB   HIS   5           HB1      HIS   5 -21.293   6.707  -1.656
   29    HD1  HIS   5           HD1      HIS   5 -24.276   6.504  -0.868
   30    HD2  HIS   5           HD2      HIS   5 -22.746   9.455  -3.383
   31    HE1  HIS   5           HE1      HIS   5 -26.221   7.339  -2.257
   32    H    LYS   6           HN       LYS   6 -20.937   5.174  -0.434
   33    HA   LYS   6           HA       LYS   6 -19.135   4.963   1.903
   34   1HB   LYS   6           HB2      LYS   6 -19.841   3.048  -0.336
   35   2HB   LYS   6           HB1      LYS   6 -18.635   2.686   0.899
   36   1HG   LYS   6           HG2      LYS   6 -20.247   2.089   2.348
   37   2HG   LYS   6           HG1      LYS   6 -21.016   3.668   2.178
   38   1HD   LYS   6           HD2      LYS   6 -22.610   2.867   0.779
   39   2HD   LYS   6           HD1      LYS   6 -21.448   1.908  -0.136
   40   1HE   LYS   6           HE2      LYS   6 -21.692   0.054   1.224
   41   2HE   LYS   6           HE1      LYS   6 -22.124   1.017   2.636
   42   1HZ   LYS   6           HZ3      LYS   6 -24.104   1.521   0.819
   43   2HZ   LYS   6           HZ2      LYS   6 -23.814  -0.146   0.655
   44   3HZ   LYS   6           HZ1      LYS   6 -24.219   0.504   2.172
   45    H    CYS   7           HN       CYS   7 -18.312   7.057   0.356
   46    HA   CYS   7           HA       CYS   7 -15.615   6.381  -0.289
   47   1HB   CYS   7           HB2      CYS   7 -15.916   6.939  -2.830
   48   2HB   CYS   7           HB1      CYS   7 -16.262   5.302  -2.273
   49    H    ASP   8           HN       ASP   8 -16.083   8.347   1.232
   50    HA   ASP   8           HA       ASP   8 -16.826  10.846  -0.060
   51   1HB   ASP   8           HB2      ASP   8 -16.530   9.964   2.574
   52   2HB   ASP   8           HB1      ASP   8 -15.220  11.124   2.361
   53    H    ILE   9           HN       ILE   9 -14.747  12.544   0.956
   54    HA   ILE   9           HA       ILE   9 -12.877  12.420  -1.213
   55    HB   ILE   9           HB       ILE   9 -12.567  13.902   1.412
   56   1HG1  ILE   9          HG12      ILE   9 -13.535  15.509  -0.773
   57   2HG1  ILE   9          HG11      ILE   9 -14.607  14.125  -0.554
   58   1HG2  ILE   9          HG23      ILE   9 -11.447  14.328  -1.375
   59   2HG2  ILE   9          HG22      ILE   9 -11.294  15.490  -0.057
   60   3HG2  ILE   9          HG21      ILE   9 -10.536  13.903   0.075
   61   1HD1  ILE   9          HD11      ILE   9 -13.695  15.581   1.891
   62   2HD1  ILE   9          HD13      ILE   9 -14.917  16.352   0.881
   63   3HD1  ILE   9          HD12      ILE   9 -15.225  14.762   1.580
   64    H    THR  10           HN       THR  10 -12.956  10.706   1.771
   65    HA   THR  10           HA       THR  10 -10.128  10.451   2.228
   66    HB   THR  10           HB       THR  10 -12.437   8.634   2.983
   67    HG1  THR  10           HG1      THR  10 -10.995  10.635   4.391
   68   1HG2  THR  10          HG22      THR  10  -9.497   8.557   3.548
   69   2HG2  THR  10          HG21      THR  10 -10.614   8.060   4.820
   70   3HG2  THR  10          HG23      THR  10 -10.620   7.226   3.267
   71    H    LEU  11           HN       LEU  11 -12.445   8.101   0.836
   72    HA   LEU  11           HA       LEU  11 -10.445   6.263  -0.028
   73   1HB   LEU  11           HB2      LEU  11 -13.221   6.343   0.017
   74   2HB   LEU  11           HB1      LEU  11 -12.845   6.315  -1.704
   75    HG   LEU  11           HG       LEU  11 -11.459   4.314  -1.397
   76   1HD1  LEU  11          HD11      LEU  11 -11.565   5.134   1.358
   77   2HD1  LEU  11          HD13      LEU  11 -12.202   3.495   1.222
   78   3HD1  LEU  11          HD12      LEU  11 -10.583   3.865   0.627
   79   1HD2  LEU  11          HD21      LEU  11 -14.226   4.458  -1.228
   80   2HD2  LEU  11          HD23      LEU  11 -13.294   2.992  -1.526
   81   3HD2  LEU  11          HD22      LEU  11 -13.795   3.397   0.114
   82    H    GLN  12           HN       GLN  12 -11.617   9.215  -1.493
   83    HA   GLN  12           HA       GLN  12 -10.690   8.590  -4.169
   84   1HB   GLN  12           HB2      GLN  12 -11.421  11.161  -2.758
   85   2HB   GLN  12           HB1      GLN  12 -10.810  11.151  -4.413
   86   1HG   GLN  12           HG2      GLN  12 -12.691   9.243  -4.652
   87   2HG   GLN  12           HG1      GLN  12 -13.420  10.188  -3.353
   88   1HE2  GLN  12          HE22      GLN  12 -13.364  13.209  -5.540
   89   2HE2  GLN  12          HE21      GLN  12 -12.706  12.799  -4.030
   90    H    GLU  13           HN       GLU  13  -9.335  10.586  -1.536
   91    HA   GLU  13           HA       GLU  13  -6.884  11.173  -2.905
   92   1HB   GLU  13           HB2      GLU  13  -8.044  11.698  -0.330
   93   2HB   GLU  13           HB1      GLU  13  -6.391  11.123  -0.109
   94   1HG   GLU  13           HG2      GLU  13  -7.055  13.236  -2.157
   95   2HG   GLU  13           HG1      GLU  13  -6.722  13.658  -0.477
   96    H    ILE  14           HN       ILE  14  -7.967   8.398  -1.073
   97    HA   ILE  14           HA       ILE  14  -5.332   7.291  -0.591
   98    HB   ILE  14           HB       ILE  14  -8.135   6.485  -0.209
   99   1HG1  ILE  14          HG12      ILE  14  -6.275   5.136   1.490
  100   2HG1  ILE  14          HG11      ILE  14  -5.713   6.795   1.282
  101   1HG2  ILE  14          HG21      ILE  14  -6.031   4.430  -0.946
  102   2HG2  ILE  14          HG23      ILE  14  -7.508   4.035  -0.068
  103   3HG2  ILE  14          HG22      ILE  14  -7.606   4.674  -1.707
  104   1HD1  ILE  14          HD12      ILE  14  -8.625   6.503   1.717
  105   2HD1  ILE  14          HD11      ILE  14  -7.612   6.061   3.091
  106   3HD1  ILE  14          HD13      ILE  14  -7.497   7.677   2.394
  107    H    ILE  15           HN       ILE  15  -7.762   6.970  -3.136
  108    HA   ILE  15           HA       ILE  15  -6.463   4.824  -4.543
  109    HB   ILE  15           HB       ILE  15  -8.655   6.757  -5.056
  110   1HG1  ILE  15          HG12      ILE  15  -8.520   3.903  -5.971
  111   2HG1  ILE  15          HG11      ILE  15  -8.646   4.242  -4.245
  112   1HG2  ILE  15          HG21      ILE  15  -7.009   5.488  -7.243
  113   2HG2  ILE  15          HG23      ILE  15  -8.702   5.923  -7.481
  114   3HG2  ILE  15          HG22      ILE  15  -7.517   7.171  -7.094
  115   1HD1  ILE  15          HD12      ILE  15 -10.619   5.754  -4.816
  116   2HD1  ILE  15          HD11      ILE  15 -10.570   5.054  -6.434
  117   3HD1  ILE  15          HD13      ILE  15 -10.893   4.026  -5.038
  118    H    LYS  16           HN       LYS  16  -6.474   8.364  -5.101
  119    HA   LYS  16           HA       LYS  16  -4.697   8.385  -7.306
  120   1HB   LYS  16           HB2      LYS  16  -5.524  10.346  -5.225
  121   2HB   LYS  16           HB1      LYS  16  -4.041  10.706  -6.109
  122   1HG   LYS  16           HG2      LYS  16  -5.769  11.715  -7.388
  123   2HG   LYS  16           HG1      LYS  16  -5.385  10.221  -8.243
  124   1HD   LYS  16           HD2      LYS  16  -7.753  10.245  -8.130
  125   2HD   LYS  16           HD1      LYS  16  -7.259   9.143  -6.844
  126   1HE   LYS  16           HE2      LYS  16  -8.872  10.561  -5.831
  127   2HE   LYS  16           HE1      LYS  16  -7.317  11.194  -5.293
  128   1HZ   LYS  16           HZ3      LYS  16  -7.522  12.653  -7.399
  129   2HZ   LYS  16           HZ2      LYS  16  -9.178  12.292  -7.288
  130   3HZ   LYS  16           HZ1      LYS  16  -8.390  13.080  -6.006
  131    H    THR  17           HN       THR  17  -3.907   8.951  -3.873
  132    HA   THR  17           HA       THR  17  -1.110   9.030  -4.109
  133    HB   THR  17           HB       THR  17  -2.485   7.657  -1.803
  134    HG1  THR  17           HG1      THR  17  -2.181  10.403  -1.757
  135   1HG2  THR  17          HG23      THR  17   0.081   8.008  -2.058
  136   2HG2  THR  17          HG22      THR  17  -0.275   9.700  -1.711
  137   3HG2  THR  17          HG21      THR  17  -0.677   8.454  -0.530
  138    H    LEU  18           HN       LEU  18  -3.275   6.254  -4.040
  139    HA   LEU  18           HA       LEU  18  -1.385   4.205  -3.592
  140   1HB   LEU  18           HB2      LEU  18  -4.027   4.167  -3.996
  141   2HB   LEU  18           HB1      LEU  18  -3.521   3.741  -5.630
  142    HG   LEU  18           HG       LEU  18  -3.832   1.699  -4.332
  143   1HD1  LEU  18          HD11      LEU  18  -1.770   2.115  -5.911
  144   2HD1  LEU  18          HD13      LEU  18  -0.851   2.016  -4.409
  145   3HD1  LEU  18          HD12      LEU  18  -1.842   0.653  -4.927
  146   1HD2  LEU  18          HD23      LEU  18  -3.115   3.149  -2.167
  147   2HD2  LEU  18          HD22      LEU  18  -3.050   1.387  -2.195
  148   3HD2  LEU  18          HD21      LEU  18  -1.587   2.328  -2.485
  149    H    ASN  19           HN       ASN  19  -2.617   5.240  -6.801
  150    HA   ASN  19           HA       ASN  19  -0.718   3.821  -8.329
  151   1HB   ASN  19           HB2      ASN  19  -2.564   4.782  -9.483
  152   2HB   ASN  19           HB1      ASN  19  -2.195   6.399  -8.880
  153   1HD2  ASN  19          HD22      ASN  19   0.455   4.910 -11.662
  154   2HD2  ASN  19          HD21      ASN  19  -0.120   3.883 -10.439
  155    H    SER  20           HN       SER  20  -0.343   6.835  -6.572
  156    HA   SER  20           HA       SER  20   2.000   7.780  -7.927
  157   1HB   SER  20           HB2      SER  20   0.586   9.084  -6.275
  158   2HB   SER  20           HB1      SER  20   1.367   8.165  -4.991
  159    HG   SER  20           HG       SER  20   2.264  10.312  -6.263
  160    H    LEU  21           HN       LEU  21   1.617   5.621  -5.107
  161    HA   LEU  21           HA       LEU  21   4.464   5.348  -4.678
  162   1HB   LEU  21           HB2      LEU  21   2.018   3.895  -3.728
  163   2HB   LEU  21           HB1      LEU  21   3.603   3.161  -3.477
  164    HG   LEU  21           HG       LEU  21   3.755   5.945  -2.792
  165   1HD1  LEU  21          HD13      LEU  21   1.414   4.404  -1.674
  166   2HD1  LEU  21          HD12      LEU  21   2.189   5.688  -0.746
  167   3HD1  LEU  21          HD11      LEU  21   1.446   6.051  -2.304
  168   1HD2  LEU  21          HD21      LEU  21   5.132   3.950  -2.001
  169   2HD2  LEU  21          HD23      LEU  21   4.622   5.066  -0.734
  170   3HD2  LEU  21          HD22      LEU  21   3.774   3.537  -0.955
  171    H    THR  22           HN       THR  22   2.282   3.957  -6.980
  172    HA   THR  22           HA       THR  22   3.978   1.610  -7.471
  173    HB   THR  22           HB       THR  22   1.811   2.543  -9.331
  174    HG1  THR  22           HG1      THR  22   0.496   1.163  -7.801
  175   1HG2  THR  22          HG22      THR  22   3.406   0.408  -9.455
  176   2HG2  THR  22          HG21      THR  22   2.190  -0.255  -8.363
  177   3HG2  THR  22          HG23      THR  22   1.719   0.327  -9.960
  178    H    GLU  23           HN       GLU  23   4.551   4.761  -8.107
  179    HA   GLU  23           HA       GLU  23   5.129   4.713 -10.937
  180   1HB   GLU  23           HB2      GLU  23   5.198   6.622  -8.830
  181   2HB   GLU  23           HB1      GLU  23   6.814   6.574  -9.536
  182   1HG   GLU  23           HG2      GLU  23   5.999   7.087 -11.710
  183   2HG   GLU  23           HG1      GLU  23   4.333   6.735 -11.251
  184    H    GLN  24           HN       GLN  24   6.874   3.738  -8.058
  185    HA   GLN  24           HA       GLN  24   9.175   2.954  -9.807
  186   1HB   GLN  24           HB2      GLN  24   9.495   4.825  -7.994
  187   2HB   GLN  24           HB1      GLN  24   9.495   3.468  -6.866
  188   1HG   GLN  24           HG2      GLN  24  11.176   2.564  -8.851
  189   2HG   GLN  24           HG1      GLN  24  11.550   4.288  -8.807
  190   1HE2  GLN  24          HE22      GLN  24  12.280   3.937  -5.134
  191   2HE2  GLN  24          HE21      GLN  24  11.109   4.785  -6.022
  192    H    LYS  25           HN       LYS  25   7.797   0.954  -9.992
  193    HA   LYS  25           HA       LYS  25   8.131  -0.790  -7.585
  194   1HB   LYS  25           HB2      LYS  25   6.238  -2.140  -8.630
  195   2HB   LYS  25           HB1      LYS  25   5.785  -0.548  -8.015
  196   1HG   LYS  25           HG2      LYS  25   5.439   0.318 -10.113
  197   2HG   LYS  25           HG1      LYS  25   6.695  -0.678 -10.847
  198   1HD   LYS  25           HD2      LYS  25   5.286  -2.524 -11.074
  199   2HD   LYS  25           HD1      LYS  25   4.204  -1.982  -9.790
  200   1HE   LYS  25           HE2      LYS  25   2.880  -1.019 -11.331
  201   2HE   LYS  25           HE1      LYS  25   4.213   0.038 -11.797
  202   1HZ   LYS  25           HZ3      LYS  25   3.985  -2.735 -12.803
  203   2HZ   LYS  25           HZ2      LYS  25   3.233  -1.430 -13.589
  204   3HZ   LYS  25           HZ1      LYS  25   4.924  -1.464 -13.422
  205    H    THR  26           HN       THR  26  10.317  -1.291  -8.404
  206    HA   THR  26           HA       THR  26  10.366  -3.701  -9.959
  207    HB   THR  26           HB       THR  26  12.009  -2.138 -11.626
  208    HG1  THR  26           HG1      THR  26  10.395  -0.647 -12.399
  209   1HG2  THR  26          HG21      THR  26  10.543  -4.175 -12.100
  210   2HG2  THR  26          HG23      THR  26   9.198  -3.045 -12.256
  211   3HG2  THR  26          HG22      THR  26  10.575  -2.933 -13.352
  212    H    LEU  27           HN       LEU  27  12.240  -0.845  -8.963
  213    HA   LEU  27           HA       LEU  27  14.709  -2.395  -8.745
  214   1HB   LEU  27           HB2      LEU  27  14.447   0.151  -9.228
  215   2HB   LEU  27           HB1      LEU  27  14.255   0.302  -7.481
  216    HG   LEU  27           HG       LEU  27  16.414  -0.997  -7.229
  217   1HD1  LEU  27          HD13      LEU  27  16.036  -1.275 -10.046
  218   2HD1  LEU  27          HD12      LEU  27  17.503  -0.331  -9.792
  219   3HD1  LEU  27          HD11      LEU  27  17.342  -1.925  -9.056
  220   1HD2  LEU  27          HD22      LEU  27  16.191   1.536  -7.147
  221   2HD2  LEU  27          HD21      LEU  27  17.793   0.942  -7.584
  222   3HD2  LEU  27          HD23      LEU  27  16.710   1.557  -8.832
  223    H    CYS  28           HN       CYS  28  12.508  -0.821  -6.418
  224    HA   CYS  28           HA       CYS  28  13.811  -2.286  -4.206
  225   1HB   CYS  28           HB2      CYS  28  12.934   0.191  -4.191
  226   2HB   CYS  28           HB1      CYS  28  11.372  -0.565  -3.871
  227    H    THR  29           HN       THR  29  10.964  -2.512  -6.206
  228    HA   THR  29           HA       THR  29   9.581  -4.284  -4.319
  229    HB   THR  29           HB       THR  29   7.844  -4.407  -6.039
  230    HG1  THR  29           HG1      THR  29   9.945  -3.669  -7.592
  231   1HG2  THR  29          HG22      THR  29   8.066  -2.376  -4.553
  232   2HG2  THR  29          HG21      THR  29   8.903  -1.577  -5.883
  233   3HG2  THR  29          HG23      THR  29   7.223  -2.081  -6.073
  234    H    GLU  30           HN       GLU  30  12.248  -4.895  -6.039
  235    HA   GLU  30           HA       GLU  30  11.311  -7.428  -7.260
  236   1HB   GLU  30           HB2      GLU  30  13.562  -5.621  -7.652
  237   2HB   GLU  30           HB1      GLU  30  14.099  -7.293  -7.484
  238   1HG   GLU  30           HG2      GLU  30  11.714  -6.911  -9.190
  239   2HG   GLU  30           HG1      GLU  30  13.207  -6.218  -9.824
  240    H    LEU  31           HN       LEU  31  11.794  -6.706  -4.192
  241    HA   LEU  31           HA       LEU  31  13.645  -8.930  -3.591
  242   1HB   LEU  31           HB2      LEU  31  12.318  -6.800  -1.900
  243   2HB   LEU  31           HB1      LEU  31  13.166  -8.171  -1.180
  244    HG   LEU  31           HG       LEU  31  14.559  -6.631  -3.332
  245   1HD1  LEU  31          HD13      LEU  31  13.493  -5.033  -1.581
  246   2HD1  LEU  31          HD12      LEU  31  14.678  -5.711  -0.464
  247   3HD1  LEU  31          HD11      LEU  31  15.217  -4.867  -1.917
  248   1HD2  LEU  31          HD21      LEU  31  15.173  -8.485  -1.126
  249   2HD2  LEU  31          HD23      LEU  31  16.041  -8.207  -2.636
  250   3HD2  LEU  31          HD22      LEU  31  16.299  -7.134  -1.260
  251    H    THR  32           HN       THR  32  11.131  -8.595  -1.237
  252    HA   THR  32           HA       THR  32   9.160 -10.256  -2.500
  253    HB   THR  32           HB       THR  32   9.779 -12.176  -0.685
  254    HG1  THR  32           HG1      THR  32  12.213 -12.294  -1.384
  255   1HG2  THR  32          HG22      THR  32   9.645 -11.946  -3.428
  256   2HG2  THR  32          HG21      THR  32  11.307 -12.481  -3.179
  257   3HG2  THR  32          HG23      THR  32   9.968 -13.444  -2.556
  258    H    VAL  33           HN       VAL  33   7.351 -10.588  -1.130
  259    HA   VAL  33           HA       VAL  33   7.535  -9.649   1.673
  260    HB   VAL  33           HB       VAL  33   5.592  -8.111   1.312
  261   1HG1  VAL  33          HG13      VAL  33   7.940  -7.284   1.325
  262   2HG1  VAL  33          HG12      VAL  33   8.001  -7.498  -0.425
  263   3HG1  VAL  33          HG11      VAL  33   6.896  -6.319   0.281
  264   1HG2  VAL  33          HG23      VAL  33   5.164  -9.435  -0.983
  265   2HG2  VAL  33          HG22      VAL  33   4.653  -7.762  -0.769
  266   3HG2  VAL  33          HG21      VAL  33   6.155  -8.124  -1.619
  267    H    THR  34           HN       THR  34   4.844  -9.636   2.288
  268    HA   THR  34           HA       THR  34   4.203 -12.492   2.030
  269    HB   THR  34           HB       THR  34   3.602 -10.376   3.879
  270    HG1  THR  34           HG1      THR  34   4.246 -12.319   4.615
  271   1HG2  THR  34          HG23      THR  34   1.170 -11.828   2.802
  272   2HG2  THR  34          HG22      THR  34   1.204 -10.851   4.263
  273   3HG2  THR  34          HG21      THR  34   1.476 -10.097   2.695
  274    H    ASP  35           HN       ASP  35   2.607 -13.330   0.722
  275    HA   ASP  35           HA       ASP  35   1.296 -11.444  -1.150
  276   1HB   ASP  35           HB2      ASP  35   1.637 -13.123  -2.607
  277   2HB   ASP  35           HB1      ASP  35   2.229 -14.163  -1.312
  278    H    ILE  36           HN       ILE  36  -0.774 -10.823  -0.830
  279    HA   ILE  36           HA       ILE  36  -2.448 -12.469   1.025
  280    HB   ILE  36           HB       ILE  36  -3.329 -10.515   1.974
  281   1HG1  ILE  36          HG12      ILE  36  -2.449  -9.209  -0.603
  282   2HG1  ILE  36          HG11      ILE  36  -4.066  -9.276   0.097
  283   1HG2  ILE  36          HG23      ILE  36  -0.834 -10.835   2.383
  284   2HG2  ILE  36          HG22      ILE  36  -0.558  -9.583   1.171
  285   3HG2  ILE  36          HG21      ILE  36  -1.435  -9.199   2.653
  286   1HD1  ILE  36          HD13      ILE  36  -3.082  -7.927   2.058
  287   2HD1  ILE  36          HD12      ILE  36  -1.715  -7.609   0.990
  288   3HD1  ILE  36          HD11      ILE  36  -3.332  -7.069   0.538
  289    H    PHE  37           HN       PHE  37  -2.150 -12.373  -2.059
  290    HA   PHE  37           HA       PHE  37  -5.057 -11.931  -2.611
  291   1HB   PHE  37           HB2      PHE  37  -2.680 -11.450  -4.432
  292   2HB   PHE  37           HB1      PHE  37  -4.363 -11.385  -4.956
  293    HD1  PHE  37           HD2      PHE  37  -5.921  -9.701  -3.935
  294    HD2  PHE  37           HD1      PHE  37  -1.684  -9.640  -3.225
  295    HE1  PHE  37           HE2      PHE  37  -6.089  -7.362  -3.133
  296    HE2  PHE  37           HE1      PHE  37  -1.854  -7.300  -2.423
  297    HZ   PHE  37           HZ       PHE  37  -4.056  -6.163  -2.375
  298    H    ALA  38           HN       ALA  38  -3.642 -14.396  -1.760
  299    HA   ALA  38           HA       ALA  38  -3.412 -16.085  -4.126
