*HEADER    OXIDOREDUCTASE                          17-JAN-10   2KT2              
*TITLE     STRUCTURE OF NMERA, THE N-TERMINAL HMA DOMAIN OF TN501 MERCURIC       
*TITLE    2 REDUCTASE                                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MERCURIC REDUCTASE;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL HMA DOMAIN, RESIDUES 1-69;                      
*COMPND   5 SYNONYM: HG(II) REDUCTASE;                                           
*COMPND   6 EC: 1.16.1.1;                                                        
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA;                         
*SOURCE   3 ORGANISM_TAXID: 287;                                                 
*SOURCE   4 GENE: MERA;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 83333;                                      
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: K12;                                       
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET11A                                    
*KEYWDS    NMERA, MERA, MERCURIC REDUCTASE, HMA DOMAIN, MERCURIC RESISTANCE,     
*KEYWDS   2 METAL-BINDING, OXIDOREDUCTASE                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    R.LEDWIDGE, F.DANACEA, V.DOTSCH, S.M.MILLER                           
*REVDAT   1   22-SEP-10 2KT2    0                                                


! NOE distance restraints
ASSI {    1}
 (( segid "    " and resid   2 and name   HA ))
 (( segid "    " and resid   3 and name   HN ))
    0.000   0.000   2.490
ASSI {    2}
 (( segid "    " and resid   2 and name   HB ))
 (( segid "    " and resid   3 and name   HN ))
    0.000   0.000   4.970
ASSI {    3}
 (( segid "    " and resid   2 and name   HB ))
 (( segid "    " and resid  42 and name   HN ))
    0.000   0.000   4.970
ASSI {    4}
 (( segid "    " and resid   2 and name HG2% ))
 (( segid "    " and resid   3 and name   HN ))
    0.000   0.000   4.700
ASSI {    5}
 (( segid "    " and resid   2 and name HG2% ))
 (( segid "    " and resid  42 and name   HN ))
    0.000   0.000   6.530
ASSI {    6}
 (( segid "    " and resid   3 and name   HN ))
 (( segid "    " and resid   3 and name  HB2 ))
    0.000   0.000   3.670
ASSI {    7}
 (( segid "    " and resid   3 and name   HN ))
 (( segid "    " and resid   3 and name  HB3 ))
    0.000   0.000   3.670
ASSI {    8}
 (( segid "    " and resid   3 and name   HN ))
 (( segid "    " and resid   3 and name  HB% ))
    0.000   0.000   3.230
ASSI {    9}
 (( segid "    " and resid   3 and name   HN ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   5.500
ASSI {   10}
 (( segid "    " and resid   3 and name   HN ))
 (( segid "    " and resid  68 and name   HA ))
    0.000   0.000   3.760
ASSI {   11}
 (( segid "    " and resid   3 and name   HA ))
 (( segid "    " and resid   4 and name   HN ))
    0.000   0.000   2.430
ASSI {   12}
 (( segid "    " and resid   3 and name   HA ))
 (( segid "    " and resid  42 and name   HN ))
    0.000   0.000   3.830
ASSI {   13}
 (( segid "    " and resid   3 and name  HB2 ))
 (( segid "    " and resid   4 and name   HN ))
    0.000   0.000   3.890
ASSI {   14}
 (( segid "    " and resid   3 and name  HB2 ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   5.500
ASSI {   15}
 (( segid "    " and resid   3 and name  HB3 ))
 (( segid "    " and resid   4 and name   HN ))
    0.000   0.000   3.890
ASSI {   16}
 (( segid "    " and resid   3 and name  HB3 ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   5.500
ASSI {   17}
 (( segid "    " and resid   3 and name  HB% ))
 (( segid "    " and resid   4 and name   HN ))
    0.000   0.000   3.620
ASSI {   18}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid   4 and name  HB2 ))
    0.000   0.000   3.700
ASSI {   19}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid   4 and name  HB3 ))
    0.000   0.000   3.700
ASSI {   20}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid   4 and name  HB% ))
    0.000   0.000   3.150
ASSI {   21}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid   4 and name HD1% ))
    0.000   0.000   6.530
ASSI {   22}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid   4 and name HD2% ))
    0.000   0.000   6.530
ASSI {   23}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid  40 and name   HN ))
    0.000   0.000   2.930
ASSI {   24}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid  40 and name  HB% ))
    0.000   0.000   5.130
ASSI {   25}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid  41 and name   HA ))
    0.000   0.000   4.230
ASSI {   26}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid  42 and name   HN ))
    0.000   0.000   4.420
ASSI {   27}
 (( segid "    " and resid   4 and name   HN ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   4.450
ASSI {   28}
 (( segid "    " and resid   4 and name   HA ))
 (( segid "    " and resid   4 and name HD1% ))
    0.000   0.000   4.360
ASSI {   29}
 (( segid "    " and resid   4 and name   HA ))
 (( segid "    " and resid   4 and name HD2% ))
    0.000   0.000   4.360
ASSI {   30}
 (( segid "    " and resid   4 and name   HA ))
 (( segid "    " and resid   4 and name HD%% ))
    0.000   0.000   3.870
ASSI {   31}
 (( segid "    " and resid   4 and name   HA ))
 (( segid "    " and resid   5 and name   HN ))
    0.000   0.000   2.550
ASSI {   32}
 (( segid "    " and resid   4 and name   HA ))
 (( segid "    " and resid  66 and name