  300   1HB   ALA  38           HB2      ALA  38  -2.208 -16.424  -1.887
  301   2HB   ALA  38           HB1      ALA  38  -3.748 -17.026  -1.272
  302   3HB   ALA  38           HB3      ALA  38  -2.943 -17.860  -2.601
  303    H    ALA  39           HN       ALA  39  -5.873 -15.411  -1.685
  304    HA   ALA  39           HA       ALA  39  -7.921 -16.550  -3.462
  305   1HB   ALA  39           HB2      ALA  39  -7.036 -17.849  -0.924
  306   2HB   ALA  39           HB1      ALA  39  -8.769 -17.804  -1.250
  307   3HB   ALA  39           HB3      ALA  39  -7.676 -18.580  -2.396
  308    H    SER  40           HN       SER  40  -9.168 -14.708  -3.503
  309    HA   SER  40           HA       SER  40 -10.067 -13.646  -0.857
  310   1HB   SER  40           HB2      SER  40 -10.010 -11.390  -1.744
  311   2HB   SER  40           HB1      SER  40  -8.427 -12.120  -1.993
  312    HG   SER  40           HG       SER  40 -10.401 -11.419  -3.820
  313    H    LYS  41           HN       LYS  41 -12.131 -14.469  -0.805
  314    HA   LYS  41           HA       LYS  41 -13.940 -13.653  -3.030
  315   1HB   LYS  41           HB2      LYS  41 -13.157 -16.175  -3.010
  316   2HB   LYS  41           HB1      LYS  41 -14.332 -16.317  -1.702
  317   1HG   LYS  41           HG2      LYS  41 -15.458 -14.790  -3.881
  318   2HG   LYS  41           HG1      LYS  41 -14.865 -16.342  -4.472
  319   1HD   LYS  41           HD2      LYS  41 -16.429 -16.304  -1.920
  320   2HD   LYS  41           HD1      LYS  41 -17.303 -16.122  -3.441
  321   1HE   LYS  41           HE2      LYS  41 -15.635 -18.191  -4.057
  322   2HE   LYS  41           HE1      LYS  41 -15.911 -18.486  -2.340
  323   1HZ   LYS  41           HZ3      LYS  41 -18.330 -18.219  -2.824
  324   2HZ   LYS  41           HZ2      LYS  41 -17.947 -18.224  -4.479
  325   3HZ   LYS  41           HZ1      LYS  41 -17.616 -19.589  -3.522
  326    H    ASP  42           HN       ASP  42 -13.385 -12.723  -0.193
  327    HA   ASP  42           HA       ASP  42 -16.108 -12.245   0.573
  328   1HB   ASP  42           HB2      ASP  42 -15.043 -14.743   1.434
  329   2HB   ASP  42           HB1      ASP  42 -15.134 -13.698   2.852
  330    H    THR  43           HN       THR  43 -13.618 -10.788   0.216
  331    HA   THR  43           HA       THR  43 -13.206  -9.782   3.004
  332    HB   THR  43           HB       THR  43 -11.092  -8.777   1.570
  333    HG1  THR  43           HG1      THR  43 -11.154  -9.904  -0.221
  334   1HG2  THR  43          HG22      THR  43 -11.035  -9.910   3.777
  335   2HG2  THR  43          HG21      THR  43 -11.213 -11.465   2.966
  336   3HG2  THR  43          HG23      THR  43  -9.763 -10.495   2.704
  337    H    THR  44           HN       THR  44 -13.287  -7.506   3.300
  338    HA   THR  44           HA       THR  44 -14.558  -6.048   1.038
  339    HB   THR  44           HB       THR  44 -14.616  -4.517   3.443
  340    HG1  THR  44           HG1      THR  44 -15.840  -6.997   3.864
  341   1HG2  THR  44          HG23      THR  44 -16.250  -4.702   1.463
  342   2HG2  THR  44          HG22      THR  44 -16.894  -6.122   2.286
  343   3HG2  THR  44          HG21      THR  44 -16.954  -4.545   3.072
  344    H    GLU  45           HN       GLU  45 -14.008  -3.579   1.136
  345    HA   GLU  45           HA       GLU  45 -11.222  -3.315   0.564
  346   1HB   GLU  45           HB2      GLU  45 -11.726  -0.818   0.664
  347   2HB   GLU  45           HB1      GLU  45 -12.723  -1.749  -0.452
  348   1HG   GLU  45           HG2      GLU  45 -13.974  -1.801   2.123
  349   2HG   GLU  45           HG1      GLU  45 -13.584  -0.127   1.727
  350    H    LYS  46           HN       LYS  46 -13.078  -2.885   3.514
  351    HA   LYS  46           HA       LYS  46 -11.049  -1.444   4.967
  352   1HB   LYS  46           HB2      LYS  46 -12.345  -2.058   6.968
  353   2HB   LYS  46           HB1      LYS  46 -13.413  -1.494   5.684
  354   1HG   LYS  46           HG2      LYS  46 -13.526  -4.051   5.052
  355   2HG   LYS  46           HG1      LYS  46 -13.016  -4.282   6.724
  356   1HD   LYS  46           HD2      LYS  46 -15.361  -4.275   6.890
  357   2HD   LYS  46           HD1      LYS  46 -14.935  -2.612   7.293
  358   1HE   LYS  46           HE2      LYS  46 -15.138  -2.419   4.589
  359   2HE   LYS  46           HE1      LYS  46 -16.329  -3.681   4.906
  360   1HZ   LYS  46           HZ3      LYS  46 -17.017  -2.033   6.802
  361   2HZ   LYS  46           HZ2      LYS  46 -16.299  -0.884   5.777
  362   3HZ   LYS  46           HZ1      LYS  46 -17.595  -1.831   5.221
  363    H    GLU  47           HN       GLU  47 -11.803  -4.901   4.612
  364    HA   GLU  47           HA       GLU  47  -9.822  -5.805   6.502
  365   1HB   GLU  47           HB2      GLU  47 -11.832  -6.993   4.987
  366   2HB   GLU  47           HB1      GLU  47 -10.350  -7.638   4.281
  367   1HG   GLU  47           HG2      GLU  47 -10.736  -9.146   6.020
  368   2HG   GLU  47           HG1      GLU  47  -9.641  -7.995   6.784
  369    H    THR  48           HN       THR  48  -9.788  -5.082   3.044
  370    HA   THR  48           HA       THR  48  -7.120  -6.141   2.603
  371    HB   THR  48           HB       THR  48  -8.826  -4.216   1.000
  372    HG1  THR  48           HG1      THR  48  -8.181  -6.710   0.053
  373   1HG2  THR  48          HG21      THR  48  -6.143  -5.484   0.422
  374   2HG2  THR  48          HG23      THR  48  -7.196  -4.864  -0.849
  375   3HG2  THR  48          HG22      THR  48  -6.563  -3.770   0.381
  376    H    PHE  49           HN       PHE  49  -8.378  -3.091   3.786
  377    HA   PHE  49           HA       PHE  49  -5.969  -1.578   3.181
  378   1HB   PHE  49           HB2      PHE  49  -8.161  -1.027   5.197
  379   2HB   PHE  49           HB1      PHE  49  -6.868   0.085   4.782
  380    HD1  PHE  49           HD2      PHE  49  -6.759  -0.444   1.780
  381    HD2  PHE  49           HD1      PHE  49 -10.047   0.187   4.472
  382    HE1  PHE  49           HE2      PHE  49  -8.125   0.440  -0.089
  383    HE2  PHE  49           HE1      PHE  49 -11.411   1.065   2.602
  384    HZ   PHE  49           HZ       PHE  49 -10.451   1.199   0.325
  385    H    CYS  50           HN       CYS  50  -7.254  -3.090   6.155
  386    HA   CYS  50           HA       CYS  50  -5.019  -2.304   7.775
  387   1HB   CYS  50           HB2      CYS  50  -7.207  -3.016   8.708
  388   2HB   CYS  50           HB1      CYS  50  -6.892  -4.662   8.157
  389    NH1  ARG  51           NH2      ARG  51  -8.513 -10.189   6.645
  390    NH2  ARG  51           NH1      ARG  51  -8.024 -10.575   8.816
  391    H    ARG  51           HN       ARG  51  -5.749  -5.441   6.176
  392    HA   ARG  51           HA       ARG  51  -3.368  -6.753   7.021
  393   1HB   ARG  51           HB2      ARG  51  -5.470  -7.207   5.054
  394   2HB   ARG  51           HB1      ARG  51  -3.896  -7.732   4.454
  395   1HG   ARG  51           HG2      ARG  51  -3.772  -9.447   5.932
  396   2HG   ARG  51           HG1      ARG  51  -4.388  -8.462   7.259
  397   1HD   ARG  51           HD2      ARG  51  -6.616  -8.705   5.674
  398   2HD   ARG  51           HD1      ARG  51  -5.834 -10.265   5.432
  399    HE   ARG  51           HE       ARG  51  -5.761  -9.879   8.182
  400   1HH1  ARG  51          HH21      ARG  51  -8.240  -9.910   5.726
  401   2HH1  ARG  51          HH22      ARG  51  -9.458 -10.462   6.820
  402   1HH2  ARG  51          HH11      ARG  51  -7.369 -10.592   9.570
  403   2HH2  ARG  51          HH12      ARG  51  -8.975 -10.844   8.973
  404    H    ALA  52           HN       ALA  52  -4.016  -5.103   3.910
  405    HA   ALA  52           HA       ALA  52  -1.300  -5.235   3.010
  406   1HB   ALA  52           HB3      ALA  52  -3.300  -4.763   1.565
  407   2HB   ALA  52           HB2      ALA  52  -3.369  -3.151   2.279
  408   3HB   ALA  52           HB1      ALA  52  -1.965  -3.635   1.326
  409    H    ALA  53           HN       ALA  53  -2.810  -3.267   5.409
  410    HA   ALA  53           HA       ALA  53  -0.967  -1.022   5.171
  411   1HB   ALA  53           HB3      ALA  53  -3.127  -1.859   7.062
  412   2HB   ALA  53           HB2      ALA  53  -1.915  -0.723   7.655
  413   3HB   ALA  53           HB1      ALA  53  -2.890  -0.314   6.243
  414    H    THR  54           HN       THR  54  -1.113  -4.060   6.941
  415    HA   THR  54           HA       THR  54   1.066  -3.445   8.750
  416    HB   THR  54           HB       THR  54  -0.248  -6.019   7.854
  417    HG1  THR  54           HG1      THR  54  -0.024  -4.861  10.421
  418   1HG2  THR  54          HG22      THR  54   2.162  -5.610   9.629
  419   2HG2  THR  54          HG21      THR  54   1.148  -7.049   9.732
  420   3HG2  THR  54          HG23      THR  54   2.008  -6.682   8.238
  421    H    VAL  55           HN       VAL  55   0.795  -5.248   5.682
  422    HA   VAL  55           HA       VAL  55   3.594  -5.849   5.467
  423    HB   VAL  55           HB       VAL  55   1.419  -5.541   3.369
  424   1HG1  VAL  55          HG12      VAL  55   4.300  -6.461   3.114
  425   2HG1  VAL  55          HG11      VAL  55   3.063  -6.777   1.896
  426   3HG1  VAL  55          HG13      VAL  55   3.531  -5.118   2.268
  427   1HG2  VAL  55          HG22      VAL  55   1.642  -7.459   5.236
  428   2HG2  VAL  55          HG21      VAL  55   1.102  -7.819   3.595
  429   3HG2  VAL  55          HG23      VAL  55   2.779  -8.114   4.056
  430    H    LEU  56           HN       LEU  56   1.636  -3.059   4.614
  431    HA   LEU  56           HA       LEU  56   3.646  -1.676   3.076
  432   1HB   LEU  56           HB2      LEU  56   0.976  -1.123   4.143
  433   2HB   LEU  56           HB1      LEU  56   2.039   0.281   4.238
  434    HG   LEU  56           HG       LEU  56   2.633  -0.129   1.809
  435   1HD1  LEU  56          HD11      LEU  56   1.588  -2.563   2.100
  436   2HD1  LEU  56          HD13      LEU  56   0.117  -1.733   1.592
  437   3HD1  LEU  56          HD12      LEU  56   1.538  -1.730   0.547
  438   1HD2  LEU  56          HD22      LEU  56   0.249   0.989   2.983
  439   2HD2  LEU  56          HD21      LEU  56   1.133   1.537   1.559
  440   3HD2  LEU  56          HD23      LEU  56  -0.138   0.325   1.396
  441    NH1  ARG  57           NH2      ARG  57   1.676   2.938  10.894
  442    NH2  ARG  57           NH1      ARG  57   3.505   4.145  11.443
  443    H    ARG  57           HN       ARG  57   2.951  -2.001   6.498
  444    HA   ARG  57           HA       ARG  57   4.614   0.226   7.334
  445   1HB   ARG  57           HB2      ARG  57   2.706  -0.942   8.644
  446   2HB   ARG  57           HB1      ARG  57   3.918  -2.158   9.047
  447   1HG   ARG  57           HG2      ARG  57   4.713  -0.820  10.669
  448   2HG   ARG  57           HG1      ARG  57   5.097   0.406   9.460
  449   1HD   ARG  57           HD2      ARG  57   2.456   0.833   9.628
  450   2HD   ARG  57           HD1      ARG  57   2.721   0.187  11.248
  451    HE   ARG  57           HE       ARG  57   4.723   2.073  10.962
  452   1HH1  ARG  57          HH21      ARG  57   1.250   2.085  10.598
  453   2HH1  ARG  57          HH22      ARG  57   1.106   3.741  11.069
  454   1HH2  ARG  57          HH11      ARG  57   4.495   4.215  11.567
  455   2HH2  ARG  57          HH12      ARG  57   2.922   4.939  11.614
  456    H    GLN  58           HN       GLN  58   5.140  -3.174   6.624
  457    HA   GLN  58           HA       GLN  58   7.760  -3.270   7.903
  458   1HB   GLN  58           HB2      GLN  58   6.196  -5.259   7.369
  459   2HB   GLN  58           HB1      GLN  58   6.818  -5.133   5.722
  460   1HG   GLN  58           HG2      GLN  58   9.018  -5.008   7.571
  461   2HG   GLN  58           HG1      GLN  58   8.037  -6.428   7.933
  462   1HE2  GLN  58          HE22      GLN  58   8.786  -8.064   4.849
  463   2HE2  GLN  58          HE21      GLN  58   7.703  -8.010   6.155
  464    H    PHE  59           HN       PHE  59   6.519  -2.436   4.727
  465    HA   PHE  59           HA       PHE  59   9.192  -2.468   3.502
  466   1HB   PHE  59           HB2      PHE  59   7.839  -2.803   1.725
  467   2HB   PHE  59           HB1      PHE  59   6.424  -2.223   2.600
  468    HD1  PHE  59           HD1      PHE  59   9.525  -1.003   0.890
  469    HD2  PHE  59           HD2      PHE  59   5.485  -0.135   2.066
  470    HE1  PHE  59           HE1      PHE  59   9.606   1.116  -0.394
  471    HE2  PHE  59           HE2      PHE  59   5.569   1.985   0.784
  472    HZ   PHE  59           HZ       PHE  59   7.628   2.611  -0.445
  473    OH   TYR  60           OH       TYR  60   6.921   5.471   9.876
  474    H    TYR  60           HN       TYR  60   7.046  -0.121   4.983
  475    HA   TYR  60           HA       TYR  60   8.715   2.129   4.044
  476   1HB   TYR  60           HB2      TYR  60   6.729   3.171   4.192
  477   2HB   TYR  60           HB1      TYR  60   6.022   1.800   5.046
  478    HD1  TYR  60           HD2      TYR  60   6.093   1.668   7.509
  479    HD2  TYR  60           HD1      TYR  60   7.646   5.071   5.394
  480    HE1  TYR  60           HE2      TYR  60   6.128   2.966   9.620
  481    HE2  TYR  60           HE1      TYR  60   7.679   6.369   7.508
  482    HH   TYR  60           HH       TYR  60   6.301   6.199   9.786
  483    H    SER  61           HN       SER  61   8.488   0.057   6.812
  484    HA   SER  61           HA       SER  61   9.810   2.022   8.573
  485   1HB   SER  61           HB2      SER  61   8.009   0.355   9.329
  486   2HB   SER  61           HB1      SER  61   9.262  -0.878   9.213
  487    HG   SER  61           HG       SER  61  10.193  -0.085  10.937
  488    H    HIS  62           HN       HIS  62  10.563  -1.235   7.269
  489    HA   HIS  62           HA       HIS  62  13.356  -0.921   8.164
  490   1HB   HIS  62           HB2      HIS  62  11.612  -3.122   7.452
  491   2HB   HIS  62           HB1      HIS  62  13.144  -3.237   6.585
  492    HD1  HIS  62           HD1      HIS  62  15.102  -2.137   8.631
  493    HD2  HIS  62           HD2      HIS  62  12.026  -4.760   9.651
  494    HE1  HIS  62           HE1      HIS  62  15.792  -3.240  10.806
  495    H    HIS  63           HN       HIS  63  11.691  -1.463   5.035
  496    HA   HIS  63           HA       HIS  63  14.059  -1.180   3.458
  497   1HB   HIS  63           HB2      HIS  63  11.208  -1.459   3.007
  498   2HB   HIS  63           HB1      HIS  63  11.920  -0.314   1.869
  499    HD1  HIS  63           HD1      HIS  63  14.726  -1.635   1.591
  500    HD2  HIS  63           HD2      HIS  63  11.126  -3.728   1.396
  501    HE1  HIS  63           HE1      HIS  63  15.204  -3.766   0.308
  502    H    GLU  64           HN       GLU  64  12.172   1.199   5.110
  503    HA   GLU  64           HA       GLU  64  12.630   3.428   3.363
  504   1HB   GLU  64           HB2      GLU  64  11.048   3.996   4.922
  505   2HB   GLU  64           HB1      GLU  64  11.815   3.053   6.199
  506   1HG   GLU  64           HG2      GLU  64  13.470   4.733   6.583
  507   2HG   GLU  64           HG1      GLU  64  13.043   5.589   5.100
  508    H    LYS  65           HN       LYS  65  14.634   1.840   5.771
  509    HA   LYS  65           HA       LYS  65  16.748   3.881   5.208
  510   1HB   LYS  65           HB2      LYS  65  17.454   2.553   7.580
  511   2HB   LYS  65           HB1      LYS  65  16.867   4.207   7.427
  512   1HG   LYS  65           HG2      LYS  65  14.536   3.383   7.589
  513   2HG   LYS  65           HG1      LYS  65  15.143   1.737   7.784
  514   1HD   LYS  65           HD2      LYS  65  16.568   2.857   9.726
  515   2HD   LYS  65           HD1      LYS  65  15.260   4.039   9.694
  516   1HE   LYS  65           HE2      LYS  65  14.116   1.416   9.555
  517   2HE   LYS  65           HE1      LYS  65  15.254   1.461  10.902
  518   1HZ   LYS  65           HZ3      LYS  65  14.143   3.629  11.517
  519   2HZ   LYS  65           HZ2      LYS  65  12.915   3.210  10.421
  520   3HZ   LYS  65           HZ1      LYS  65  13.232   2.221  11.766
  521    H    ASP  66           HN       ASP  66  15.951   0.887   4.267
  522    HA   ASP  66           HA       ASP  66  18.435  -0.530   4.850
  523   1HB   ASP  66           HB2      ASP  66  16.019  -1.057   3.141
  524   2HB   ASP  66           HB1      ASP  66  17.477  -2.017   2.903
  525    H    THR  67           HN       THR  67  20.300  -0.378   3.678
  526    HA   THR  67           HA       THR  67  20.686   1.605   1.691
  527    HB   THR  67           HB       THR  67  22.518   0.552   3.011
  528    HG1  THR  67           HG1      THR  67  23.903   0.228   1.100
  529   1HG2  THR  67          HG21      THR  67  21.355  -1.822   2.149
  530   2HG2  THR  67          HG23      THR  67  22.850  -1.726   1.218
  531   3HG2  THR  67          HG22      THR  67  22.903  -1.670   2.980
  532    NH1  ARG  68           NH2      ARG  68  17.801  -6.819   3.239
  533    NH2  ARG  68           NH1      ARG  68  17.228  -8.104   1.473
  534    H    ARG  68           HN       ARG  68  19.467  -1.657   1.413
  535    HA   ARG  68           HA       ARG  68  20.032  -2.107  -1.352
  536   1HB   ARG  68           HB2      ARG  68  17.646  -3.080   0.248
  537   2HB   ARG  68           HB1      ARG  68  18.258  -3.786  -1.250
  538   1HG   ARG  68           HG2      ARG  68  19.958  -4.859  -0.193
  539   2HG   ARG  68           HG1      ARG  68  20.292  -3.485   0.862
  540   1HD   ARG  68           HD2      ARG  68  19.468  -5.022   2.402
  541   2HD   ARG  68           HD1      ARG  68  17.990  -4.166   1.965
  542    HE   ARG  68           HE       ARG  68  18.126  -6.251   0.140
  543   1HH1  ARG  68          HH21      ARG  68  18.190  -5.982   3.619
  544   2HH1  ARG  68          HH22      ARG  68  17.456  -7.528   3.854
  545   1HH2  ARG  68          HH11      ARG  68  17.178  -8.252   0.485
  546   2HH2  ARG  68          HH12      ARG  68  16.885  -8.803   2.101
  547    H    CYS  69           HN       CYS  69  17.315  -0.484   0.270
  548    HA   CYS  69           HA       CYS  69  16.008   0.046  -2.314
  549   1HB   CYS  69           HB2      CYS  69  14.890  -0.403   0.028
  550   2HB   CYS  69           HB1      CYS  69  15.161   1.325   0.265
  551    H    LEU  70           HN       LEU  70  18.191   1.667  -0.136
  552    HA   LEU  70           HA       LEU  70  17.600   4.362  -0.976
  553   1HB   LEU  70           HB2      LEU  70  20.097   3.138   0.235
  554   2HB   LEU  70           HB1      LEU  70  19.857   4.871  -0.001
  555    HG   LEU  70           HG       LEU  70  18.093   3.053   1.670
  556   1HD1  LEU  70          HD11      LEU  70  20.416   3.676   2.553
  557   2HD1  LEU  70          HD13      LEU  70  19.840   5.342   2.591
  558   3HD1  LEU  70          HD12      LEU  70  19.050   4.114   3.579
  559   1HD2  LEU  70          HD21      LEU  70  17.770   5.765   0.575
  560   2HD2  LEU  70          HD23      LEU  70  16.557   4.672   1.243
  561   3HD2  LEU  70          HD22      LEU  70  17.528   5.675   2.320
  562    H    GLY  71           HN       GLY  71  20.637   2.593  -1.619
  563   1HA   GLY  71           HA2      GLY  71  20.883   2.228  -4.227
  564   2HA   GLY  71           HA1      GLY  71  20.779   3.990  -4.237
  565    H    ALA  72           HN       ALA  72  22.665   5.102  -3.972
  566    HA   ALA  72           HA       ALA  72  24.856   3.996  -2.371
  567   1HB   ALA  72           HB2      ALA  72  24.768   3.458  -5.166
  568   2HB   ALA  72           HB1      ALA  72  26.042   4.648  -4.899
  569   3HB   ALA  72           HB3      ALA  72  26.078   3.109  -4.038
  570    H    THR  73           HN       THR  73  24.041   6.434  -4.865
  571    HA   THR  73           HA       THR  73  25.854   8.380  -3.622
  572    HB   THR  73           HB       THR  73  24.891   9.922  -5.381
  573    HG1  THR  73           HG1      THR  73  23.754   7.678  -6.574
  574   1HG2  THR  73          HG22      THR  73  26.348   7.389  -5.839
  575   2HG2  THR  73          HG21      THR  73  25.684   8.149  -7.285
  576   3HG2  THR  73          HG23      THR  73  26.803   9.042  -6.253
  577    H    ALA  74           HN       ALA  74  24.955  10.581  -3.014
  578    HA   ALA  74           HA       ALA  74  22.805  10.231  -1.089
  579   1HB   ALA  74           HB3      ALA  74  24.597  12.478  -1.930
  580   2HB   ALA  74           HB2      ALA  74  23.133  12.864  -1.028
  581   3HB   ALA  74           HB1      ALA  74  24.343  11.790  -0.327
  582    H    GLN  75           HN       GLN  75  23.052  11.486  -4.356
  583    HA   GLN  75           HA       GLN  75  20.687  13.043  -4.459
  584   1HB   GLN  75           HB2      GLN  75  22.003  11.323  -6.580
  585   2HB   GLN  75           HB1      GLN  75  20.683  12.447  -6.909
  586   1HG   GLN  75           HG2      GLN  75  22.020  14.324  -6.128
  587   2HG   GLN  75           HG1      GLN  75  23.319  13.236  -5.635
  588   1HE2  GLN  75          HE22      GLN  75  22.681  13.504  -9.696
  589   2HE2  GLN  75          HE21      GLN  75  21.343  13.438  -8.654
  590    H    GLN  76           HN       GLN  76  21.080   9.589  -5.345
  591    HA   GLN  76           HA       GLN  76  18.355   9.037  -5.820
  592   1HB   GLN  76           HB2      GLN  76  20.770   7.526  -5.470
  593   2HB   GLN  76           HB1      GLN  76  19.477   6.756  -4.550
  594   1HG   GLN  76           HG2      GLN  76  18.755   7.695  -7.273
  595   2HG   GLN  76           HG1      GLN  76  19.854   6.316  -7.191
  596   1HE2  GLN  76          HE22      GLN  76  15.984   5.643  -6.594
  597   2HE2  GLN  76          HE21      GLN  76  16.615   7.012  -7.375
  598    H    PHE  77           HN       PHE  77  20.084   9.381  -2.783
  599    HA   PHE  77           HA       PHE  77  18.115   8.148  -1.098
  600   1HB   PHE  77           HB2      PHE  77  20.400   8.686  -0.314
  601   2HB   PHE  77           HB1      PHE  77  20.036  10.406  -0.448
  602    HD1  PHE  77           HD1      PHE  77  18.933   7.260   1.238
  603    HD2  PHE  77           HD2      PHE  77  18.943  11.555   1.296
  604    HE1  PHE  77           HE1      PHE  77  17.920   7.232   3.503
  605    HE2  PHE  77           HE2      PHE  77  17.930  11.527   3.559
  606    HZ   PHE  77           HZ       PHE  77  17.418   9.366   4.662
  607    H    HIS  78           HN       HIS  78  18.589  11.535  -2.123
  608    HA   HIS  78           HA       HIS  78  16.433  12.652  -0.652
  609   1HB   HIS  78           HB2      HIS  78  18.032  14.108  -1.730
  610   2HB   HIS  78           HB1      HIS  78  17.629  13.453  -3.318
  611    HD1  HIS  78           HD1      HIS  78  15.489  14.297  -4.454
  612    HD2  HIS  78           HD2      HIS  78  16.018  15.844  -0.619
  613    HE1  HIS  78           HE1      HIS  78  13.772  16.139  -4.181
  614    NH1  ARG  79           NH2      ARG  79  16.091  12.282 -10.152
  615    NH2  ARG  79           NH1      ARG  79  17.308  10.383 -10.036
  616    H    ARG  79           HN       ARG  79  16.501  11.243  -3.921
  617    HA   ARG  79           HA       ARG  79  13.737  11.747  -4.502
  618   1HB   ARG  79           HB2      ARG  79  15.870  10.742  -5.915
  619   2HB   ARG  79           HB1      ARG  79  14.886   9.298  -5.674
  620   1HG   ARG  79           HG2      ARG  79  13.466   9.983  -7.276
  621   2HG   ARG  79           HG1      ARG  79  13.144  11.463  -6.373
  622   1HD   ARG  79           HD2      ARG  79  14.016  11.978  -8.624
  623   2HD   ARG  79           HD1      ARG  79  15.137  12.516  -7.374
  624    HE   ARG  79           HE       ARG  79  16.001   9.954  -8.006
  625   1HH1  ARG  79          HH21      ARG  79  15.387  12.890  -9.791
  626   2HH1  ARG  79          HH22      ARG  79  16.580  12.531 -10.989
  627   1HH2  ARG  79          HH11      ARG  79  17.538   9.524  -9.579
  628   2HH2  ARG  79          HH12      ARG  79  17.787  10.647 -10.873
  629    H    HIS  80           HN       HIS  80  15.364   9.244  -2.664
  630    HA   HIS  80           HA       HIS  80  13.091   7.429  -2.620
  631   1HB   HIS  80           HB2      HIS  80  15.254   6.472  -2.242
  632   2HB   HIS  80           HB1      HIS  80  15.616   7.634  -0.966
  633    HD1  HIS  80           HD1      HIS  80  13.340   4.686  -1.691
  634    HD2  HIS  80           HD2      HIS  80  14.693   6.901   1.572
  635    HE1  HIS  80           HE1      HIS  80  12.542   3.469   0.383
  636    H    LYS  81           HN       LYS  81  14.141  10.174  -0.711
  637    HA   LYS  81           HA       LYS  81  12.572   9.652   1.629
  638   1HB   LYS  81           HB2      LYS  81  13.466  11.607   2.331
  639   2HB   LYS  81           HB1      LYS  81  14.357  11.617   0.810
  640   1HG   LYS  81           HG2      LYS  81  12.408  12.810  -0.244
  641   2HG   LYS  81           HG1      LYS  81  11.682  12.934   1.361
  642   1HD   LYS  81           HD2      LYS  81  14.502  13.821   1.146
  643   2HD   LYS  81           HD1      LYS  81  13.313  14.833   0.326
  644   1HE   LYS  81           HE2      LYS  81  11.967  14.649   2.548
  645   2HE   LYS  81           HE1      LYS  81  13.502  14.147   3.253
  646   1HZ   LYS  81           HZ3      LYS  81  14.239  16.288   1.827
  647   2HZ   LYS  81           HZ2      LYS  81  12.671  16.745   2.292
  648   3HZ   LYS  81           HZ1      LYS  81  13.825  16.339   3.472
  649    H    GLN  82           HN       GLN  82  11.799  11.021  -1.505
  650    HA   GLN  82           HA       GLN  82   9.251  12.146  -0.734
  651   1HB   GLN  82           HB2      GLN  82  10.814  11.848  -3.162
  652   2HB   GLN  82           HB1      GLN  82   9.115  11.480  -3.460
  653   1HG   GLN  82           HG2      GLN  82   9.486  13.836  -1.754
  654   2HG   GLN  82           HG1      GLN  82  10.205  14.024  -3.353
  655   1HE2  GLN  82          HE22      GLN  82   6.962  14.948  -4.446
  656   2HE2  GLN  82          HE21      GLN  82   8.558  15.462  -4.177
  657    H    LEU  83           HN       LEU  83  10.226   9.034  -2.168
  658    HA   LEU  83           HA       LEU  83   7.583   8.014  -2.542
  659   1HB   LEU  83           HB2      LEU  83   9.416   6.903  -3.626
  660   2HB   LEU  83           HB1      LEU  83  10.236   6.630  -2.088
  661    HG   LEU  83           HG       LEU  83   7.480   5.570  -2.244
  662   1HD1  LEU  83          HD13      LEU  83   9.621   4.800  -4.166
  663   2HD1  LEU  83          HD12      LEU  83   8.714   3.486  -3.418
  664   3HD1  LEU  83          HD11      LEU  83   7.869   4.725  -4.346
  665   1HD2  LEU  83          HD21      LEU  83  10.099   4.964  -1.002
  666   2HD2  LEU  83          HD23      LEU  83   8.472   4.765  -0.351
  667   3HD2  LEU  83          HD22      LEU  83   9.140   3.552  -1.447
  668    H    ILE  84           HN       ILE  84   9.891   7.448   0.134
  669    HA   ILE  84           HA       ILE  84   8.233   5.844   1.742
  670    HB   ILE  84           HB       ILE  84  10.262   7.925   2.607
  671   1HG1  ILE  84          HG12      ILE  84  11.200   6.222   1.111
  672   2HG1  ILE  84          HG11      ILE  84  11.766   5.946   2.759
  673   1HG2  ILE  84          HG22      ILE  84   8.747   7.248   4.442
  674   2HG2  ILE  84          HG21      ILE  84   9.106   5.554   4.106
  675   3HG2  ILE  84          HG23      ILE  84  10.377   6.626   4.693
  676   1HD1  ILE  84          HD12      ILE  84   9.814   4.322   3.019
  677   2HD1  ILE  84          HD11      ILE  84   9.598   4.450   1.272
  678   3HD1  ILE  84          HD13      ILE  84  11.102   3.805   1.930
  679    NH1  ARG  85           NH2      ARG  85   7.102  16.325   2.673
  680    NH2  ARG  85           NH1      ARG  85   6.184  16.347   4.737
  681    H    ARG  85           HN       ARG  85   8.344   9.386   1.483
  682    HA   ARG  85           HA       ARG  85   6.601   9.962   3.659
  683   1HB   ARG  85           HB2      ARG  85   7.760  11.803   2.695
  684   2HB   ARG  85           HB1      ARG  85   7.184  11.413   1.073
  685   1HG   ARG  85           HG2      ARG  85   4.939  12.068   1.619
  686   2HG   ARG  85           HG1      ARG  85   5.328  12.188   3.335
  687   1HD   ARG  85           HD2      ARG  85   7.154  13.847   1.870
  688   2HD   ARG  85           HD1      ARG  85   5.511  14.230   1.358
  689    HE   ARG  85           HE       ARG  85   5.361  14.117   4.132
  690   1HH1  ARG  85          HH21      ARG  85   7.274  15.874   1.799
  691   2HH1  ARG  85          HH22      ARG  85   7.473  17.238   2.840
  692   1HH2  ARG  85          HH11      ARG  85   5.643  15.904   5.453
  693   2HH2  ARG  85          HH12      ARG  85   6.563  17.259   4.888
  694    H    PHE  86           HN       PHE  86   5.849   9.522   0.197
  695    HA   PHE  86           HA       PHE  86   3.051   9.846   0.379
  696   1HB   PHE  86           HB2      PHE  86   4.936   8.833  -1.558
  697   2HB   PHE  86           HB1      PHE  86   3.508   7.795  -1.513
  698    HD1  PHE  86           HD1      PHE  86   4.207  11.479  -1.223
  699    HD2  PHE  86           HD2      PHE  86   1.845   8.379  -3.027
  700    HE1  PHE  86           HE1      PHE  86   2.915  13.188  -2.471
  701    HE2  PHE  86           HE2      PHE  86   0.555  10.091  -4.276
  702    HZ   PHE  86           HZ       PHE  86   1.090  12.495  -3.998
  703    H    LEU  87           HN       LEU  87   5.073   7.081   1.203
  704    HA   LEU  87           HA       LEU  87   2.927   5.179   1.409
  705   1HB   LEU  87           HB2      LEU  87   5.397   4.616   1.310
  706   2HB   LEU  87           HB1      LEU  87   5.536   5.191   2.967
  707    HG   LEU  87           HG       LEU  87   5.249   2.658   2.627
  708   1HD1  LEU  87          HD13      LEU  87   4.752   4.122   4.742
  709   2HD1  LEU  87          HD12      LEU  87   3.069   3.757   4.368
  710   3HD1  LEU  87          HD11      LEU  87   4.200   2.448   4.693
  711   1HD2  LEU  87          HD22      LEU  87   3.296   3.155   0.950
  712   2HD2  LEU  87          HD21      LEU  87   3.171   1.774   2.040
  713   3HD2  LEU  87          HD23      LEU  87   2.315   3.270   2.412
  714    H    LYS  88           HN       LYS  88   4.541   7.275   3.801
  715    HA   LYS  88           HA       LYS  88   3.152   6.473   6.108
  716   1HB   LYS  88           HB2      LYS  88   4.903   8.542   5.415
  717   2HB   LYS  88           HB1      LYS  88   3.459   9.364   6.004
  718   1HG   LYS  88           HG2      LYS  88   3.575   7.593   7.939
  719   2HG   LYS  88           HG1      LYS  88   5.263   7.446   7.448
  720   1HD   LYS  88           HD2      LYS  88   4.785  10.203   7.509
  721   2HD   LYS  88           HD1      LYS  88   3.969   9.577   8.942
  722   1HE   LYS  88           HE2      LYS  88   6.021   9.633   9.906
  723   2HE   LYS  88           HE1      LYS  88   6.340   8.174   8.967
  724   1HZ   LYS  88           HZ3      LYS  88   6.766  10.869   7.830
  725   2HZ   LYS  88           HZ2      LYS  88   7.970  10.091   8.742
  726   3HZ   LYS  88           HZ1      LYS  88   7.401   9.387   7.305
  727    NH1  ARG  89           NH2      ARG  89  -0.203  13.522  -0.276
  728    NH2  ARG  89           NH1      ARG  89   1.371  14.283   1.154
  729    H    ARG  89           HN       ARG  89   2.166   8.848   3.638
  730    HA   ARG  89           HA       ARG  89  -0.244   9.681   4.919
  731   1HB   ARG  89           HB2      ARG  89   0.836  10.776   2.919
  732   2HB   ARG  89           HB1      ARG  89   0.223   9.446   1.936
  733   1HG   ARG  89           HG2      ARG  89  -2.065  10.007   2.482
  734   2HG   ARG  89           HG1      ARG  89  -1.538  11.212   3.658
  735   1HD   ARG  89           HD2      ARG  89  -1.129  11.306   0.657
  736   2HD   ARG  89           HD1      ARG  89  -2.161  12.366   1.618
  737    HE   ARG  89           HE       ARG  89   0.348  12.705   2.733
  738   1HH1  ARG  89          HH21      ARG  89  -0.979  12.931  -0.486
  739   2HH1  ARG  89          HH22      ARG  89   0.153  14.137  -0.979
  740   1HH2  ARG  89          HH11      ARG  89   1.805  14.272   2.056
  741   2HH2  ARG  89          HH12      ARG  89   1.714  14.893   0.441
  742    H    LEU  90           HN       LEU  90   0.280   7.190   2.426
  743    HA   LEU  90           HA       LEU  90  -2.459   6.254   2.503
  744   1HB   LEU  90           HB2      LEU  90  -0.758   6.029   0.594
  745   2HB   LEU  90           HB1      LEU  90  -0.071   4.691   1.513
  746    HG   LEU  90           HG       LEU  90  -2.724   4.057   1.581
  747   1HD1  LEU  90          HD13      LEU  90  -2.791   6.108  -0.168
  748   2HD1  LEU  90          HD12      LEU  90  -2.406   4.799  -1.284
  749   3HD1  LEU  90          HD11      LEU  90  -3.867   4.717  -0.301
  750   1HD2  LEU  90          HD23      LEU  90  -0.815   2.585   0.977
  751   2HD2  LEU  90          HD22      LEU  90  -2.171   2.388  -0.132
  752   3HD2  LEU  90          HD21      LEU  90  -0.764   3.333  -0.619
  753    H    ASP  91           HN       ASP  91   0.057   5.847   4.737
  754    HA   ASP  91           HA       ASP  91  -0.532   3.075   5.438
  755   1HB   ASP  91           HB2      ASP  91   1.659   3.622   5.998
  756   2HB   ASP  91           HB1      ASP  91   1.223   5.242   6.543
  757    NH1  ARG  92           NH2      ARG  92  -4.849   8.889  12.669
  758    NH2  ARG  92           NH1      ARG  92  -3.807  10.758  11.947
  759    H    ARG  92           HN       ARG  92  -1.257   6.275   6.850
  760    HA   ARG  92           HA       ARG  92  -2.936   4.986   8.905
  761   1HB   ARG  92           HB2      ARG  92  -1.680   7.604   8.514
  762   2HB   ARG  92           HB1      ARG  92  -3.337   7.723   9.105
  763   1HG   ARG  92           HG2      ARG  92  -1.970   5.607  10.510
  764   2HG   ARG  92           HG1      ARG  92  -1.018   7.089  10.603
  765   1HD   ARG  92           HD2      ARG  92  -3.975   6.911  11.245
  766   2HD   ARG  92           HD1      ARG  92  -2.688   6.900  12.452
  767    HE   ARG  92           HE       ARG  92  -2.197   9.189  10.964
  768   1HH1  ARG  92          HH21      ARG  92  -4.909   7.896  12.739
  769   2HH1  ARG  92          HH22      ARG  92  -5.547   9.459  13.103
  770   1HH2  ARG  92          HH11      ARG  92  -3.058  11.200  11.454
  771   2HH2  ARG  92          HH12      ARG  92  -4.514  11.312  12.385
  772    H    ASN  93           HN       ASN  93  -3.318   6.645   5.845
  773    HA   ASN  93           HA       ASN  93  -6.166   7.160   6.273
  774   1HB   ASN  93           HB2      ASN  93  -4.167   7.937   4.371
  775   2HB   ASN  93           HB1      ASN  93  -5.536   7.243   3.503
  776   1HD2  ASN  93          HD22      ASN  93  -7.014  10.455   3.784
  777   2HD2  ASN  93          HD21      ASN  93  -6.351   9.298   2.734
  778    H    LEU  94           HN       LEU  94  -4.241   4.808   4.402
  779    HA   LEU  94           HA       LEU  94  -6.316   3.520   3.031
  780   1HB   LEU  94           HB2      LEU  94  -3.888   3.033   2.775
  781   2HB   LEU  94           HB1      LEU  94  -3.929   2.157   4.302
  782    HG   LEU  94           HG       LEU  94  -5.872   0.819   3.224
  783   1HD1  LEU  94          HD11      LEU  94  -4.639   2.238   0.862
  784   2HD1  LEU  94          HD13      LEU  94  -5.447   0.681   0.677
  785   3HD1  LEU  94          HD12      LEU  94  -6.347   2.075   1.273
  786   1HD2  LEU  94          HD21      LEU  94  -2.945   0.634   2.564
  787   2HD2  LEU  94          HD23      LEU  94  -3.914  -0.400   3.614
  788   3HD2  LEU  94          HD22      LEU  94  -4.073  -0.526   1.863
  789    CH2  TRP  95           CH2      TRP  95  -6.047  -0.332  13.124
  790    H    TRP  95           HN       TRP  95  -4.966   2.295   6.130
  791    HA   TRP  95           HA       TRP  95  -7.417   0.712   6.520
  792   1HB   TRP  95           HB2      TRP  95  -6.130  -0.594   7.822
  793   2HB   TRP  95           HB1      TRP  95  -4.779   0.330   7.173
  794    HD1  TRP  95           HD1      TRP  95  -4.354   2.736   8.628
  795    HE1  TRP  95           HE1      TRP  95  -4.208   2.967  11.195
  796    HE3  TRP  95           HE3      TRP  95  -6.758  -1.534  10.014
  797    HZ2  TRP  95           HZ2      TRP  95  -5.007   1.510  13.530
  798    HZ3  TRP  95           HZ3      TRP  95  -7.048  -2.095  12.403
  799    HH2  TRP  95           HH2      TRP  95  -6.178  -0.584  14.166
  800    H    GLY  96           HN       GLY  96  -6.171   3.752   7.613
  801   1HA   GLY  96           HA2      GLY  96  -7.441   4.029  10.119
  802   2HA   GLY  96           HA1      GLY  96  -7.181   5.369   9.003
  803    H    LEU  97           HN       LEU  97  -8.789   4.094   6.874
  804    HA   LEU  97           HA       LEU  97 -11.422   5.005   7.817
  805   1HB   LEU  97           HB2      LEU  97 -10.522   5.575   5.536
  806   2HB   LEU  97           HB1      LEU  97 -10.648   3.869   5.112
  807    HG   LEU  97           HG       LEU  97 -13.102   4.956   6.306
  808   1HD1  LEU  97          HD11      LEU  97 -12.288   6.953   5.048
  809   2HD1  LEU  97          HD13      LEU  97 -12.201   5.966   3.589
  810   3HD1  LEU  97          HD12      LEU  97 -13.760   6.274   4.353
  811   1HD2  LEU  97          HD22      LEU  97 -12.427   3.477   3.742
  812   2HD2  LEU  97          HD21      LEU  97 -12.993   2.753   5.248
  813   3HD2  LEU  97          HD23      LEU  97 -14.066   3.795   4.312
  814    H    ALA  98           HN       ALA  98  -9.787   2.001   7.011
  815    HA   ALA  98           HA       ALA  98 -11.949   0.236   6.720
  816   1HB   ALA  98           HB1      ALA  98  -9.341  -0.161   6.684
  817   2HB   ALA  98           HB3      ALA  98  -9.582  -0.572   8.381
  818   3HB   ALA  98           HB2      ALA  98 -10.422  -1.482   7.126
  819    H    GLY  99           HN       GLY  99 -10.317   1.188   9.753
  820   1HA   GLY  99           HA2      GLY  99 -11.298   1.463  11.893
  821   2HA   GLY  99           HA1      GLY  99 -12.852   0.994  11.205
  822    H    LEU 100           HN       LEU 100  -9.710  -0.349  12.205
  823    HA   LEU 100           HA       LEU 100 -11.116  -2.686  13.319
  824   1HB   LEU 100           HB2      LEU 100  -9.733  -2.764  10.769
  825   2HB   LEU 100           HB1      LEU 100  -8.962  -3.845  11.927
  826    HG   LEU 100           HG       LEU 100 -11.768  -4.175  12.241
  827   1HD1  LEU 100          HD12      LEU 100 -10.862  -3.781   9.425
  828   2HD1  LEU 100          HD11      LEU 100 -11.976  -5.110   9.743
  829   3HD1  LEU 100          HD13      LEU 100 -12.436  -3.457  10.154
  830   1HD2  LEU 100          HD21      LEU 100  -9.383  -5.737  11.419
  831   2HD2  LEU 100          HD23      LEU 100 -10.609  -6.111  12.630
  832   3HD2  LEU 100          HD22      LEU 100 -10.939  -6.402  10.923
  833    H    ASN 101           HN       ASN 101  -8.931  -4.285  13.876
  834    HA   ASN 101           HA       ASN 101  -7.277  -2.465  15.577
  835   1HB   ASN 101           HB2      ASN 101  -7.767  -5.426  16.001
  836   2HB   ASN 101           HB1      ASN 101  -7.063  -4.280  17.144
  837   1HD2  ASN 101          HD22      ASN 101 -10.195  -3.315  18.413
  838   2HD2  ASN 101          HD21      ASN 101  -8.510  -3.358  18.609
  839    H    SER 102           HN       SER 102  -5.312  -4.494  16.201
  840    HA   SER 102           HA       SER 102  -3.410  -4.081  14.177
  841   1HB   SER 102           HB2      SER 102  -2.161  -5.958  15.186
  842   2HB   SER 102           HB1      SER 102  -2.829  -4.900  16.426
  843    HG   SER 102           HG       SER 102  -3.819  -6.599  17.141
  844    H    CYS 103           HN       CYS 103  -2.370  -6.033  12.912
  845    HA   CYS 103           HA       CYS 103  -4.420  -7.894  11.860
  846   1HB   CYS 103           HB2      CYS 103  -3.160  -5.641  10.337
  847   2HB   CYS 103           HB1      CYS 103  -3.488  -7.153   9.493
  848    HA   PRO 104           HA       PRO 104  -0.179  -9.652  12.533
  849   1HB   PRO 104           HB2      PRO 104  -1.590 -12.107  13.127
  850   2HB   PRO 104           HB1      PRO 104  -0.610 -11.114  14.216
  851   1HG   PRO 104           HG2      PRO 104  -3.473 -11.369  14.193
  852   2HG   PRO 104           HG1      PRO 104  -2.492 -10.332  15.236
  853   1HD   PRO 104           HD2      PRO 104  -4.190  -9.533  13.046
  854   2HD   PRO 104           HD1      PRO 104  -3.206  -8.494  14.096
  855    H    VAL 105           HN       VAL 105   0.097  -9.532  10.203
  856    HA   VAL 105           HA       VAL 105  -1.308 -11.294   8.398
  857    HB   VAL 105           HB       VAL 105   0.844  -9.307   8.242
  858   1HG1  VAL 105          HG11      VAL 105   0.937 -11.773   6.481
  859   2HG1  VAL 105          HG13      VAL 105   1.743 -10.256   6.088
  860   3HG1  VAL 105          HG12      VAL 105   2.223 -11.159   7.522
  861   1HG2  VAL 105          HG23      VAL 105  -1.693  -9.737   7.196
  862   2HG2  VAL 105          HG22      VAL 105  -0.571  -8.477   6.683
  863   3HG2  VAL 105          HG21      VAL 105  -0.634 -10.011   5.815
  864    H    LYS 106           HN       LYS 106  -0.877 -13.406   7.917
  865    HA   LYS 106           HA       LYS 106   1.809 -14.510   8.465
  866   1HB   LYS 106           HB2      LYS 106  -0.400 -14.886  10.252
  867   2HB   LYS 106           HB1      LYS 106  -0.039 -16.428   9.474
  868   1HG   LYS 106           HG2      LYS 106   2.057 -16.570  10.410
  869   2HG   LYS 106           HG1      LYS 106   2.282 -14.821  10.427
  870   1HD   LYS 106           HD2      LYS 106   2.035 -15.610  12.721
  871   2HD   LYS 106           HD1      LYS 106   0.611 -14.666  12.279
  872   1HE   LYS 106           HE2      LYS 106  -0.056 -16.736  13.430
  873   2HE   LYS 106           HE1      LYS 106  -0.603 -16.758  11.754
  874   1HZ   LYS 106           HZ1      LYS 106   1.958 -17.965  12.620
  875   2HZ   LYS 106           HZ3      LYS 106   0.505 -18.839  12.576
  876   3HZ   LYS 106           HZ2      LYS 106   1.146 -18.184  11.144
  877    H    GLU 107           HN       GLU 107  -1.516 -15.583   7.669
  878    HA   GLU 107           HA       GLU 107  -0.762 -17.721   5.959
  879   1HB   GLU 107           HB2      GLU 107  -3.061 -17.303   4.898
  880   2HB   GLU 107           HB1      GLU 107  -3.050 -17.602   6.634
  881   1HG   GLU 107           HG2      GLU 107  -3.553 -15.405   7.160
  882   2HG   GLU 107           HG1      GLU 107  -2.807 -14.771   5.695
  883    H    ALA 108           HN       ALA 108   0.958 -17.054   4.574
  884    HA   ALA 108           HA       ALA 108   0.162 -15.925   2.063
  885   1HB   ALA 108           HB2      ALA 108   0.160 -13.853   3.487
  886   2HB   ALA 108           HB1      ALA 108   1.878 -14.114   3.782
  887   3HB   ALA 108           HB3      ALA 108   1.305 -13.787   2.149
  888    H    ASP 109           HN       ASP 109   1.651 -16.541   0.549
  889    HA   ASP 109           HA       ASP 109   4.117 -17.855   1.504
  890   1HB   ASP 109           HB2      ASP 109   2.545 -17.809  -1.035
  891   2HB   ASP 109           HB1      ASP 109   4.278 -18.108  -1.167
  892    H    GLN 110           HN       GLN 110   6.230 -17.232   0.556
  893    HA   GLN 110           HA       GLN 110   6.622 -14.385   0.605
  894   1HB   GLN 110           HB2      GLN 110   8.279 -16.562   0.840
  895   2HB   GLN 110           HB1      GLN 110   8.710 -15.956  -0.759
  896   1HG   GLN 110           HG2      GLN 110  10.130 -14.750   0.684
  897   2HG   GLN 110           HG1      GLN 110   8.803 -13.627   0.379
  898   1HE2  GLN 110          HE22      GLN 110   8.018 -13.400   3.792
  899   2HE2  GLN 110          HE21      GLN 110   7.985 -12.693   2.250
  900    H    SER 111           HN       SER 111   5.308 -13.460  -1.022
  901    HA   SER 111           HA       SER 111   5.752 -14.293  -3.824
  902   1HB   SER 111           HB2      SER 111   3.978 -12.676  -4.343
  903   2HB   SER 111           HB1      SER 111   3.464 -13.740  -3.040
  904    HG   SER 111           HG       SER 111   3.017 -11.651  -2.426
  905    H    THR 112           HN       THR 112   5.596 -11.838  -5.119
  906    HA   THR 112           HA       THR 112   8.142 -10.555  -4.221
  907    HB   THR 112           HB       THR 112   8.500  -9.948  -6.568
  908    HG1  THR 112           HG1      THR 112   6.985 -10.251  -8.045
  909   1HG2  THR 112          HG21      THR 112   8.120 -12.724  -5.656
  910   2HG2  THR 112          HG23      THR 112   8.140 -12.536  -7.410
  911   3HG2  THR 112          HG22      THR 112   9.510 -11.980  -6.447
  912    H    LEU 113           HN       LEU 113   8.061  -8.419  -3.694
  913    HA   LEU 113           HA       LEU 113   5.676  -7.037  -3.209
  914   1HB   LEU 113           HB2      LEU 113   7.998  -6.415  -2.409
  915   2HB   LEU 113           HB1      LEU 113   8.270  -5.702  -3.997
  916    HG   LEU 113           HG       LEU 113   6.312  -4.223  -3.664
  917   1HD1  LEU 113          HD13      LEU 113   5.869  -6.051  -1.459
  918   2HD1  LEU 113          HD12      LEU 113   5.912  -4.386  -0.883
  919   3HD1  LEU 113          HD11      LEU 113   4.772  -4.854  -2.144
  920   1HD2  LEU 113          HD21      LEU 113   8.821  -4.007  -2.500
  921   2HD2  LEU 113          HD23      LEU 113   7.637  -2.705  -2.618
  922   3HD2  LEU 113          HD22      LEU 113   7.732  -3.681  -1.152
  923    H    GLU 114           HN       GLU 114   7.407  -7.393  -6.234
  924    HA   GLU 114           HA       GLU 114   6.327  -5.206  -7.673
  925   1HB   GLU 114           HB2      GLU 114   7.979  -7.262  -8.314
  926   2HB   GLU 114           HB1      GLU 114   6.499  -7.800  -9.108
  927   1HG   GLU 114           HG2      GLU 114   6.419  -5.297  -9.960
  928   2HG   GLU 114           HG1      GLU 114   8.153  -5.357  -9.638
  929    H    ASN 115           HN       ASN 115   5.068  -8.538  -7.401
  930    HA   ASN 115           HA       ASN 115   2.583  -7.924  -8.732
  931   1HB   ASN 115           HB2      ASN 115   3.748 -10.241  -8.256
  932   2HB   ASN 115           HB1      ASN 115   2.818 -10.173  -6.759
  933   1HD2  ASN 115          HD22      ASN 115   0.674 -10.210 -10.281
  934   2HD2  ASN 115          HD21      ASN 115   2.171  -9.412 -10.240
  935    H    PHE 116           HN       PHE 116   3.703  -7.491  -5.463
  936    HA   PHE 116           HA       PHE 116   1.156  -7.513  -4.142
  937   1HB   PHE 116           HB2      PHE 116   3.445  -7.528  -3.031
  938   2HB   PHE 116           HB1      PHE 116   3.547  -5.806  -3.396
  939    HD1  PHE 116           HD1      PHE 116   1.533  -8.374  -1.611
  940    HD2  PHE 116           HD2      PHE 116   2.389  -4.192  -2.085
  941    HE1  PHE 116           HE1      PHE 116   0.171  -7.869   0.398
  942    HE2  PHE 116           HE2      PHE 116   1.026  -3.686  -0.075
  943    HZ   PHE 116           HZ       PHE 116  -0.084  -5.524   1.166
  944    H    LEU 117           HN       LEU 117   3.136  -4.641  -4.958
  945    HA   LEU 117           HA       LEU 117   1.071  -2.746  -4.655
  946   1HB   LEU 117           HB2      LEU 117   3.728  -2.827  -5.885
  947   2HB   LEU 117           HB1      LEU 117   2.626  -1.730  -6.718
  948    HG   LEU 117           HG       LEU 117   2.625  -1.633  -3.742
  949   1HD1  LEU 117          HD13      LEU 117   5.002  -1.153  -5.419
  950   2HD1  LEU 117          HD12      LEU 117   4.579   0.193  -4.361
  951   3HD1  LEU 117          HD11      LEU 117   4.886  -1.402  -3.676
  952   1HD2  LEU 117          HD21      LEU 117   1.340  -0.215  -5.604
  953   2HD2  LEU 117          HD23      LEU 117   1.886   0.533  -4.104
  954   3HD2  LEU 117          HD22      LEU 117   2.834   0.721  -5.578
  955    H    GLU 118           HN       GLU 118   1.791  -4.930  -7.313
  956    HA   GLU 118           HA       GLU 118   0.299  -3.669  -9.368
  957   1HB   GLU 118           HB2      GLU 118   1.743  -5.631  -9.754
  958   2HB   GLU 118           HB1      GLU 118   0.625  -6.635  -8.831
  959   1HG   GLU 118           HG2      GLU 118  -0.534  -6.993 -10.726
  960   2HG   GLU 118           HG1      GLU 118  -0.949  -5.278 -10.746
  961    NH1  ARG 119           NH2      ARG 119  -4.365 -11.948  -8.117
  962    NH2  ARG 119           NH1      ARG 119  -5.174 -10.822  -9.899
  963    H    ARG 119           HN       ARG 119  -0.843  -6.387  -7.340
  964    HA   ARG 119           HA       ARG 119  -3.591  -6.098  -8.065
  965   1HB   ARG 119           HB2      ARG 119  -2.627  -7.161  -5.399
  966   2HB   ARG 119           HB1      ARG 119  -4.073  -7.624  -6.295
  967   1HG   ARG 119           HG2      ARG 119  -2.023  -8.101  -8.105
  968   2HG   ARG 119           HG1      ARG 119  -1.331  -8.605  -6.562
  969   1HD   ARG 119           HD2      ARG 119  -2.426 -10.556  -7.121
  970   2HD   ARG 119           HD1      ARG 119  -3.738  -9.732  -6.281
  971    HE   ARG 119           HE       ARG 119  -4.002  -8.905  -8.915
  972   1HH1  ARG 119          HH21      ARG 119  -3.837 -11.977  -7.269
  973   2HH1  ARG 119          HH22      ARG 119  -4.814 -12.777  -8.448
  974   1HH2  ARG 119          HH11      ARG 119  -5.267  -9.976 -10.424
  975   2HH2  ARG 119          HH12      ARG 119  -5.616 -11.660 -10.219
  976    H    LEU 120           HN       LEU 120  -1.643  -4.180  -5.922
  977    HA   LEU 120           HA       LEU 120  -3.831  -3.306  -4.230
  978   1HB   LEU 120           HB2      LEU 120  -0.998  -2.790  -4.471
  979   2HB   LEU 120           HB1      LEU 120  -1.873  -1.265  -4.341
  980    HG   LEU 120           HG       LEU 120  -3.092  -2.965  -2.461
  981   1HD1  LEU 120          HD12      LEU 120  -0.732  -4.176  -2.966
  982   2HD1  LEU 120          HD11      LEU 120  -0.203  -3.003  -1.760
  983   3HD1  LEU 120          HD13      LEU 120  -1.474  -4.162  -1.366
  984   1HD2  LEU 120          HD22      LEU 120  -1.065  -0.726  -2.252
  985   2HD2  LEU 120          HD21      LEU 120  -2.816  -0.613  -2.090
  986   3HD2  LEU 120          HD23      LEU 120  -1.866  -1.421  -0.843
  987    H    LYS 121           HN       LYS 121  -2.276  -2.041  -7.158
  988    HA   LYS 121           HA       LYS 121  -3.958   0.317  -7.314
  989   1HB   LYS 121           HB2      LYS 121  -1.707   0.109  -8.412
  990   2HB   LYS 121           HB1      LYS 121  -2.409  -1.064  -9.527
  991   1HG   LYS 121           HG2      LYS 121  -3.820   1.547  -9.214
  992   2HG   LYS 121           HG1      LYS 121  -2.307   1.540 -10.123
  993   1HD   LYS 121           HD2      LYS 121  -3.605  -0.696 -11.097
  994   2HD   LYS 121           HD1      LYS 121  -4.927   0.446 -10.860
  995   1HE   LYS 121           HE2      LYS 121  -2.420   1.440 -12.152
  996   2HE   LYS 121           HE1      LYS 121  -3.514   0.444 -13.112
  997   1HZ   LYS 121           HZ3      LYS 121  -5.258   2.087 -12.016
  998   2HZ   LYS 121           HZ2      LYS 121  -3.906   3.117 -12.020
  999   3HZ   LYS 121           HZ1      LYS 121  -4.469   2.442 -13.474
 1000    H    THR 122           HN       THR 122  -3.798  -2.641  -9.265
 1001    HA   THR 122           HA       THR 122  -6.068  -2.318 -10.845
 1002    HB   THR 122           HB       THR 122  -6.157  -5.021 -10.167
 1003    HG1  THR 122           HG1      THR 122  -3.472  -4.660 -10.409
 1004   1HG2  THR 122          HG22      THR 122  -6.073  -4.031 -12.434
 1005   2HG2  THR 122          HG21      THR 122  -4.373  -3.631 -12.185
 1006   3HG2  THR 122          HG23      THR 122  -4.881  -5.318 -12.249
 1007    H    ILE 123           HN       ILE 123  -5.947  -3.782  -7.618
 1008    HA   ILE 123           HA       ILE 123  -8.744  -4.310  -7.405
 1009    HB   ILE 123           HB       ILE 123  -6.618  -3.834  -5.308
 1010   1HG1  ILE 123          HG12      ILE 123  -6.461  -5.876  -6.773
 1011   2HG1  ILE 123          HG11      ILE 123  -6.681  -6.250  -5.063
 1012   1HG2  ILE 123          HG22      ILE 123  -9.559  -4.280  -5.071
 1013   2HG2  ILE 123          HG21      ILE 123  -8.515  -5.150  -3.947
 1014   3HG2  ILE 123          HG23      ILE 123  -8.468  -3.389  -4.009
 1015   1HD1  ILE 123          HD11      ILE 123  -9.249  -5.921  -6.362
 1016   2HD1  ILE 123          HD13      ILE 123  -8.282  -7.133  -7.202
 1017   3HD1  ILE 123          HD12      ILE 123  -8.620  -7.312  -5.481
 1018    H    MET 124           HN       MET 124  -6.833  -1.432  -6.622
 1019    HA   MET 124           HA       MET 124  -9.004  -0.084  -5.276
 1020   1HB   MET 124           HB2      MET 124  -6.419   0.932  -6.461
 1021   2HB   MET 124           HB1      MET 124  -7.555   1.961  -5.587
 1022   1HG   MET 124           HG2      MET 124  -6.734  -0.597  -4.289
 1023   2HG   MET 124           HG1      MET 124  -5.554   0.710  -4.331
 1024   1HE   MET 124           HE3      MET 124  -5.291   2.288  -3.158
 1025   2HE   MET 124           HE2      MET 124  -6.542   3.500  -2.915
 1026   3HE   MET 124           HE1      MET 124  -6.001   2.518  -1.558
 1027    NH1  ARG 125           NH2      ARG 125  -6.407   5.976 -13.421
 1028    NH2  ARG 125           NH1      ARG 125  -8.215   6.441 -14.691
 1029    H    ARG 125           HN       ARG 125  -7.461   0.941  -8.324
 1030    HA   ARG 125           HA       ARG 125  -9.583   2.610  -9.139
 1031   1HB   ARG 125           HB2      ARG 125  -7.253   2.593 -10.070
 1032   2HB   ARG 125           HB1      ARG 125  -7.677   1.132 -10.965
 1033   1HG   ARG 125           HG2      ARG 125  -9.155   2.252 -12.368
 1034   2HG   ARG 125           HG1      ARG 125  -9.459   3.534 -11.195
 1035   1HD   ARG 125           HD2      ARG 125  -7.137   4.364 -11.546
 1036   2HD   ARG 125           HD1      ARG 125  -6.908   3.130 -12.784
 1037    HE   ARG 125           HE       ARG 125  -9.188   4.469 -13.603
 1038   1HH1  ARG 125          HH21      ARG 125  -5.941   5.414 -12.741
 1039   2HH1  ARG 125          HH22      ARG 125  -5.939   6.764 -13.817
 1040   1HH2  ARG 125          HH11      ARG 125  -9.146   6.231 -14.989
 1041   2HH2  ARG 125          HH12      ARG 125  -7.733   7.228 -15.075
 1042    H    GLU 126           HN       GLU 126  -9.361  -0.873  -9.417
 1043    HA   GLU 126           HA       GLU 126 -11.427  -0.922 -11.522
 1044   1HB   GLU 126           HB2      GLU 126  -9.410  -2.523 -11.329
 1045   2HB   GLU 126           HB1      GLU 126 -10.361  -3.345 -10.092
 1046   1HG   GLU 126           HG2      GLU 126 -12.010  -2.783 -12.399
 1047   2HG   GLU 126           HG1      GLU 126 -10.565  -3.669 -12.887
 1048    H    LYS 127           HN       LYS 127 -11.181  -2.100  -8.141
 1049    HA   LYS 127           HA       LYS 127 -14.011  -2.867  -8.161
 1050   1HB   LYS 127           HB2      LYS 127 -11.734  -3.513  -6.616
 1051   2HB   LYS 127           HB1      LYS 127 -12.890  -2.768  -5.512
 1052   1HG   LYS 127           HG2      LYS 127 -14.466  -4.429  -5.818
 1053   2HG   LYS 127           HG1      LYS 127 -13.929  -4.781  -7.460
 1054   1HD   LYS 127           HD2      LYS 127 -12.409  -6.316  -6.761
 1055   2HD   LYS 127           HD1      LYS 127 -11.897  -5.320  -5.399
 1056   1HE   LYS 127           HE2      LYS 127 -13.036  -7.477  -4.740
 1057   2HE   LYS 127           HE1      LYS 127 -13.786  -6.026  -4.076
 1058   1HZ   LYS 127           HZ2      LYS 127 -14.699  -7.141  -6.647
 1059   2HZ   LYS 127           HZ1      LYS 127 -15.266  -7.788  -5.181
 1060   3HZ   LYS 127           HZ3      LYS 127 -15.541  -6.155  -5.549
 1061    OH   TYR 128           OH       TYR 128 -10.259  -0.263  -1.326
 1062    H    TYR 128           HN       TYR 128 -12.336   0.051  -7.480
 1063    HA   TYR 128           HA       TYR 128 -14.399   0.989  -5.594
 1064   1HB   TYR 128           HB2      TYR 128 -11.882   2.261  -6.692
 1065   2HB   TYR 128           HB1      TYR 128 -13.012   3.117  -5.649
 1066    HD1  TYR 128           HD1      TYR 128 -11.433  -0.316  -5.705
 1067    HD2  TYR 128           HD2      TYR 128 -12.392   3.190  -3.411
 1068    HE1  TYR 128           HE1      TYR 128 -10.422  -1.352  -3.710
 1069    HE2  TYR 128           HE2      TYR 128 -11.367   2.143  -1.407
 1070    HH   TYR 128           HH       TYR 128  -9.621  -0.913  -1.631
 1071    H    SER 129           HN       SER 129 -14.647   0.516  -8.737
 1072    HA   SER 129           HA       SER 129 -15.540   3.218  -9.522
 1073   1HB   SER 129           HB2      SER 129 -15.851   2.274 -11.727
 1074   2HB   SER 129           HB1      SER 129 -14.298   1.716 -11.109
 1075    HG   SER 129           HG       SER 129 -15.088  -0.191 -11.511
 1076    H    LYS 130           HN       LYS 130 -16.938   1.082  -7.558
 1077    HA   LYS 130           HA       LYS 130 -19.579   1.019  -8.896
 1078   1HB   LYS 130           HB2      LYS 130 -20.253  -0.358  -6.929
 1079   2HB   LYS 130           HB1      LYS 130 -18.867  -1.034  -7.784
 1080   1HG   LYS 130           HG2      LYS 130 -17.363  -0.427  -6.107
 1081   2HG   LYS 130           HG1      LYS 130 -18.406   0.856  -5.496
 1082   1HD   LYS 130           HD2      LYS 130 -18.936  -0.656  -3.879
 1083   2HD   LYS 130           HD1      LYS 130 -19.998  -1.333  -5.115
 1084   1HE   LYS 130           HE2      LYS 130 -17.186  -2.230  -5.276
 1085   2HE   LYS 130           HE1      LYS 130 -18.049  -2.755  -3.831
 1086   1HZ   LYS 130           HZ2      LYS 130 -19.131  -3.053  -6.575
 1087   2HZ   LYS 130           HZ1      LYS 130 -18.249  -4.268  -5.781
 1088   3HZ   LYS 130           HZ3      LYS 130 -19.731  -3.746  -5.144
 1089    H    CYS 131           HN       CYS 131 -18.155   3.487  -7.621
 1090    HA   CYS 131           HA       CYS 131 -20.316   4.203  -5.692
 1091   1HB   CYS 131           HB2      CYS 131 -17.456   4.816  -5.879
 1092   2HB   CYS 131           HB1      CYS 131 -18.447   6.257  -5.649
 1093    H    SER 132           HN       SER 132 -18.649   5.218  -8.639
 1094    HA   SER 132           HA       SER 132 -20.665   7.387  -8.993
 1095   1HB   SER 132           HB2      SER 132 -17.985   7.560  -9.267
 1096   2HB   SER 132           HB1      SER 132 -18.407   7.070 -10.906
 1097    HG   SER 132           HG       SER 132 -18.467   9.339 -10.655
 1098    H    SER 133           HN       SER 133 -21.382   7.641 -11.366
 1099    HA   SER 133           HA       SER 133 -21.733   4.935 -12.594
 1100   1HB   SER 133           HB2      SER 133 -23.778   6.124 -11.433
 1101   2HB   SER 133           HB1      SER 133 -23.799   7.091 -12.905
 1102    HG   SER 133           HG       SER 133 -23.466   4.489 -13.495
   
  Start of MODEL          21
 Raw file had 1102 H/Q atoms
  Start of MODEL   21
    1   1H    GLU   1           HT3      GLU   1 -21.717  17.888  10.253
    2   2H    GLU   1           HT2      GLU   1 -20.301  18.002   9.323
    3   3H    GLU   1           HT1      GLU   1 -21.760  18.640   8.733
    4    HA   GLU   1           HA       GLU   1 -22.625  16.610   8.193
    5   1HB   GLU   1           HB2      GLU   1 -19.770  16.938   7.674
    6   2HB   GLU   1           HB1      GLU   1 -20.249  15.239   7.697
    7   1HG   GLU   1           HG2      GLU   1 -20.493  16.196   5.433
    8   2HG   GLU   1           HG1      GLU   1 -22.059  15.723   6.094
    9    H    ALA   2           HN       ALA   2 -23.376  14.739   9.096
   10    HA   ALA   2           HA       ALA   2 -21.868  13.666  11.446
   11   1HB   ALA   2           HB1      ALA   2 -24.163  14.626  11.882
   12   2HB   ALA   2           HB3      ALA   2 -24.825  13.353  10.856
   13   3HB   ALA   2           HB2      ALA   2 -23.988  12.935  12.351
   14    H    GLU   3           HN       GLU   3 -23.930  12.683   8.696
   15    HA   GLU   3           HA       GLU   3 -23.178   9.874   9.018
   16   1HB   GLU   3           HB2      GLU   3 -24.693  11.336   6.838
   17   2HB   GLU   3           HB1      GLU   3 -24.465   9.588   6.885
   18   1HG   GLU   3           HG2      GLU   3 -25.385  10.108   9.424
   19   2HG   GLU   3           HG1      GLU   3 -26.282  11.282   8.462
   20    H    ALA   4           HN       ALA   4 -22.154   8.670   7.189
   21    HA   ALA   4           HA       ALA   4 -20.628  10.064   5.175
   22   1HB   ALA   4           HB1      ALA   4 -19.362   9.488   7.806
   23   2HB   ALA   4           HB3      ALA   4 -18.413   9.085   6.374
   24   3HB   ALA   4           HB2      ALA   4 -18.976  10.737   6.623
   25    H    HIS   5           HN       HIS   5 -20.236   8.582   3.577
   26    HA   HIS   5           HA       HIS   5 -20.806   5.749   4.170
   27   1HB   HIS   5           HB2      HIS   5 -21.337   7.361   1.993
   28   2HB   HIS   5           HB1      HIS   5 -19.951   6.419   1.440
   29    HD1  HIS   5           HD1      HIS   5 -21.234   4.813  -0.091
   30    HD2  HIS   5           HD2      HIS   5 -22.712   4.871   3.806
   31    HE1  HIS   5           HE1      HIS   5 -22.868   2.885   0.085
   32    H    LYS   6           HN       LYS   6 -19.214   4.426   2.366
   33    HA   LYS   6           HA       LYS   6 -16.512   4.810   3.568
   34   1HB   LYS   6           HB2      LYS   6 -17.272   2.383   1.976
   35   2HB   LYS   6           HB1      LYS   6 -16.157   2.519   3.333
   36   1HG   LYS   6           HG2      LYS   6 -17.852   1.638   4.556
   37   2HG   LYS   6           HG1      LYS   6 -18.542   3.258   4.491
   38   1HD   LYS   6           HD2      LYS   6 -20.049   2.695   2.806
   39   2HD   LYS   6           HD1      LYS   6 -19.049   1.368   2.216
   40   1HE   LYS   6           HE2      LYS   6 -20.093  -0.107   3.558
   41   2HE   LYS   6           HE1      LYS   6 -19.837   0.917   4.970
   42   1HZ   LYS   6           HZ3      LYS   6 -21.755   2.248   4.272
   43   2HZ   LYS   6           HZ2      LYS   6 -22.017   1.187   2.971
   44   3HZ   LYS   6           HZ1      LYS   6 -22.181   0.633   4.568
   45    H    CYS   7           HN       CYS   7 -16.948   6.644   1.636
   46    HA   CYS   7           HA       CYS   7 -14.966   6.012  -0.354
   47   1HB   CYS   7           HB2      CYS   7 -16.960   4.693  -1.190
   48   2HB   CYS   7           HB1      CYS   7 -17.821   6.219  -1.368
   49    H    ASP   8           HN       ASP   8 -15.478   8.117   1.510
   50    HA   ASP   8           HA       ASP   8 -16.538  10.416   0.059
   51   1HB   ASP   8           HB2      ASP   8 -14.729  10.590   2.467
   52   2HB   ASP   8           HB1      ASP   8 -16.054  11.658   2.005
   53    H    ILE   9           HN       ILE   9 -14.518  12.338   0.689
   54    HA   ILE   9           HA       ILE   9 -12.834  12.118  -1.602
   55    HB   ILE   9           HB       ILE   9 -13.464  14.084   0.248
   56   1HG1  ILE   9          HG12      ILE   9 -11.279  15.036  -1.282
   57   2HG1  ILE   9          HG11      ILE   9 -12.078  13.817  -2.274
   58   1HG2  ILE   9          HG22      ILE   9 -11.596  13.196   1.681
   59   2HG2  ILE   9          HG21      ILE   9 -10.475  13.603   0.379
   60   3HG2  ILE   9          HG23      ILE   9 -11.387  14.876   1.190
   61   1HD1  ILE   9          HD13      ILE   9 -13.849  15.735  -0.847
   62   2HD1  ILE   9          HD12      ILE   9 -12.903  16.383  -2.188
   63   3HD1  ILE   9          HD11      ILE   9 -14.012  15.039  -2.458
   64    H    THR  10           HN       THR  10 -12.543  10.765   1.568
   65    HA   THR  10           HA       THR  10  -9.701  10.581   1.768
   66    HB   THR  10           HB       THR  10 -11.713   8.564   2.808
   67    HG1  THR  10           HG1      THR  10 -11.120  10.205   4.696
   68   1HG2  THR  10          HG22      THR  10  -8.922   9.404   3.668
   69   2HG2  THR  10          HG21      THR  10  -9.978   8.371   4.632
   70   3HG2  THR  10          HG23      THR  10  -9.413   7.825   3.053
   71    H    LEU  11           HN       LEU  11 -12.071   8.434   0.192
   72    HA   LEU  11           HA       LEU  11 -10.056   6.428  -0.423
   73   1HB   LEU  11           HB2      LEU  11 -12.828   6.480  -0.403
   74   2HB   LEU  11           HB1      LEU  11 -12.437   6.380  -2.120
   75    HG   LEU  11           HG       LEU  11 -10.884   4.472  -1.585
   76   1HD1  LEU  11          HD11      LEU  11 -12.154   4.808   1.147
   77   2HD1  LEU  11          HD13      LEU  11 -11.298   3.353   0.642
   78   3HD1  LEU  11          HD12      LEU  11 -10.437   4.886   0.754
   79   1HD2  LEU  11          HD21      LEU  11 -13.780   4.132  -0.745
   80   2HD2  LEU  11          HD23      LEU  11 -13.170   4.044  -2.397
   81   3HD2  LEU  11          HD22      LEU  11 -12.697   2.823  -1.215
   82    H    GLN  12           HN       GLN  12 -11.557   9.102  -2.236
   83    HA   GLN  12           HA       GLN  12 -10.407   8.458  -4.776
   84   1HB   GLN  12           HB2      GLN  12 -11.073  11.181  -3.612
   85   2HB   GLN  12           HB1      GLN  12 -10.778  10.846  -5.319
   86   1HG   GLN  12           HG2      GLN  12 -12.881   9.316  -3.798
   87   2HG   GLN  12           HG1      GLN  12 -13.243  10.900  -4.485
   88   1HE2  GLN  12          HE22      GLN  12 -13.327   7.734  -6.905
   89   2HE2  GLN  12          HE21      GLN  12 -13.369   7.632  -5.211
   90    H    GLU  13           HN       GLU  13  -9.181  10.379  -2.051
   91    HA   GLU  13           HA       GLU  13  -6.734  11.169  -3.357
   92   1HB   GLU  13           HB2      GLU  13  -7.216  10.801  -0.380
   93   2HB   GLU  13           HB1      GLU  13  -5.965  11.791  -1.134
   94   1HG   GLU  13           HG2      GLU  13  -8.544  12.526  -2.189
   95   2HG   GLU  13           HG1      GLU  13  -8.584  12.588  -0.426
   96    H    ILE  14           HN       ILE  14  -7.690   8.469  -1.281
   97    HA   ILE  14           HA       ILE  14  -5.148   7.204  -1.017
   98    HB   ILE  14           HB       ILE  14  -7.889   6.627  -0.402
   99   1HG1  ILE  14          HG12      ILE  14  -5.530   4.918   0.370
  100   2HG1  ILE  14          HG11      ILE  14  -5.706   6.557   1.000
  101   1HG2  ILE  14          HG23      ILE  14  -7.863   5.121  -2.368
  102   2HG2  ILE  14          HG22      ILE  14  -6.423   4.322  -1.729
  103   3HG2  ILE  14          HG21      ILE  14  -7.955   4.206  -0.865
  104   1HD1  ILE  14          HD12      ILE  14  -8.202   5.057   1.158
  105   2HD1  ILE  14          HD11      ILE  14  -6.899   4.264   2.045
  106   3HD1  ILE  14          HD13      ILE  14  -7.339   5.929   2.425
  107    H    ILE  15           HN       ILE  15  -7.308   7.486  -3.729
  108    HA   ILE  15           HA       ILE  15  -6.259   5.174  -5.163
  109    HB   ILE  15           HB       ILE  15  -8.088   7.468  -5.838
  110   1HG1  ILE  15          HG12      ILE  15  -8.411   4.461  -5.993
  111   2HG1  ILE  15          HG11      ILE  15  -8.926   5.449  -4.628
  112   1HG2  ILE  15          HG21      ILE  15  -6.825   5.487  -7.735
  113   2HG2  ILE  15          HG23      ILE  15  -8.306   6.366  -8.110
  114   3HG2  ILE  15          HG22      ILE  15  -6.801   7.246  -7.845
  115   1HD1  ILE  15          HD12      ILE  15 -10.218   6.828  -6.423
  116   2HD1  ILE  15          HD11      ILE  15 -10.015   5.397  -7.432
  117   3HD1  ILE  15          HD13      ILE  15 -10.887   5.282  -5.904
  118    H    LYS  16           HN       LYS  16  -5.822   8.709  -5.339
  119    HA   LYS  16           HA       LYS  16  -3.959   8.609  -7.539
  120   1HB   LYS  16           HB2      LYS  16  -4.573  10.693  -5.437
  121   2HB   LYS  16           HB1      LYS  16  -3.379  10.959  -6.709
  122   1HG   LYS  16           HG2      LYS  16  -5.031  10.720  -8.431
  123   2HG   LYS  16           HG1      LYS  16  -6.228  10.111  -7.288
  124   1HD   LYS  16           HD2      LYS  16  -5.562  12.519  -6.150
  125   2HD   LYS  16           HD1      LYS  16  -5.435  12.892  -7.871
  126   1HE   LYS  16           HE2      LYS  16  -7.770  11.355  -7.640
  127   2HE   LYS  16           HE1      LYS  16  -7.817  12.455  -6.261
  128   1HZ   LYS  16           HZ2      LYS  16  -7.411  14.300  -7.776
  129   2HZ   LYS  16           HZ1      LYS  16  -7.402  13.232  -9.098
  130   3HZ   LYS  16           HZ3      LYS  16  -8.824  13.459  -8.204
  131    H    THR  17           HN       THR  17  -3.605   8.201  -4.086
  132    HA   THR  17           HA       THR  17  -0.689   8.578  -4.125
  133    HB   THR  17           HB       THR  17  -1.787   7.140  -1.814
  134    HG1  THR  17           HG1      THR  17  -3.430   8.361  -1.419
  135   1HG2  THR  17          HG23      THR  17   0.263   8.916  -2.398
  136   2HG2  THR  17          HG22      THR  17  -0.874   9.900  -1.485
  137   3HG2  THR  17          HG21      THR  17  -0.229   8.419  -0.779
  138    H    LEU  18           HN       LEU  18  -2.965   5.845  -3.882
  139    HA   LEU  18           HA       LEU  18  -1.035   3.768  -3.684
  140   1HB   LEU  18           HB2      LEU  18  -3.695   3.746  -3.642
  141   2HB   LEU  18           HB1      LEU  18  -3.471   3.321  -5.341
  142    HG   LEU  18           HG       LEU  18  -1.591   1.756  -4.032
  143   1HD1  LEU  18          HD13      LEU  18  -3.566   2.512  -2.118
  144   2HD1  LEU  18          HD12      LEU  18  -3.829   0.815  -2.520
  145   3HD1  LEU  18          HD11      LEU  18  -2.257   1.348  -1.926
  146   1HD2  LEU  18          HD22      LEU  18  -3.582   1.398  -5.838
  147   2HD2  LEU  18          HD21      LEU  18  -2.689   0.070  -5.102
  148   3HD2  LEU  18          HD23      LEU  18  -4.255   0.544  -4.451
  149    H    ASN  19           HN       ASN  19  -2.267   5.605  -6.416
  150    HA   ASN  19           HA       ASN  19  -0.911   3.945  -8.407
  151   1HB   ASN  19           HB2      ASN  19  -3.051   5.332  -8.764
  152   2HB   ASN  19           HB1      ASN  19  -1.984   6.737  -8.836
  153   1HD2  ASN  19          HD22      ASN  19  -2.476   4.810 -12.201
  154   2HD2  ASN  19          HD21      ASN  19  -3.604   4.984 -10.944
  155    H    SER  20           HN       SER  20  -0.190   6.817  -6.531
  156    HA   SER  20           HA       SER  20   1.908   7.864  -8.160
  157   1HB   SER  20           HB2      SER  20   0.753   8.836  -6.006
  158   2HB   SER  20           HB1      SER  20   2.036   7.976  -5.157
  159    HG   SER  20           HG       SER  20   3.191   9.192  -7.159
  160    H    LEU  21           HN       LEU  21   1.812   5.235  -5.816
  161    HA   LEU  21           HA       LEU  21   4.641   4.908  -5.489
  162   1HB   LEU  21           HB2      LEU  21   2.216   3.286  -4.989
  163   2HB   LEU  21           HB1      LEU  21   3.690   2.358  -5.238
  164    HG   LEU  21           HG       LEU  21   3.261   4.545  -3.184
  165   1HD1  LEU  21          HD13      LEU  21   3.223   1.566  -3.198
  166   2HD1  LEU  21          HD12      LEU  21   3.992   2.343  -1.814
  167   3HD1  LEU  21          HD11      LEU  21   2.307   2.696  -2.199
  168   1HD2  LEU  21          HD21      LEU  21   5.693   3.406  -4.352
  169   2HD2  LEU  21          HD23      LEU  21   5.513   4.798  -3.284
  170   3HD2  LEU  21          HD22      LEU  21   5.621   3.174  -2.605
  171    H    THR  22           HN       THR  22   2.489   3.958  -8.080
  172    HA   THR  22           HA       THR  22   4.083   1.869  -9.194
  173    HB   THR  22           HB       THR  22   2.788   2.195 -11.239
  174    HG1  THR  22           HG1      THR  22   1.448   3.979 -11.428
  175   1HG2  THR  22          HG21      THR  22   1.378   2.392  -8.592
  176   2HG2  THR  22          HG23      THR  22   0.450   2.333 -10.090
  177   3HG2  THR  22          HG22      THR  22   1.530   1.004  -9.668
  178    H    GLU  23           HN       GLU  23   4.466   5.351  -9.378
  179    HA   GLU  23           HA       GLU  23   6.029   5.414 -11.779
  180   1HB   GLU  23           HB2      GLU  23   4.993   7.362 -10.355
  181   2HB   GLU  23           HB1      GLU  23   6.551   7.334  -9.531
  182   1HG   GLU  23           HG2      GLU  23   6.858   7.199 -12.426
  183   2HG   GLU  23           HG1      GLU  23   5.987   8.647 -11.923
  184    H    GLN  24           HN       GLN  24   6.801   4.209  -8.639
  185    HA   GLN  24           HA       GLN  24   9.616   3.791  -9.530
  186   1HB   GLN  24           HB2      GLN  24  10.435   4.339  -7.274
  187   2HB   GLN  24           HB1      GLN  24   9.633   5.730  -8.002
  188   1HG   GLN  24           HG2      GLN  24   7.649   4.181  -6.648
  189   2HG   GLN  24           HG1      GLN  24   9.000   4.430  -5.540
  190   1HE2  GLN  24          HE22      GLN  24   7.076   7.763  -7.007
  191   2HE2  GLN  24          HE21      GLN  24   7.130   6.354  -7.951
  192    H    LYS  25           HN       LYS  25   7.961   1.798  -9.857
  193    HA   LYS  25           HA       LYS  25   8.257   0.070  -7.434
  194   1HB   LYS  25           HB2      LYS  25   5.918   0.363  -7.800
  195   2HB   LYS  25           HB1      LYS  25   6.092   0.168  -9.544
  196   1HG   LYS  25           HG2      LYS  25   6.389  -2.154  -9.383
  197   2HG   LYS  25           HG1      LYS  25   6.893  -2.068  -7.696
  198   1HD   LYS  25           HD2      LYS  25   4.731  -2.811  -7.393
  199   2HD   LYS  25           HD1      LYS  25   4.427  -1.074  -7.412
  200   1HE   LYS  25           HE2      LYS  25   4.494  -2.066 -10.117
  201   2HE   LYS  25           HE1      LYS  25   3.354  -3.017  -9.166
  202   1HZ   LYS  25           HZ3      LYS  25   2.398  -0.891  -8.375
  203   2HZ   LYS  25           HZ2      LYS  25   3.404  -0.067  -9.469
  204   3HZ   LYS  25           HZ1      LYS  25   2.215  -1.136 -10.045
  205    H    THR  26           HN       THR  26  10.399  -0.534  -8.243
  206    HA   THR  26           HA       THR  26  10.321  -2.891  -9.914
  207    HB   THR  26           HB       THR  26  12.183  -1.104 -11.254
  208    HG1  THR  26           HG1      THR  26  10.830   0.555 -11.037
  209   1HG2  THR  26          HG21      THR  26   9.881  -2.889 -12.021
  210   2HG2  THR  26          HG23      THR  26  10.717  -1.903 -13.221
  211   3HG2  THR  26          HG22      THR  26  11.605  -3.127 -12.313
  212    H    LEU  27           HN       LEU  27  12.346  -0.275  -8.630
  213    HA   LEU  27           HA       LEU  27  14.601  -2.144  -8.284
  214   1HB   LEU  27           HB2      LEU  27  14.397   0.586  -8.788
  215   2HB   LEU  27           HB1      LEU  27  14.899   0.511  -7.097
  216    HG   LEU  27           HG       LEU  27  16.284  -1.330  -8.983
  217   1HD1  LEU  27          HD12      LEU  27  16.018   1.037 -10.055
  218   2HD1  LEU  27          HD11      LEU  27  17.182   1.537  -8.829
  219   3HD1  LEU  27          HD13      LEU  27  17.620   0.301 -10.009
  220   1HD2  LEU  27          HD23      LEU  27  16.710  -0.007  -6.395
  221   2HD2  LEU  27          HD22      LEU  27  17.395  -1.510  -7.012
  222   3HD2  LEU  27          HD21      LEU  27  18.130   0.036  -7.439
  223    H    CYS  28           HN       CYS  28  12.467  -0.172  -6.206
  224    HA   CYS  28           HA       CYS  28  13.658  -1.446  -3.824
  225   1HB   CYS  28           HB2      CYS  28  11.693   0.781  -4.264
  226   2HB   CYS  28           HB1      CYS  28  11.786  -0.002  -2.687
  227    H    THR  29           HN       THR  29  11.038  -2.058  -5.956
  228    HA   THR  29           HA       THR  29   9.440  -3.474  -3.923
  229    HB   THR  29           HB       THR  29   8.158  -4.160  -6.108
  230    HG1  THR  29           HG1      THR  29   9.960  -3.410  -7.414
  231   1HG2  THR  29          HG21      THR  29   7.965  -2.055  -4.311
  232   2HG2  THR  29          HG23      THR  29   7.942  -1.248  -5.879
  233   3HG2  THR  29          HG22      THR  29   6.749  -2.495  -5.511
  234    H    GLU  30           HN       GLU  30  12.298  -4.260  -5.186
  235    HA   GLU  30           HA       GLU  30  11.626  -6.979  -6.101
  236   1HB   GLU  30           HB2      GLU  30  13.932  -5.160  -6.264
  237   2HB   GLU  30           HB1      GLU  30  14.381  -6.834  -5.939
  238   1HG   GLU  30           HG2      GLU  30  12.503  -7.199  -7.875
  239   2HG   GLU  30           HG1      GLU  30  13.164  -5.638  -8.360
  240    H    LEU  31           HN       LEU  31  10.682  -7.146  -3.768
  241    HA   LEU  31           HA       LEU  31  12.504  -8.815  -2.247
  242   1HB   LEU  31           HB2      LEU  31  11.602  -7.288  -0.135
  243   2HB   LEU  31           HB1      LEU  31  13.224  -7.221  -0.805
  244    HG   LEU  31           HG       LEU  31  11.711  -5.488  -2.441
  245   1HD1  LEU  31          HD13      LEU  31  10.039  -5.769  -0.447
  246   2HD1  LEU  31          HD12      LEU  31  11.184  -4.741   0.416
  247   3HD1  LEU  31          HD11      LEU  31  10.399  -4.152  -1.051
  248   1HD2  LEU  31          HD22      LEU  31  13.710  -5.218  -0.219
  249   2HD2  LEU  31          HD21      LEU  31  13.904  -4.869  -1.937
  250   3HD2  LEU  31          HD23      LEU  31  12.984  -3.768  -0.912
  251    H    THR  32           HN       THR  32  11.074 -10.444  -2.438
  252    HA   THR  32           HA       THR  32   8.330 -10.490  -2.537
  253    HB   THR  32           HB       THR  32   8.507 -12.779  -1.443
  254    HG1  THR  32           HG1      THR  32  10.289 -13.235  -0.448
  255   1HG2  THR  32          HG21      THR  32  10.191 -11.862  -3.765
  256   2HG2  THR  32          HG23      THR  32  10.176 -13.559  -3.286
  257   3HG2  THR  32          HG22      THR  32   8.679 -12.771  -3.786
  258    H    VAL  33           HN       VAL  33   6.639 -10.800  -1.055
  259    HA   VAL  33           HA       VAL  33   7.152 -10.271   1.811
  260    HB   VAL  33           HB       VAL  33   5.414  -8.511   1.847
  261   1HG1  VAL  33          HG13      VAL  33   7.796  -7.895   1.501
  262   2HG1  VAL  33          HG12      VAL  33   7.545  -7.981  -0.242
  263   3HG1  VAL  33          HG11      VAL  33   6.697  -6.764   0.711
  264   1HG2  VAL  33          HG22      VAL  33   5.045  -9.488  -0.898
  265   2HG2  VAL  33          HG21      VAL  33   3.921  -8.608   0.138
  266   3HG2  VAL  33          HG23      VAL  33   5.133  -7.730  -0.796
  267    H    THR  34           HN       THR  34   3.982  -9.842   1.807
  268    HA   THR  34           HA       THR  34   3.376 -12.756   1.531
  269    HB   THR  34           HB       THR  34   3.061 -10.933   3.775
  270    HG1  THR  34           HG1      THR  34   3.669 -12.767   4.546
  271   1HG2  THR  34          HG22      THR  34   0.590 -12.389   2.788
  272   2HG2  THR  34          HG21      THR  34   0.771 -11.727   4.409
  273   3HG2  THR  34          HG23      THR  34   0.768 -10.649   3.015
  274    H    ASP  35           HN       ASP  35   1.594 -13.292   0.338
  275    HA   ASP  35           HA       ASP  35   0.189 -11.194  -1.142
  276   1HB   ASP  35           HB2      ASP  35   0.728 -13.833  -1.672
  277   2HB   ASP  35           HB1      ASP  35  -0.946 -13.931  -1.131
  278    H    ILE  36           HN       ILE  36  -2.105 -10.709  -0.849
  279    HA   ILE  36           HA       ILE  36  -3.304 -11.871   1.612
  280    HB   ILE  36           HB       ILE  36  -3.751  -9.768   2.598
  281   1HG1  ILE  36          HG12      ILE  36  -2.846  -8.484  -0.010
  282   2HG1  ILE  36          HG11      ILE  36  -4.516  -8.592   0.538
  283   1HG2  ILE  36          HG22      ILE  36  -1.345 -10.540   2.612
  284   2HG2  ILE  36          HG21      ILE  36  -1.046  -9.416   1.287
  285   3HG2  ILE  36          HG23      ILE  36  -1.560  -8.808   2.860
  286   1HD1  ILE  36          HD12      ILE  36  -2.362  -7.255   2.184
  287   2HD1  ILE  36          HD11      ILE  36  -3.346  -6.382   1.013
  288   3HD1  ILE  36          HD13      ILE  36  -4.107  -7.156   2.398
  289    H    PHE  37           HN       PHE  37  -3.824 -12.066  -1.365
  290    HA   PHE  37           HA       PHE  37  -6.646 -11.072  -1.312
  291   1HB   PHE  37           HB2      PHE  37  -4.856 -11.597  -3.704
  292   2HB   PHE  37           HB1      PHE  37  -6.530 -11.042  -3.779
  293    HD1  PHE  37           HD2      PHE  37  -6.968  -8.988  -2.010
  294    HD2  PHE  37           HD1      PHE  37  -3.258  -9.919  -3.969
  295    HE1  PHE  37           HE2      PHE  37  -6.215  -6.647  -1.698
  296    HE2  PHE  37           HE1      PHE  37  -2.507  -7.576  -3.655
  297    HZ   PHE  37           HZ       PHE  37  -3.986  -5.942  -2.519
  298    H    ALA  38           HN       ALA  38  -5.927 -13.535  -0.109
  299    HA   ALA  38           HA       ALA  38  -6.760 -15.603  -2.076
  300   1HB   ALA  38           HB2      ALA  38  -4.809 -16.041  -0.566
  301   2HB   ALA  38           HB1      ALA  38  -5.900 -15.938   0.815
  302   3HB   ALA  38           HB3      ALA  38  -6.105 -17.223  -0.376
  303    H    ALA  39           HN       ALA  39  -8.077 -13.633   0.436
  304    HA   ALA  39           HA       ALA  39 -10.590 -15.231   0.304
  305   1HB   ALA  39           HB3      ALA  39  -8.958 -14.607   2.669
  306   2HB   ALA  39           HB2      ALA  39 -10.649 -14.135   2.839
  307   3HB   ALA  39           HB1      ALA  39 -10.233 -15.809   2.469
  308    H    SER  40           HN       SER  40 -12.490 -13.928   0.371
  309    HA   SER  40           HA       SER  40 -12.256 -11.042   0.820
  310   1HB   SER  40           HB2      SER  40 -11.726 -11.964  -1.751
  311   2HB   SER  40           HB1      SER  40 -13.413 -11.467  -1.826
  312    HG   SER  40           HG       SER  40 -12.511  -9.528  -0.608
  313    H    LYS  41           HN       LYS  41 -13.836 -13.054   2.058
  314    HA   LYS  41           HA       LYS  41 -16.564 -12.347   1.051
  315   1HB   LYS  41           HB2      LYS  41 -16.587 -14.509   2.970
  316   2HB   LYS  41           HB1      LYS  41 -17.144 -14.514   1.297
  317   1HG   LYS  41           HG2      LYS  41 -14.734 -14.796   0.591
  318   2HG   LYS  41           HG1      LYS  41 -14.332 -15.032   2.292
  319   1HD   LYS  41           HD2      LYS  41 -15.028 -17.168   2.223
  320   2HD   LYS  41           HD1      LYS  41 -16.595 -16.679   1.582
  321   1HE   LYS  41           HE2      LYS  41 -16.020 -17.588  -0.392
  322   2HE   LYS  41           HE1      LYS  41 -14.746 -16.381  -0.543
  323   1HZ   LYS  41           HZ3      LYS  41 -14.495 -18.987   0.857
  324   2HZ   LYS  41           HZ2      LYS  41 -13.861 -18.623  -0.678
  325   3HZ   LYS  41           HZ1      LYS  41 -13.269 -17.827   0.702
  326    H    ASP  42           HN       ASP  42 -15.348 -13.543   4.188
  327    HA   ASP  42           HA       ASP  42 -17.093 -11.838   5.690
  328   1HB   ASP  42           HB2      ASP  42 -15.775 -13.994   6.404
  329   2HB   ASP  42           HB1      ASP  42 -14.497 -12.849   6.818
  330    H    THR  43           HN       THR  43 -13.993 -11.285   4.203
  331    HA   THR  43           HA       THR  43 -13.700  -8.736   5.727
  332    HB   THR  43           HB       THR  43 -11.390  -8.717   4.817
  333    HG1  THR  43           HG1      THR  43 -10.735 -10.238   3.458
  334   1HG2  THR  43          HG21      THR  43 -12.481 -10.503   6.731
  335   2HG2  THR  43          HG23      THR  43 -11.253 -11.398   5.835
  336   3HG2  THR  43          HG22      THR  43 -10.830  -9.890   6.647
  337    H    THR  44           HN       THR  44 -14.372  -6.914   4.675
  338    HA   THR  44           HA       THR  44 -14.977  -7.046   1.799
  339    HB   THR  44           HB       THR  44 -15.097  -4.449   3.247
  340    HG1  THR  44           HG1      THR  44 -17.107  -5.230   4.210
  341   1HG2  THR  44          HG22      THR  44 -16.468  -5.900   1.089
  342   2HG2  THR  44          HG21      THR  44 -17.558  -5.011   2.154
  343   3HG2  THR  44          HG23      THR  44 -16.253  -4.165   1.321
  344    H    GLU  45           HN       GLU  45 -14.288  -4.380   1.047
  345    HA   GLU  45           HA       GLU  45 -11.525  -4.755   0.355
  346   1HB   GLU  45           HB2      GLU  45 -11.696  -2.722  -0.807
  347   2HB   GLU  45           HB1      GLU  45 -13.367  -3.286  -0.798
  348   1HG   GLU  45           HG2      GLU  45 -13.695  -1.925   1.327
  349   2HG   GLU  45           HG1      GLU  45 -12.111  -1.211   1.016
  350    H    LYS  46           HN       LYS  46 -13.189  -3.020   2.914
  351    HA   LYS  46           HA       LYS  46 -11.026  -1.456   3.895
  352   1HB   LYS  46           HB2      LYS  46 -13.610  -2.480   4.953
  353   2HB   LYS  46           HB1      LYS  46 -12.431  -1.918   6.133
  354   1HG   LYS  46           HG2      LYS  46 -12.438   0.271   5.288
  355   2HG   LYS  46           HG1      LYS  46 -13.056  -0.240   3.718
  356   1HD   LYS  46           HD2      LYS  46 -14.982   0.665   4.661
  357   2HD   LYS  46           HD1      LYS  46 -15.142  -1.024   5.146
  358   1HE   LYS  46           HE2      LYS  46 -14.986  -0.484   7.327
  359   2HE   LYS  46           HE1      LYS  46 -13.511   0.437   7.045
  360   1HZ   LYS  46           HZ3      LYS  46 -16.243   1.452   6.501
  361   2HZ   LYS  46           HZ2      LYS  46 -15.359   1.786   7.913
  362   3HZ   LYS  46           HZ1      LYS  46 -14.793   2.329   6.407
  363    H    GLU  47           HN       GLU  47 -12.185  -4.654   5.054
  364    HA   GLU  47           HA       GLU  47 -10.095  -5.036   6.949
  365   1HB   GLU  47           HB2      GLU  47 -12.043  -6.792   5.537
  366   2HB   GLU  47           HB1      GLU  47 -10.642  -7.579   6.266
  367   1HG   GLU  47           HG2      GLU  47 -12.572  -7.417   7.842
  368   2HG   GLU  47           HG1      GLU  47 -11.146  -6.558   8.425
  369    H    THR  48           HN       THR  48 -10.322  -5.975   3.528
  370    HA   THR  48           HA       THR  48  -7.873  -7.375   3.325
  371    HB   THR  48           HB       THR  48  -9.862  -6.399   1.554
  372    HG1  THR  48           HG1      THR  48  -9.286  -8.353   1.068
  373   1HG2  THR  48          HG23      THR  48  -8.345  -4.492   1.091
  374   2HG2  THR  48          HG22      THR  48  -7.067  -5.633   0.660
  375   3HG2  THR  48          HG21      THR  48  -8.532  -5.540  -0.314
  376    H    PHE  49           HN       PHE  49  -8.543  -3.925   3.460
  377    HA   PHE  49           HA       PHE  49  -5.894  -3.113   2.626
  378   1HB   PHE  49           HB2      PHE  49  -8.126  -1.668   4.066
  379   2HB   PHE  49           HB1      PHE  49  -6.583  -0.897   3.698
  380    HD1  PHE  49           HD2      PHE  49  -5.901  -1.979   1.055
  381    HD2  PHE  49           HD1      PHE  49  -9.705  -0.727   2.612
  382    HE1  PHE  49           HE2      PHE  49  -6.695  -1.525  -1.246
  383    HE2  PHE  49           HE1      PHE  49 -10.494  -0.267   0.310
  384    HZ   PHE  49           HZ       PHE  49  -8.992  -0.669  -1.621
  385    H    CYS  50           HN       CYS  50  -7.385  -3.832   5.773
  386    HA   CYS  50           HA       CYS  50  -5.217  -2.793   7.352
  387   1HB   CYS  50           HB2      CYS  50  -6.230  -3.822   9.187
  388   2HB   CYS  50           HB1      CYS  50  -7.597  -3.669   8.090
  389    NH1  ARG  51           NH2      ARG  51  -7.274 -12.326   4.665
  390    NH2  ARG  51           NH1      ARG  51  -6.999 -13.063   6.783
  391    H    ARG  51           HN       ARG  51  -5.702  -5.832   5.626
  392    HA   ARG  51           HA       ARG  51  -3.419  -7.184   6.806
  393   1HB   ARG  51           HB2      ARG  51  -4.847  -7.616   4.159
  394   2HB   ARG  51           HB1      ARG  51  -3.623  -8.699   4.821
  395   1HG   ARG  51           HG2      ARG  51  -5.070  -8.939   6.876
  396   2HG   ARG  51           HG1      ARG  51  -6.321  -8.031   6.025
  397   1HD   ARG  51           HD2      ARG  51  -6.838  -9.775   4.655
  398   2HD   ARG  51           HD1      ARG  51  -5.157 -10.280   4.500
  399    HE   ARG  51           HE       ARG  51  -5.815 -10.936   7.110
  400   1HH1  ARG  51          HH21      ARG  51  -7.138 -11.635   3.958
  401   2HH1  ARG  51          HH22      ARG  51  -7.768 -13.168   4.446
  402   1HH2  ARG  51          HH11      ARG  51  -6.647 -12.934   7.711
  403   2HH2  ARG  51          HH12      ARG  51  -7.494 -13.899   6.548
  404    H    ALA  52           HN       ALA  52  -3.972  -5.325   3.829
  405    HA   ALA  52           HA       ALA  52  -1.213  -5.450   2.959
  406   1HB   ALA  52           HB2      ALA  52  -3.693  -4.394   1.974
  407   2HB   ALA  52           HB1      ALA  52  -2.476  -3.118   1.922
  408   3HB   ALA  52           HB3      ALA  52  -2.186  -4.649   1.094
  409    H    ALA  53           HN       ALA  53  -2.751  -3.744   5.484
  410    HA   ALA  53           HA       ALA  53  -1.061  -1.363   5.378
  411   1HB   ALA  53           HB2      ALA  53  -3.452  -1.812   6.530
  412   2HB   ALA  53           HB1      ALA  53  -2.412  -2.194   7.901
  413   3HB   ALA  53           HB3      ALA  53  -2.328  -0.601   7.148
  414    H    THR  54           HN       THR  54  -1.164  -4.468   7.053
  415    HA   THR  54           HA       THR  54   1.058  -3.906   8.820
  416    HB   THR  54           HB       THR  54  -0.391  -6.384   7.921
  417    HG1  THR  54           HG1      THR  54  -0.490  -4.728   9.947
  418   1HG2  THR  54          HG21      THR  54   2.319  -6.230   9.227
  419   2HG2  THR  54          HG23      THR  54   1.240  -7.591   9.533
  420   3HG2  THR  54          HG22      THR  54   1.794  -7.258   7.893
  421    H    VAL  55           HN       VAL  55   0.738  -5.622   5.702
  422    HA   VAL  55           HA       VAL  55   3.513  -6.228   5.394
  423    HB   VAL  55           HB       VAL  55   1.456  -5.653   3.235
  424   1HG1  VAL  55          HG11      VAL  55   4.204  -6.902   3.239
  425   2HG1  VAL  55          HG13      VAL  55   3.023  -7.303   1.992
  426   3HG1  VAL  55          HG12      VAL  55   3.573  -5.638   2.183
  427   1HG2  VAL  55          HG22      VAL  55   2.012  -7.988   5.001
  428   2HG2  VAL  55          HG21      VAL  55   0.497  -7.479   4.257
  429   3HG2  VAL  55          HG23      VAL  55   1.702  -8.342   3.301
  430    H    LEU  56           HN       LEU  56   1.602  -3.345   4.612
  431    HA   LEU  56           HA       LEU  56   3.686  -1.957   3.194
  432   1HB   LEU  56           HB2      LEU  56   1.019  -1.367   4.125
  433   2HB   LEU  56           HB1      LEU  56   2.099  -0.044   4.559
  434    HG   LEU  56           HG       LEU  56   2.972  -0.315   2.096
  435   1HD1  LEU  56          HD12      LEU  56   1.144  -2.355   2.084
  436   2HD1  LEU  56          HD11      LEU  56   0.197  -1.036   1.394
  437   3HD1  LEU  56          HD13      LEU  56   1.714  -1.523   0.636
  438   1HD2  LEU  56          HD22      LEU  56   0.306   0.909   2.864
  439   2HD2  LEU  56          HD21      LEU  56   1.880   1.706   2.859
  440   3HD2  LEU  56          HD23      LEU  56   1.125   1.234   1.336
  441    NH1  ARG  57           NH2      ARG  57   3.529  -3.116  12.150
  442    NH2  ARG  57           NH1      ARG  57   4.351  -2.374  14.117
  443    H    ARG  57           HN       ARG  57   2.909  -2.369   6.599
  444    HA   ARG  57           HA       ARG  57   4.529  -0.302   7.691
  445   1HB   ARG  57           HB2      ARG  57   2.945  -1.775   8.999
  446   2HB   ARG  57           HB1      ARG  57   4.121  -3.081   8.847
  447   1HG   ARG  57           HG2      ARG  57   5.151  -2.285  10.681
  448   2HG   ARG  57           HG1      ARG  57   5.598  -0.863   9.744
  449   1HD   ARG  57           HD2      ARG  57   4.099   0.442  10.815
  450   2HD   ARG  57           HD1      ARG  57   2.818  -0.759  10.680
  451    HE   ARG  57           HE       ARG  57   4.352  -0.191  13.021
  452   1HH1  ARG  57          HH21      ARG  57   3.208  -2.947  11.222
  453   2HH1  ARG  57          HH22      ARG  57   3.488  -4.041  12.527
  454   1HH2  ARG  57          HH11      ARG  57   4.672  -1.626  14.698
  455   2HH2  ARG  57          HH12      ARG  57   4.293  -3.303  14.484
  456    H    GLN  58           HN       GLN  58   5.278  -3.671   6.812
  457    HA   GLN  58           HA       GLN  58   8.071  -3.537   7.475
  458   1HB   GLN  58           HB2      GLN  58   6.628  -5.256   5.433
  459   2HB   GLN  58           HB1      GLN  58   8.282  -5.519   5.989
  460   1HG   GLN  58           HG2      GLN  58   6.358  -5.216   8.185
  461   2HG   GLN  58           HG1      GLN  58   6.025  -6.608   7.155
  462   1HE2  GLN  58          HE22      GLN  58   8.809  -7.102   9.860
  463   2HE2  GLN  58          HE21      GLN  58   7.445  -6.096   9.966
  464    H    PHE  59           HN       PHE  59   6.199  -2.520   4.692
  465    HA   PHE  59           HA       PHE  59   8.210  -2.271   2.730
  466   1HB   PHE  59           HB2      PHE  59   5.612  -1.744   2.703
  467   2HB   PHE  59           HB1      PHE  59   6.159  -0.107   3.050
  468    HD1  PHE  59           HD2      PHE  59   8.446   0.451   1.546
  469    HD2  PHE  59           HD1      PHE  59   5.183  -2.120   0.448
  470    HE1  PHE  59           HE2      PHE  59   8.994   0.780  -0.845
  471    HE2  PHE  59           HE1      PHE  59   5.731  -1.784  -1.947
  472    HZ   PHE  59           HZ       PHE  59   7.636  -0.335  -2.593
  473    OH   TYR  60           OH       TYR  60   7.388   4.010  10.789
  474    H    TYR  60           HN       TYR  60   7.014   0.433   4.774
  475    HA   TYR  60           HA       TYR  60   9.491   1.920   4.248
  476   1HB   TYR  60           HB2      TYR  60   8.226   3.724   4.715
  477   2HB   TYR  60           HB1      TYR  60   6.859   2.618   4.836
  478    HD1  TYR  60           HD2      TYR  60   6.305   1.586   7.084
  479    HD2  TYR  60           HD1      TYR  60   9.093   4.825   6.639
  480    HE1  TYR  60           HE2      TYR  60   6.116   2.081   9.506
  481    HE2  TYR  60           HE1      TYR  60   8.900   5.320   9.061
  482    HH   TYR  60           HH       TYR  60   8.267   3.971  11.171
  483    H    SER  61           HN       SER  61   8.784  -0.485   6.460
  484    HA   SER  61           HA       SER  61  10.151   0.760   8.746
  485   1HB   SER  61           HB2      SER  61   8.430  -0.770   9.348
  486   2HB   SER  61           HB1      SER  61   9.021  -1.991   8.226
  487    HG   SER  61           HG       SER  61  10.696  -1.028  10.266
  488    H    HIS  62           HN       HIS  62  10.809  -2.073   6.651
  489    HA   HIS  62           HA       HIS  62  13.560  -2.231   7.597
  490   1HB   HIS  62           HB2      HIS  62  11.991  -4.123   6.654
  491   2HB   HIS  62           HB1      HIS  62  12.607  -3.583   5.092
  492    HD1  HIS  62           HD1      HIS  62  15.076  -4.050   4.550
  493    HD2  HIS  62           HD2      HIS  62  13.986  -5.266   8.384
  494    HE1  HIS  62           HE1      HIS  62  16.986  -5.463   5.422
  495    H    HIS  63           HN       HIS  63  11.912  -0.711   4.892
  496    HA   HIS  63           HA       HIS  63  14.299  -0.335   3.286
  497   1HB   HIS  63           HB2      HIS  63  11.523   0.810   3.263
  498   2HB   HIS  63           HB1      HIS  63  12.777   1.543   2.268
  499    HD1  HIS  63           HD1      HIS  63  12.993   0.543   0.002
  500    HD2  HIS  63           HD2      HIS  63  11.459  -2.201   2.740
  501    HE1  HIS  63           HE1      HIS  63  12.499  -1.573  -1.303
  502    H    GLU  64           HN       GLU  64  12.321   2.054   5.065
  503    HA   GLU  64           HA       GLU  64  14.162   4.179   4.911
  504   1HB   GLU  64           HB2      GLU  64  11.736   4.189   5.754
  505   2HB   GLU  64           HB1      GLU  64  12.402   3.699   7.312
  506   1HG   GLU  64           HG2      GLU  64  14.027   5.704   6.992
  507   2HG   GLU  64           HG1      GLU  64  12.855   6.260   5.798
  508    H    LYS  65           HN       LYS  65  14.235   1.340   6.952
  509    HA   LYS  65           HA       LYS  65  16.417   2.563   8.572
  510   1HB   LYS  65           HB2      LYS  65  14.261   0.919   9.272
  511   2HB   LYS  65           HB1      LYS  65  15.669  -0.141   9.335
  512   1HG   LYS  65           HG2      LYS  65  15.510   2.575  10.673
  513   2HG   LYS  65           HG1      LYS  65  15.245   1.040  11.501
  514   1HD   LYS  65           HD2      LYS  65  17.631   0.563  10.244
  515   2HD   LYS  65           HD1      LYS  65  17.769   2.284  10.607
  516   1HE   LYS  65           HE2      LYS  65  16.839   1.519  12.972
  517   2HE   LYS  65           HE1      LYS  65  17.518  -0.033  12.487
  518   1HZ   LYS  65           HZ2      LYS  65  19.559   1.424  11.870
  519   2HZ   LYS  65           HZ1      LYS  65  18.883   2.518  12.979
  520   3HZ   LYS  65           HZ3      LYS  65  19.307   0.955  13.483
  521    H    ASP  66           HN       ASP  66  17.007   1.910   5.881
  522    HA   ASP  66           HA       ASP  66  19.248   0.094   6.306
  523   1HB   ASP  66           HB2      ASP  66  17.077  -1.300   5.729
  524   2HB   ASP  66           HB1      ASP  66  17.424  -0.764   4.084
  525    H    THR  67           HN       THR  67  20.806   0.297   4.622
  526    HA   THR  67           HA       THR  67  20.443   2.726   2.991
  527    HB   THR  67           HB       THR  67  22.899   2.335   2.472
  528    HG1  THR  67           HG1      THR  67  23.770   0.818   4.165
  529   1HG2  THR  67          HG21      THR  67  21.683   2.898   5.114
  530   2HG2  THR  67          HG23      THR  67  23.413   2.552   5.127
  531   3HG2  THR  67          HG22      THR  67  22.787   3.878   4.149
  532    NH1  ARG  68           NH2      ARG  68  16.348  -4.770  -2.871
  533    NH2  ARG  68           NH1      ARG  68  17.815  -4.877  -4.585
  534    H    ARG  68           HN       ARG  68  19.667  -0.446   2.468
  535    HA   ARG  68           HA       ARG  68  20.864  -0.974  -0.076
  536   1HB   ARG  68           HB2      ARG  68  19.529  -2.558   1.514
  537   2HB   ARG  68           HB1      ARG  68  18.114  -1.954   0.652
  538   1HG   ARG  68           HG2      ARG  68  20.120  -2.570  -1.285
  539   2HG   ARG  68           HG1      ARG  68  19.972  -3.953  -0.200
  540   1HD   ARG  68           HD2      ARG  68  17.714  -4.281  -0.716
  541   2HD   ARG  68           HD1      ARG  68  17.495  -2.617  -1.254
  542    HE   ARG  68           HE       ARG  68  19.321  -3.694  -3.054
  543   1HH1  ARG  68          HH21      ARG  68  16.111  -4.493  -1.941
  544   2HH1  ARG  68          HH22      ARG  68  15.672  -5.249  -3.432
  545   1HH2  ARG  68          HH11      ARG  68  18.715  -4.680  -4.973
  546   2HH2  ARG  68          HH12      ARG  68  17.128  -5.355  -5.134
  547    H    CYS  69           HN       CYS  69  17.628   0.365   0.720
  548    HA   CYS  69           HA       CYS  69  17.255   1.075  -2.126
  549   1HB   CYS  69           HB2      CYS  69  15.523   0.773   0.241
  550   2HB   CYS  69           HB1      CYS  69  15.084   2.118  -0.811
  551    H    LEU  70           HN       LEU  70  19.318   2.528  -0.444
  552    HA   LEU  70           HA       LEU  70  18.094   5.199  -0.174
  553   1HB   LEU  70           HB2      LEU  70  20.534   3.886   0.792
  554   2HB   LEU  70           HB1      LEU  70  20.817   5.529   0.218
  555    HG   LEU  70           HG       LEU  70  18.712   4.712   2.246
  556   1HD1  LEU  70          HD13      LEU  70  21.452   5.949   2.452
  557   2HD1  LEU  70          HD12      LEU  70  20.226   6.277   3.677
  558   3HD1  LEU  70          HD11      LEU  70  20.767   4.624   3.391
  559   1HD2  LEU  70          HD23      LEU  70  19.387   7.280   0.840
  560   2HD2  LEU  70          HD22      LEU  70  17.804   6.613   1.243
  561   3HD2  LEU  70          HD21      LEU  70  18.799   7.346   2.502
  562    H    GLY  71           HN       GLY  71  21.320   4.532  -1.532
  563   1HA   GLY  71           HA2      GLY  71  21.032   4.823  -4.218
  564   2HA   GLY  71           HA1      GLY  71  20.763   6.475  -3.664
  565    H    ALA  72           HN       ALA  72  22.683   7.349  -4.518
  566    HA   ALA  72           HA       ALA  72  25.129   6.668  -2.997
  567   1HB   ALA  72           HB2      ALA  72  24.701   5.638  -5.578
  568   2HB   ALA  72           HB1      ALA  72  25.804   6.996  -5.797
  569   3HB   ALA  72           HB3      ALA  72  26.230   5.682  -4.699
  570    H    THR  73           HN       THR  73  23.780   8.681  -5.632
  571    HA   THR  73           HA       THR  73  25.620  10.873  -4.919
  572    HB   THR  73           HB       THR  73  24.881  11.944  -6.885
  573    HG1  THR  73           HG1      THR  73  22.850  10.801  -7.843
  574   1HG2  THR  73          HG21      THR  73  25.989   9.663  -7.214
  575   2HG2  THR  73          HG23      THR  73  24.376   9.045  -7.569
  576   3HG2  THR  73          HG22      THR  73  25.087  10.296  -8.590
  577    H    ALA  74           HN       ALA  74  24.120  13.130  -5.197
  578    HA   ALA  74           HA       ALA  74  22.522  13.088  -2.722
  579   1HB   ALA  74           HB3      ALA  74  23.346  15.355  -4.559
  580   2HB   ALA  74           HB2      ALA  74  22.447  15.565  -3.056
  581   3HB   ALA  74           HB1      ALA  74  24.091  14.927  -3.019
  582    H    GLN  75           HN       GLN  75  21.963  13.100  -6.162
  583    HA   GLN  75           HA       GLN  75  19.264  14.199  -5.964
  584   1HB   GLN  75           HB2      GLN  75  20.982  13.051  -8.115
  585   2HB   GLN  75           HB1      GLN  75  19.236  12.982  -8.358
  586   1HG   GLN  75           HG2      GLN  75  19.041  15.248  -8.576
  587   2HG   GLN  75           HG1      GLN  75  20.275  15.570  -7.358
  588   1HE2  GLN  75          HE22      GLN  75  21.504  16.347 -10.902
  589   2HE2  GLN  75          HE21      GLN  75  20.041  16.730 -10.130
  590    H    GLN  76           HN       GLN  76  20.731  10.971  -6.116
  591    HA   GLN  76           HA       GLN  76  18.287   9.509  -6.387
  592   1HB   GLN  76           HB2      GLN  76  20.972   8.835  -6.224
  593   2HB   GLN  76           HB1      GLN  76  20.312   8.192  -4.719
  594   1HG   GLN  76           HG2      GLN  76  19.095   6.596  -5.790
  595   2HG   GLN  76           HG1      GLN  76  18.628   7.693  -7.091
  596   1HE2  GLN  76          HE22      GLN  76  20.796   5.540  -8.983
  597   2HE2  GLN  76          HE21      GLN  76  19.173   5.777  -8.545
  598    H    PHE  77           HN       PHE  77  19.919  10.946  -3.622
  599    HA   PHE  77           HA       PHE  77  18.430   9.621  -1.568
  600   1HB   PHE  77           HB2      PHE  77  20.393  11.639  -1.684
  601   2HB   PHE  77           HB1      PHE  77  19.002  12.384  -0.896
  602    HD1  PHE  77           HD1      PHE  77  21.497   9.675  -0.708
  603    HD2  PHE  77           HD2      PHE  77  18.171  11.568   1.246
  604    HE1  PHE  77           HE1      PHE  77  22.027   8.451   1.381
  605    HE2  PHE  77           HE2      PHE  77  18.702  10.342   3.336
  606    HZ   PHE  77           HZ       PHE  77  20.630   8.784   3.403
  607    H    HIS  78           HN       HIS  78  17.739  12.399  -3.620
  608    HA   HIS  78           HA       HIS  78  15.403  13.296  -2.200
  609   1HB   HIS  78           HB2      HIS  78  16.314  14.846  -3.746
  610   2HB   HIS  78           HB1      HIS  78  16.386  13.643  -5.034
  611    HD1  HIS  78           HD1      HIS  78  14.057  12.891  -6.082
  612    HD2  HIS  78           HD2      HIS  78  13.856  16.183  -3.531
  613    HE1  HIS  78           HE1      HIS  78  11.800  13.969  -6.479
  614    NH1  ARG  79           NH2      ARG  79  15.034   9.104 -11.315
  615    NH2  ARG  79           NH1      ARG  79  13.910  11.047 -11.562
  616    H    ARG  79           HN       ARG  79  15.875  11.113  -4.967
  617    HA   ARG  79           HA       ARG  79  13.159  10.549  -5.516
  618   1HB   ARG  79           HB2      ARG  79  15.440   8.553  -5.634
  619   2HB   ARG  79           HB1      ARG  79  13.946   8.513  -6.570
  620   1HG   ARG  79           HG2      ARG  79  14.869  11.010  -7.182
  621   2HG   ARG  79           HG1      ARG  79  16.386  10.131  -6.984
  622   1HD   ARG  79           HD2      ARG  79  16.099   9.093  -8.960
  623   2HD   ARG  79           HD1      ARG  79  14.505   8.520  -8.473
  624    HE   ARG  79           HE       ARG  79  14.094  11.184  -9.120
  625   1HH1  ARG  79          HH21      ARG  79  15.482   8.422 -10.739
  626   2HH1  ARG  79          HH22      ARG  79  15.003   8.972 -12.306
  627   1HH2  ARG  79          HH11      ARG  79  13.489  11.865 -11.168
  628   2HH2  ARG  79          HH12      ARG  79  13.887  10.900 -12.551
  629    H    HIS  80           HN       HIS  80  15.369   8.720  -3.376
  630    HA   HIS  80           HA       HIS  80  13.369   6.963  -2.350
  631   1HB   HIS  80           HB2      HIS  80  15.811   6.573  -2.123
  632   2HB   HIS  80           HB1      HIS  80  15.909   7.935  -1.006
  633    HD1  HIS  80           HD1      HIS  80  13.938   4.675  -1.309
  634    HD2  HIS  80           HD2      HIS  80  15.553   7.170   1.615
  635    HE1  HIS  80           HE1      HIS  80  13.530   3.532   0.915
  636    H    LYS  81           HN       LYS  81  14.169  10.281  -1.589
  637    HA   LYS  81           HA       LYS  81  13.040  10.391   1.039
  638   1HB   LYS  81           HB2      LYS  81  14.475  12.146  -0.237
  639   2HB   LYS  81           HB1      LYS  81  12.933  12.696  -0.895
  640   1HG   LYS  81           HG2      LYS  81  12.987  14.000   1.003
  641   2HG   LYS  81           HG1      LYS  81  12.234  12.562   1.691
  642   1HD   LYS  81           HD2      LYS  81  14.554  11.736   2.267
  643   2HD   LYS  81           HD1      LYS  81  15.163  13.321   1.790
  644   1HE   LYS  81           HE2      LYS  81  12.915  13.105   3.778
  645   2HE   LYS  81           HE1      LYS  81  14.587  12.900   4.303
  646   1HZ   LYS  81           HZ3      LYS  81  15.105  15.050   3.287
  647   2HZ   LYS  81           HZ2      LYS  81  13.470  15.252   2.873
  648   3HZ   LYS  81           HZ1      LYS  81  13.935  15.193   4.506
  649    H    GLN  82           HN       GLN  82  11.621  10.807  -2.181
  650    HA   GLN  82           HA       GLN  82   9.017  11.612  -1.224
  651   1HB   GLN  82           HB2      GLN  82  10.140  11.705  -3.639
  652   2HB   GLN  82           HB1      GLN  82   9.330  10.150  -3.816
  653   1HG   GLN  82           HG2      GLN  82   7.513  11.382  -4.399
  654   2HG   GLN  82           HG1      GLN  82   7.352  11.670  -2.668
  655   1HE2  GLN  82          HE22      GLN  82   7.344  15.076  -3.893
  656   2HE2  GLN  82          HE21      GLN  82   6.303  13.768  -3.599
  657    H    LEU  83           HN       LEU  83  10.595   8.511  -1.672
  658    HA   LEU  83           HA       LEU  83   8.157   6.938  -1.640
  659   1HB   LEU  83           HB2      LEU  83  10.249   6.053  -2.588
  660   2HB   LEU  83           HB1      LEU  83  11.013   6.139  -1.002
  661    HG   LEU  83           HG       LEU  83   8.735   4.692  -0.446
  662   1HD1  LEU  83          HD13      LEU  83   8.659   4.710  -3.138
  663   2HD1  LEU  83          HD12      LEU  83   9.722   3.325  -2.889
  664   3HD1  LEU  83          HD11      LEU  83   8.109   3.337  -2.178
  665   1HD2  LEU  83          HD21      LEU  83  11.313   4.345  -0.021
  666   2HD2  LEU  83          HD23      LEU  83  10.225   2.956   0.009
  667   3HD2  LEU  83          HD22      LEU  83  11.199   3.284  -1.424
  668    H    ILE  84           HN       ILE  84  10.569   7.786   0.862
  669    HA   ILE  84           HA       ILE  84   9.299   6.291   2.954
  670    HB   ILE  84           HB       ILE  84  10.980   8.798   3.246
  671   1HG1  ILE  84          HG12      ILE  84  12.203   7.239   1.862
  672   2HG1  ILE  84          HG11      ILE  84  12.863   7.127   3.494
  673   1HG2  ILE  84          HG21      ILE  84   9.791   8.006   5.288
  674   2HG2  ILE  84          HG23      ILE  84  10.550   6.427   5.090
  675   3HG2  ILE  84          HG22      ILE  84  11.541   7.844   5.431
  676   1HD1  ILE  84          HD11      ILE  84  11.031   5.241   3.770
  677   2HD1  ILE  84          HD13      ILE  84  11.139   5.173   2.011
  678   3HD1  ILE  84          HD12      ILE  84  12.572   4.876   2.994
  679    NH1  ARG  85           NH2      ARG  85   8.139  16.716   1.743
  680    NH2  ARG  85           NH1      ARG  85   8.725  17.240   3.860
  681    H    ARG  85           HN       ARG  85   8.866   9.600   1.776
  682    HA   ARG  85           HA       ARG  85   7.169  10.474   3.919
  683   1HB   ARG  85           HB2      ARG  85   8.059  11.493   1.339
  684   2HB   ARG  85           HB1      ARG  85   6.369  11.891   1.651
  685   1HG   ARG  85           HG2      ARG  85   7.110  12.662   3.967
  686   2HG   ARG  85           HG1      ARG  85   8.767  12.534   3.378
  687   1HD   ARG  85           HD2      ARG  85   8.222  14.107   1.539
  688   2HD   ARG  85           HD1      ARG  85   6.582  14.257   2.167
  689    HE   ARG  85           HE       ARG  85   8.219  14.888   4.329
  690   1HH1  ARG  85          HH21      ARG  85   7.824  16.058   1.062
  691   2HH1  ARG  85          HH22      ARG  85   8.322  17.661   1.470
  692   1HH2  ARG  85          HH11      ARG  85   8.860  16.977   4.815
  693   2HH2  ARG  85          HH12      ARG  85   8.903  18.181   3.570
  694    H    PHE  86           HN       PHE  86   6.354   9.282   0.647
  695    HA   PHE  86           HA       PHE  86   3.545   9.361   0.905
  696   1HB   PHE  86           HB2      PHE  86   4.273   8.866  -1.260
  697   2HB   PHE  86           HB1      PHE  86   5.428   7.657  -0.704
  698    HD1  PHE  86           HD2      PHE  86   4.685   5.392  -0.081
  699    HD2  PHE  86           HD1      PHE  86   1.911   8.327  -1.535
  700    HE1  PHE  86           HE2      PHE  86   2.995   3.617  -0.426
  701    HE2  PHE  86           HE1      PHE  86   0.221   6.546  -1.891
  702    HZ   PHE  86           HZ       PHE  86   0.763   4.195  -1.336
  703    H    LEU  87           HN       LEU  87   5.746   6.661   1.667
  704    HA   LEU  87           HA       LEU  87   3.875   4.755   2.486
  705   1HB   LEU  87           HB2      LEU  87   6.669   5.379   3.427
  706   2HB   LEU  87           HB1      LEU  87   5.743   4.063   4.144
  707    HG   LEU  87           HG       LEU  87   6.039   4.295   1.154
  708   1HD1  LEU  87          HD12      LEU  87   8.260   4.193   2.641
  709   2HD1  LEU  87          HD11      LEU  87   7.828   2.484   2.721
  710   3HD1  LEU  87          HD13      LEU  87   8.101   3.253   1.157
  711   1HD2  LEU  87          HD23      LEU  87   5.400   2.095   3.134
  712   2HD2  LEU  87          HD22      LEU  87   4.366   2.731   1.854
  713   3HD2  LEU  87          HD21      LEU  87   5.784   1.767   1.444
  714    H    LYS  88           HN       LYS  88   5.409   7.250   4.537
  715    HA   LYS  88           HA       LYS  88   4.083   6.507   6.939
  716   1HB   LYS  88           HB2      LYS  88   5.304   9.078   5.964
  717   2HB   LYS  88           HB1      LYS  88   4.533   8.974   7.547
  718   1HG   LYS  88           HG2      LYS  88   6.074   6.736   7.606
  719   2HG   LYS  88           HG1      LYS  88   7.073   7.785   6.600
  720   1HD   LYS  88           HD2      LYS  88   7.666   9.050   8.369
  721   2HD   LYS  88           HD1      LYS  88   5.985   9.250   8.861
  722   1HE   LYS  88           HE2      LYS  88   6.097   7.564  10.389
  723   2HE   LYS  88           HE1      LYS  88   7.115   6.562   9.354
  724   1HZ   LYS  88           HZ1      LYS  88   8.983   8.049   9.887
  725   2HZ   LYS  88           HZ3      LYS  88   7.987   8.900  10.962
  726   3HZ   LYS  88           HZ2      LYS  88   8.361   7.270  11.262
  727    NH1  ARG  89           NH2      ARG  89  -2.960  10.665   0.191
  728    NH2  ARG  89           NH1      ARG  89  -4.671  11.078   1.606
  729    H    ARG  89           HN       ARG  89   2.999   8.605   4.287
  730    HA   ARG  89           HA       ARG  89   0.718   9.669   5.716
  731   1HB   ARG  89           HB2      ARG  89   1.749  10.646   3.609
  732   2HB   ARG  89           HB1      ARG  89   0.981   9.333   2.717
  733   1HG   ARG  89           HG2      ARG  89  -1.006  10.453   4.416
  734   2HG   ARG  89           HG1      ARG  89  -0.189  11.795   3.611
  735   1HD   ARG  89           HD2      ARG  89  -0.742  11.017   1.469
  736   2HD   ARG  89           HD1      ARG  89  -1.036   9.374   2.038
  737    HE   ARG  89           HE       ARG  89  -2.952  10.883   3.348
  738   1HH1  ARG  89          HH21      ARG  89  -1.996  10.481   0.023
  739   2HH1  ARG  89          HH22      ARG  89  -3.595  10.729  -0.579
  740   1HH2  ARG  89          HH11      ARG  89  -5.019  11.209   2.535
  741   2HH2  ARG  89          HH12      ARG  89  -5.294  11.137   0.826
  742    H    LEU  90           HN       LEU  90   0.775   7.346   3.018
  743    HA   LEU  90           HA       LEU  90  -1.896   6.448   3.339
  744   1HB   LEU  90           HB2      LEU  90  -0.464   6.127   1.311
  745   2HB   LEU  90           HB1      LEU  90   0.430   4.887   2.189
  746    HG   LEU  90           HG       LEU  90  -2.380   4.372   2.458
  747   1HD1  LEU  90          HD12      LEU  90  -1.990   5.711   0.113
  748   2HD1  LEU  90          HD11      LEU  90  -1.693   4.050  -0.399
  749   3HD1  LEU  90          HD13      LEU  90  -3.231   4.481   0.348
  750   1HD2  LEU  90          HD22      LEU  90   0.036   3.023   1.274
  751   2HD2  LEU  90          HD21      LEU  90  -0.897   2.566   2.700
  752   3HD2  LEU  90          HD23      LEU  90  -1.561   2.298   1.088
  753    H    ASP  91           HN       ASP  91   0.864   5.725   5.285
  754    HA   ASP  91           HA       ASP  91   0.361   3.053   6.053
  755   1HB   ASP  91           HB2      ASP  91   1.838   5.333   7.125
  756   2HB   ASP  91           HB1      ASP  91   1.163   4.321   8.401
  757    NH1  ARG  92           NH2      ARG  92   1.427   5.485  11.631
  758    NH2  ARG  92           NH1      ARG  92   1.168   5.826  13.848
  759    H    ARG  92           HN       ARG  92  -0.844   6.035   7.639
  760    HA   ARG  92           HA       ARG  92  -2.760   4.401   9.182
  761   1HB   ARG  92           HB2      ARG  92  -2.375   7.409   9.163
  762   2HB   ARG  92           HB1      ARG  92  -3.278   6.471  10.353
  763   1HG   ARG  92           HG2      ARG  92  -0.322   6.125   9.793
  764   2HG   ARG  92           HG1      ARG  92  -0.975   7.069  11.132
  765   1HD   ARG  92           HD2      ARG  92  -2.338   4.779  11.513
  766   2HD   ARG  92           HD1      ARG  92  -0.895   4.112  10.757
  767    HE   ARG  92           HE       ARG  92  -1.115   5.049  13.452
  768   1HH1  ARG  92          HH21      ARG  92   1.071   5.180  10.751
  769   2HH1  ARG  92          HH22      ARG  92   2.381   5.776  11.706
  770   1HH2  ARG  92          HH11      ARG  92   0.602   5.792  14.672
  771   2HH2  ARG  92          HH12      ARG  92   2.126   6.105  13.911
  772    H    ASN  93           HN       ASN  93  -2.710   6.478   6.367
  773    HA   ASN  93           HA       ASN  93  -5.607   6.857   6.323
  774   1HB   ASN  93           HB2      ASN  93  -3.409   8.030   5.035
  775   2HB   ASN  93           HB1      ASN  93  -4.303   7.212   3.753
  776   1HD2  ASN  93          HD22      ASN  93  -6.450   9.969   5.935
  777   2HD2  ASN  93          HD21      ASN  93  -5.365   8.944   6.744
  778    H    LEU  94           HN       LEU  94  -3.689   4.160   5.669
  779    HA   LEU  94           HA       LEU  94  -5.337   3.248   3.399
  780   1HB   LEU  94           HB2      LEU  94  -2.937   2.717   3.381
  781   2HB   LEU  94           HB1      LEU  94  -3.103   1.854   4.909
  782    HG   LEU  94           HG       LEU  94  -4.720   0.304   3.828
  783   1HD1  LEU  94          HD11      LEU  94  -3.983   1.892   1.350
  784   2HD1  LEU  94          HD13      LEU  94  -4.860   0.363   1.330
  785   3HD1  LEU  94          HD12      LEU  94  -5.579   1.781   2.091
  786   1HD2  LEU  94          HD21      LEU  94  -1.956   0.639   2.653
  787   2HD2  LEU  94          HD23      LEU  94  -2.495  -0.516   3.873
  788   3HD2  LEU  94          HD22      LEU  94  -2.993  -0.711   2.193
  789    CH2  TRP  95           CH2      TRP  95  -6.109  -0.967  13.274
  790    H    TRP  95           HN       TRP  95  -4.486   1.840   6.590
  791    HA   TRP  95           HA       TRP  95  -6.996   0.278   6.491
  792   1HB   TRP  95           HB2      TRP  95  -6.032  -1.142   7.963
  793   2HB   TRP  95           HB1      TRP  95  -4.548  -0.381   7.404
  794    HD1  TRP  95           HD1      TRP  95  -4.062   2.039   8.878
  795    HE1  TRP  95           HE1      TRP  95  -4.010   2.240  11.452
  796    HE3  TRP  95           HE3      TRP  95  -6.760  -2.105  10.125
  797    HZ2  TRP  95           HZ2      TRP  95  -4.985   0.811  13.737
  798    HZ3  TRP  95           HZ3      TRP  95  -7.177  -2.670  12.500
  799    HH2  TRP  95           HH2      TRP  95  -6.296  -1.218  14.308
  800    H    GLY  96           HN       GLY  96  -5.890   3.227   7.820
  801   1HA   GLY  96           HA2      GLY  96  -7.367   3.417  10.222
  802   2HA   GLY  96           HA1      GLY  96  -7.014   4.794   9.171
  803    H    LEU  97           HN       LEU  97  -8.395   3.538   6.866
  804    HA   LEU  97           HA       LEU  97 -11.075   4.526   7.390
  805   1HB   LEU  97           HB2      LEU  97  -9.608   3.325   5.081
  806   2HB   LEU  97           HB1      LEU  97 -11.368   3.212   5.060
  807    HG   LEU  97           HG       LEU  97 -10.878   5.839   5.852
  808   1HD1  LEU  97          HD13      LEU  97  -8.519   4.924   4.642
  809   2HD1  LEU  97          HD12      LEU  97  -9.355   5.817   3.373
  810   3HD1  LEU  97          HD11      LEU  97  -8.980   6.606   4.904
  811   1HD2  LEU  97          HD21      LEU  97 -12.424   4.569   4.046
  812   2HD2  LEU  97          HD23      LEU  97 -12.175   6.314   4.009
  813   3HD2  LEU  97          HD22      LEU  97 -11.233   5.267   2.948
  814    H    ALA  98           HN       ALA  98  -9.545   1.363   7.077
  815    HA   ALA  98           HA       ALA  98 -11.723  -0.359   7.020
  816   1HB   ALA  98           HB3      ALA  98  -9.206  -0.905   7.050
  817   2HB   ALA  98           HB2      ALA  98  -9.351  -0.875   8.807
  818   3HB   ALA  98           HB1      ALA  98 -10.284  -2.038   7.864
  819    H    GLY  99           HN       GLY  99 -10.250   1.113   9.916
  820   1HA   GLY  99           HA2      GLY  99 -11.225   1.548  12.020
  821   2HA   GLY  99           HA1      GLY  99 -12.794   1.195  11.293
  822    H    LEU 100           HN       LEU 100  -9.840  -0.755  11.842
  823    HA   LEU 100           HA       LEU 100 -11.483  -2.639  13.462
  824   1HB   LEU 100           HB2      LEU 100 -10.634  -3.111  10.785
  825   2HB   LEU 100           HB1      LEU 100  -9.659  -4.139  11.833
  826    HG   LEU 100           HG       LEU 100 -12.051  -4.554  12.974
  827   1HD1  LEU 100          HD13      LEU 100 -12.619  -3.231  10.451
  828   2HD1  LEU 100          HD12      LEU 100 -13.316  -4.851  10.486
  829   3HD1  LEU 100          HD11      LEU 100 -13.729  -3.685  11.744
  830   1HD2  LEU 100          HD23      LEU 100 -10.426  -6.207  11.951
  831   2HD2  LEU 100          HD22      LEU 100 -12.125  -6.638  11.759
  832   3HD2  LEU 100          HD21      LEU 100 -11.232  -5.940  10.406
  833    H    ASN 101           HN       ASN 101  -9.506  -4.591  13.795
  834    HA   ASN 101           HA       ASN 101  -7.306  -3.040  15.109
  835   1HB   ASN 101           HB2      ASN 101  -8.048  -5.775  16.067
  836   2HB   ASN 101           HB1      ASN 101  -7.438  -4.395  16.981
  837   1HD2  ASN 101          HD22      ASN 101 -10.781  -2.819  16.955
  838   2HD2  ASN 101          HD21      ASN 101  -9.198  -2.376  16.534
  839    H    SER 102           HN       SER 102  -5.758  -5.375  15.752
  840    HA   SER 102           HA       SER 102  -4.271  -5.730  13.355
  841   1HB   SER 102           HB2      SER 102  -4.437  -7.343  15.907
  842   2HB   SER 102           HB1      SER 102  -3.361  -7.803  14.590
  843    HG   SER 102           HG       SER 102  -3.350  -5.142  15.437
  844    H    CYS 103           HN       CYS 103  -4.266  -7.454  11.816
  845    HA   CYS 103           HA       CYS 103  -6.636  -9.263  11.985
  846   1HB   CYS 103           HB2      CYS 103  -5.790  -8.773   9.253
  847   2HB   CYS 103           HB1      CYS 103  -7.381  -8.547   9.978
  848    HA   PRO 104           HA       PRO 104  -3.885 -12.615  11.374
  849   1HB   PRO 104           HB2      PRO 104  -5.512 -14.035   9.500
  850   2HB   PRO 104           HB1      PRO 104  -5.427 -14.275  11.250
  851   1HG   PRO 104           HG2      PRO 104  -7.593 -13.110   9.733
  852   2HG   PRO 104           HG1      PRO 104  -7.506 -13.377  11.480
  853   1HD   PRO 104           HD2      PRO 104  -7.299 -10.872  10.051
  854   2HD   PRO 104           HD1      PRO 104  -7.260 -11.142  11.805
  855    H    VAL 105           HN       VAL 105  -2.145 -11.741  10.166
  856    HA   VAL 105           HA       VAL 105  -2.424 -11.971   7.192
  857    HB   VAL 105           HB       VAL 105  -0.409 -10.250   7.309
  858   1HG1  VAL 105          HG13      VAL 105  -2.828  -9.986   6.424
  859   2HG1  VAL 105          HG12      VAL 105  -3.155  -9.187   7.961
  860   3HG1  VAL 105          HG11      VAL 105  -1.950  -8.521   6.860
  861   1HG2  VAL 105          HG21      VAL 105  -0.564 -10.481   9.914
  862   2HG2  VAL 105          HG23      VAL 105  -0.330  -8.879   9.213
  863   3HG2  VAL 105          HG22      VAL 105  -1.932  -9.378   9.757
  864    H    LYS 106           HN       LYS 106  -1.720 -14.210   8.619
  865    HA   LYS 106           HA       LYS 106   1.193 -14.431   7.989
  866   1HB   LYS 106           HB2      LYS 106   0.267 -14.493  10.539
  867   2HB   LYS 106           HB1      LYS 106   0.126 -16.199  10.115
  868   1HG   LYS 106           HG2      LYS 106   2.619 -15.359   9.092
  869   2HG   LYS 106           HG1      LYS 106   2.511 -14.685  10.719
  870   1HD   LYS 106           HD2      LYS 106   1.563 -17.153  11.224
  871   2HD   LYS 106           HD1      LYS 106   2.602 -17.532   9.850
  872   1HE   LYS 106           HE2      LYS 106   4.483 -16.356  10.997
  873   2HE   LYS 106           HE1      LYS 106   3.434 -16.109  12.395
  874   1HZ   LYS 106           HZ1      LYS 106   4.182 -18.741  11.239
  875   2HZ   LYS 106           HZ3      LYS 106   4.817 -18.072  12.662
  876   3HZ   LYS 106           HZ2      LYS 106   3.175 -18.500  12.585
  877    H    GLU 107           HN       GLU 107  -1.497 -15.244   6.627
  878    HA   GLU 107           HA       GLU 107  -1.118 -18.186   6.529
  879   1HB   GLU 107           HB2      GLU 107  -3.198 -18.132   5.135
  880   2HB   GLU 107           HB1      GLU 107  -3.417 -17.415   6.732
  881   1HG   GLU 107           HG2      GLU 107  -3.729 -15.320   5.890
  882   2HG   GLU 107           HG1      GLU 107  -2.506 -15.536   4.639
  883    H    ALA 108           HN       ALA 108   0.109 -15.522   4.893
  884    HA   ALA 108           HA       ALA 108   0.178 -16.920   2.284
  885   1HB   ALA 108           HB1      ALA 108  -0.311 -14.468   2.388
  886   2HB   ALA 108           HB3      ALA 108   1.304 -14.216   3.048
  887   3HB   ALA 108           HB2      ALA 108   1.109 -14.854   1.417
  888    H    ASP 109           HN       ASP 109   2.173 -17.474   1.301
  889    HA   ASP 109           HA       ASP 109   4.331 -18.040   3.251
  890   1HB   ASP 109           HB2      ASP 109   4.218 -18.924   0.360
  891   2HB   ASP 109           HB1      ASP 109   5.166 -19.628   1.674
  892    H    GLN 110           HN       GLN 110   4.278 -16.892  -0.169
  893    HA   GLN 110           HA       GLN 110   5.926 -14.599   0.493
  894   1HB   GLN 110           HB2      GLN 110   7.279 -17.054   0.164
  895   2HB   GLN 110           HB1      GLN 110   7.548 -16.153  -1.328
  896   1HG   GLN 110           HG2      GLN 110   8.918 -14.678  -0.302
  897   2HG   GLN 110           HG1      GLN 110   7.807 -14.470   1.052
  898   1HE2  GLN 110          HE22      GLN 110   9.749 -16.487   3.165
  899   2HE2  GLN 110          HE21      GLN 110   8.603 -15.246   3.001
  900    H    SER 111           HN       SER 111   4.421 -13.455  -0.813
  901    HA   SER 111           HA       SER 111   4.292 -14.237  -3.694
  902   1HB   SER 111           HB2      SER 111   2.105 -13.721  -3.332
  903   2HB   SER 111           HB1      SER 111   2.470 -12.883  -1.826
  904    HG   SER 111           HG       SER 111   2.763 -11.045  -2.901
  905    H    THR 112           HN       THR 112   5.531 -13.077  -5.124
  906    HA   THR 112           HA       THR 112   7.481 -11.223  -4.446
  907    HB   THR 112           HB       THR 112   7.045 -10.349  -6.906
  908    HG1  THR 112           HG1      THR 112   5.875 -12.804  -7.299
  909   1HG2  THR 112          HG23      THR 112   7.873 -13.177  -6.200
  910   2HG2  THR 112          HG22      THR 112   8.189 -12.401  -7.752
  911   3HG2  THR 112          HG21      THR 112   8.924 -11.763  -6.282
  912    H    LEU 113           HN       LEU 113   7.484  -9.164  -3.769
  913    HA   LEU 113           HA       LEU 113   5.221  -7.719  -2.991
  914   1HB   LEU 113           HB2      LEU 113   7.704  -7.306  -2.452
  915   2HB   LEU 113           HB1      LEU 113   7.747  -6.373  -3.947
  916    HG   LEU 113           HG       LEU 113   5.498  -5.768  -2.107
  917   1HD1  LEU 113          HD12      LEU 113   7.921  -6.051  -0.897
  918   2HD1  LEU 113          HD11      LEU 113   8.026  -4.378  -1.444
  919   3HD1  LEU 113          HD13      LEU 113   6.706  -4.878  -0.387
  920   1HD2  LEU 113          HD23      LEU 113   6.078  -4.618  -4.316
  921   2HD2  LEU 113          HD22      LEU 113   5.856  -3.552  -2.931
  922   3HD2  LEU 113          HD21      LEU 113   7.480  -3.944  -3.488
  923    H    GLU 114           HN       GLU 114   6.738  -7.801  -6.178
  924    HA   GLU 114           HA       GLU 114   5.350  -5.456  -7.159
  925   1HB   GLU 114           HB2      GLU 114   6.854  -7.693  -8.514
  926   2HB   GLU 114           HB1      GLU 114   6.077  -6.397  -9.424
  927   1HG   GLU 114           HG2      GLU 114   7.388  -4.720  -8.224
  928   2HG   GLU 114           HG1      GLU 114   8.120  -5.976  -7.224
  929    H    ASN 115           HN       ASN 115   4.776  -8.958  -7.591
  930    HA   ASN 115           HA       ASN 115   2.493  -8.658  -9.290
  931   1HB   ASN 115           HB2      ASN 115   3.114 -10.884  -7.323
  932   2HB   ASN 115           HB1      ASN 115   1.965 -10.981  -8.660
  933   1HD2  ASN 115          HD22      ASN 115   5.103 -12.421  -9.976
  934   2HD2  ASN 115          HD21      ASN 115   3.923 -12.849  -8.833
  935    H    PHE 116           HN       PHE 116   2.742  -9.003  -5.757
  936    HA   PHE 116           HA       PHE 116  -0.048  -8.958  -5.200
  937   1HB   PHE 116           HB2      PHE 116   1.041  -9.508  -3.272
  938   2HB   PHE 116           HB1      PHE 116   2.476  -8.583  -3.707
  939    HD1  PHE 116           HD1      PHE 116  -1.037  -8.212  -2.495
  940    HD2  PHE 116           HD2      PHE 116   2.877  -6.467  -2.755
  941    HE1  PHE 116           HE1      PHE 116  -1.745  -6.400  -0.955
  942    HE2  PHE 116           HE2      PHE 116   2.172  -4.654  -1.218
  943    HZ   PHE 116           HZ       PHE 116  -0.139  -4.619  -0.318
  944    H    LEU 117           HN       LEU 117   2.345  -6.318  -5.470
  945    HA   LEU 117           HA       LEU 117   0.531  -4.203  -4.835
  946   1HB   LEU 117           HB2      LEU 117   3.143  -4.398  -6.280
  947   2HB   LEU 117           HB1      LEU 117   2.193  -2.931  -6.506
  948    HG   LEU 117           HG       LEU 117   3.063  -4.078  -3.835
  949   1HD1  LEU 117          HD12      LEU 117   4.792  -2.947  -5.372
  950   2HD1  LEU 117          HD11      LEU 117   3.879  -1.462  -5.105
  951   3HD1  LEU 117          HD13      LEU 117   4.626  -2.291  -3.743
  952   1HD2  LEU 117          HD21      LEU 117   1.033  -2.121  -4.605
  953   2HD2  LEU 117          HD23      LEU 117   1.333  -2.859  -3.032
  954   3HD2  LEU 117          HD22      LEU 117   2.242  -1.430  -3.524
  955    H    GLU 118           HN       GLU 118   1.027  -6.091  -7.744
  956    HA   GLU 118           HA       GLU 118  -0.268  -4.341  -9.600
  957   1HB   GLU 118           HB2      GLU 118   0.838  -6.930  -9.666
  958   2HB   GLU 118           HB1      GLU 118  -0.857  -7.145 -10.100
  959   1HG   GLU 118           HG2      GLU 118   0.010  -4.837 -11.479
  960   2HG   GLU 118           HG1      GLU 118   1.286  -6.037 -11.681
  961    NH1  ARG 119           NH2      ARG 119  -5.332 -12.673  -7.790
  962    NH2  ARG 119           NH1      ARG 119  -5.025 -12.500 -10.022
  963    H    ARG 119           HN       ARG 119  -1.480  -6.987  -7.571
  964    HA   ARG 119           HA       ARG 119  -4.241  -6.703  -8.293
  965   1HB   ARG 119           HB2      ARG 119  -3.011  -7.735  -5.722
  966   2HB   ARG 119           HB1      ARG 119  -4.669  -8.020  -6.252
  967   1HG   ARG 119           HG2      ARG 119  -3.053  -8.744  -8.439
  968   2HG   ARG 119           HG1      ARG 119  -2.235  -9.404  -7.023
  969   1HD   ARG 119           HD2      ARG 119  -3.882 -10.915  -6.621
  970   2HD   ARG 119           HD1      ARG 119  -5.165  -9.778  -7.038
  971    HE   ARG 119           HE       ARG 119  -4.021 -10.334  -9.476
  972   1HH1  ARG 119          HH21      ARG 119  -5.247 -12.305  -6.866
  973   2HH1  ARG 119          HH22      ARG 119  -5.747 -13.573  -7.927
  974   1HH2  ARG 119          HH11      ARG 119  -4.698 -11.991 -10.818
  975   2HH2  ARG 119          HH12      ARG 119  -5.445 -13.401 -10.143
  976    H    LEU 120           HN       LEU 120  -2.165  -4.797  -6.252
  977    HA   LEU 120           HA       LEU 120  -4.266  -3.653  -4.602
  978   1HB   LEU 120           HB2      LEU 120  -1.390  -3.397  -4.904
  979   2HB   LEU 120           HB1      LEU 120  -2.148  -1.812  -4.765
  980    HG   LEU 120           HG       LEU 120  -2.556  -4.133  -2.858
  981   1HD1  LEU 120          HD12      LEU 120  -0.797  -1.715  -2.884
  982   2HD1  LEU 120          HD11      LEU 120  -1.491  -2.218  -1.343
  983   3HD1  LEU 120          HD13      LEU 120  -0.470  -3.331  -2.254
  984   1HD2  LEU 120          HD21      LEU 120  -3.825  -1.440  -3.181
  985   2HD2  LEU 120          HD23      LEU 120  -4.550  -2.962  -2.664
  986   3HD2  LEU 120          HD22      LEU 120  -3.550  -2.037  -1.545
  987    H    LYS 121           HN       LYS 121  -2.263  -2.129  -7.166
  988    HA   LYS 121           HA       LYS 121  -3.768   0.194  -7.574
  989   1HB   LYS 121           HB2      LYS 121  -2.014   0.410  -8.989
  990   2HB   LYS 121           HB1      LYS 121  -1.754  -1.326  -9.016
  991   1HG   LYS 121           HG2      LYS 121  -2.161  -0.605 -11.275
  992   2HG   LYS 121           HG1      LYS 121  -3.580  -1.497 -10.759
  993   1HD   LYS 121           HD2      LYS 121  -4.423   0.919 -10.033
  994   2HD   LYS 121           HD1      LYS 121  -3.242   1.442 -11.230
  995   1HE   LYS 121           HE2      LYS 121  -4.367  -0.366 -12.754
  996   2HE   LYS 121           HE1      LYS 121  -5.716  -0.221 -11.626
  997   1HZ   LYS 121           HZ2      LYS 121  -4.506   2.219 -12.718
  998   2HZ   LYS 121           HZ1      LYS 121  -5.556   1.319 -13.703
  999   3HZ   LYS 121           HZ3      LYS 121  -6.105   1.936 -12.221
 1000    H    THR 122           HN       THR 122  -4.219  -2.986  -9.020
 1001    HA   THR 122           HA       THR 122  -6.365  -2.422 -10.759
 1002    HB   THR 122           HB       THR 122  -6.976  -4.904 -10.038
 1003    HG1  THR 122           HG1      THR 122  -5.798  -5.564  -8.510
 1004   1HG2  THR 122          HG23      THR 122  -4.812  -3.736 -11.665
 1005   2HG2  THR 122          HG22      THR 122  -4.587  -5.435 -11.249
 1006   3HG2  THR 122          HG21      THR 122  -6.036  -4.921 -12.116
 1007    H    ILE 123           HN       ILE 123  -6.497  -3.607  -7.423
 1008    HA   ILE 123           HA       ILE 123  -9.229  -3.637  -6.941
 1009    HB   ILE 123           HB       ILE 123  -6.897  -2.903  -5.187
 1010   1HG1  ILE 123          HG12      ILE 123  -7.651  -5.304  -5.998
 1011   2HG1  ILE 123          HG11      ILE 123  -7.148  -5.054  -4.326
 1012   1HG2  ILE 123          HG21      ILE 123  -9.838  -2.736  -4.558
 1013   2HG2  ILE 123          HG23      ILE 123  -8.663  -3.104  -3.296
 1014   3HG2  ILE 123          HG22      ILE 123  -8.561  -1.581  -4.178
 1015   1HD1  ILE 123          HD13      ILE 123 -10.033  -4.743  -5.152
 1016   2HD1  ILE 123          HD12      ILE 123  -9.369  -6.317  -4.718
 1017   3HD1  ILE 123          HD11      ILE 123  -9.376  -5.008  -3.537
 1018    H    MET 124           HN       MET 124  -7.089  -0.801  -6.817
 1019    HA   MET 124           HA       MET 124  -9.021   1.058  -5.871
 1020   1HB   MET 124           HB2      MET 124  -6.865   1.808  -7.844
 1021   2HB   MET 124           HB1      MET 124  -7.552   2.787  -6.555
 1022   1HG   MET 124           HG2      MET 124  -5.685   0.423  -6.270
 1023   2HG   MET 124           HG1      MET 124  -5.405   2.093  -5.792
 1024   1HE   MET 124           HE3      MET 124  -5.405   2.863  -4.023
 1025   2HE   MET 124           HE2      MET 124  -6.922   3.113  -3.183
 1026   3HE   MET 124           HE1      MET 124  -5.694   2.070  -2.471
 1027    NH1  ARG 125           NH2      ARG 125 -10.652   0.403 -16.449
 1028    NH2  ARG 125           NH1      ARG 125 -12.098   2.136 -16.506
 1029    H    ARG 125           HN       ARG 125  -8.019   0.394  -9.230
 1030    HA   ARG 125           HA       ARG 125 -10.160   2.029 -10.333
 1031   1HB   ARG 125           HB2      ARG 125  -7.803   1.268 -11.317
 1032   2HB   ARG 125           HB1      ARG 125  -8.776  -0.050 -11.968
 1033   1HG   ARG 125           HG2      ARG 125 -10.134   2.486 -12.324
 1034   2HG   ARG 125           HG1      ARG 125  -8.520   2.539 -13.036
 1035   1HD   ARG 125           HD2      ARG 125  -8.975   0.820 -14.537
 1036   2HD   ARG 125           HD1      ARG 125 -10.245   0.132 -13.525
 1037    HE   ARG 125           HE       ARG 125 -11.254   2.602 -14.248
 1038   1HH1  ARG 125          HH21      ARG 125  -9.957  -0.138 -15.981
 1039   2HH1  ARG 125          HH22      ARG 125 -10.940   0.148 -17.372
 1040   1HH2  ARG 125          HH11      ARG 125 -12.517   2.935 -16.073
 1041   2HH2  ARG 125          HH12      ARG 125 -12.374   1.864 -17.428
 1042    H    GLU 126           HN       GLU 126 -10.307  -0.986  -8.887
 1043    HA   GLU 126           HA       GLU 126 -12.199  -2.149 -10.821
 1044   1HB   GLU 126           HB2      GLU 126 -10.535  -3.141  -8.690
 1045   2HB   GLU 126           HB1      GLU 126 -12.204  -3.647  -8.423
 1046   1HG   GLU 126           HG2      GLU 126 -11.105  -5.313  -9.812
 1047   2HG   GLU 126           HG1      GLU 126 -12.283  -4.447 -10.799
 1048    H    LYS 127           HN       LYS 127 -12.354  -1.334  -7.318
 1049    HA   LYS 127           HA       LYS 127 -15.300  -1.382  -7.495
 1050   1HB   LYS 127           HB2      LYS 127 -13.281  -1.441  -5.333
 1051   2HB   LYS 127           HB1      LYS 127 -14.782  -0.602  -4.944
 1052   1HG   LYS 127           HG2      LYS 127 -16.040  -2.511  -5.057
 1053   2HG   LYS 127           HG1      LYS 127 -15.055  -3.209  -6.345
 1054   1HD   LYS 127           HD2      LYS 127 -13.207  -3.378  -4.511
 1055   2HD   LYS 127           HD1      LYS 127 -14.549  -3.202  -3.379
 1056   1HE   LYS 127           HE2      LYS 127 -15.692  -5.100  -4.634
 1057   2HE   LYS 127           HE1      LYS 127 -14.154  -5.366  -5.455
 1058   1HZ   LYS 127           HZ1      LYS 127 -13.234  -5.352  -3.046
 1059   2HZ   LYS 127           HZ3      LYS 127 -14.832  -5.725  -2.618
 1060   3HZ   LYS 127           HZ2      LYS 127 -13.970  -6.755  -3.660
 1061    OH   TYR 128           OH       TYR 128 -11.053   0.883  -2.016
 1062    H    TYR 128           HN       TYR 128 -12.759   1.022  -7.465
 1063    HA   TYR 128           HA       TYR 128 -14.680   3.129  -6.690
 1064   1HB   TYR 128           HB2      TYR 128 -11.796   3.489  -7.518
 1065   2HB   TYR 128           HB1      TYR 128 -12.800   4.600  -6.580
 1066    HD1  TYR 128           HD2      TYR 128 -14.206   2.564  -4.844
 1067    HD2  TYR 128           HD1      TYR 128 -10.072   3.007  -5.927
 1068    HE1  TYR 128           HE2      TYR 128 -13.537   1.391  -2.767
 1069    HE2  TYR 128           HE1      TYR 128  -9.404   1.832  -3.848
 1070    HH   TYR 128           HH       TYR 128 -11.684   1.110  -1.331
 1071    H    SER 129           HN       SER 129 -14.996   1.673  -9.285
 1072    HA   SER 129           HA       SER 129 -14.388   3.791 -11.256
 1073   1HB   SER 129           HB2      SER 129 -14.134   1.304 -11.764
 1074   2HB   SER 129           HB1      SER 129 -15.893   1.206 -11.736
 1075    HG   SER 129           HG       SER 129 -14.201   2.246 -13.625
 1076    H    LYS 130           HN       LYS 130 -17.030   2.652  -9.295
 1077    HA   LYS 130           HA       LYS 130 -18.894   4.423 -10.817
 1078   1HB   LYS 130           HB2      LYS 130 -19.237   1.773 -10.166
 1079   2HB   LYS 130           HB1      LYS 130 -20.061   2.585  -8.834
 1080   1HG   LYS 130           HG2      LYS 130 -21.719   2.329 -10.520
 1081   2HG   LYS 130           HG1      LYS 130 -21.214   4.016 -10.628
 1082   1HD   LYS 130           HD2      LYS 130 -19.412   2.759 -12.293
 1083   2HD   LYS 130           HD1      LYS 130 -20.889   1.837 -12.575
 1084   1HE   LYS 130           HE2      LYS 130 -22.077   3.724 -13.314
 1085   2HE   LYS 130           HE1      LYS 130 -20.956   4.846 -12.542
 1086   1HZ   LYS 130           HZ3      LYS 130 -19.918   3.060 -14.615
 1087   2HZ   LYS 130           HZ2      LYS 130 -20.862   4.384 -15.104
 1088   3HZ   LYS 130           HZ1      LYS 130 -19.441   4.636 -14.207
 1089    H    CYS 131           HN       CYS 131 -16.915   5.108  -8.595
 1090    HA   CYS 131           HA       CYS 131 -18.905   6.111  -6.604
 1091   1HB   CYS 131           HB2      CYS 131 -16.735   4.616  -6.031
 1092   2HB   CYS 131           HB1      CYS 131 -15.994   6.217  -5.991
 1093    H    SER 132           HN       SER 132 -16.424   7.009  -8.899
 1094    HA   SER 132           HA       SER 132 -16.601   9.845  -8.021
 1095   1HB   SER 132           HB2      SER 132 -14.404   9.824  -8.523
 1096   2HB   SER 132           HB1      SER 132 -14.533   8.201  -9.194
 1097    HG   SER 132           HG       SER 132 -14.225   9.180 -11.027
 1098    H    SER 133           HN       SER 133 -16.851  11.481  -9.805
 1099    HA   SER 133           HA       SER 133 -18.825  10.479 -11.806
 1100   1HB   SER 133           HB2      SER 133 -19.784  12.204 -10.448
 1101   2HB   SER 133           HB1      SER 133 -18.345  13.210 -10.590
 1102    HG   SER 133           HG       SER 133 -19.088  13.939 -12.412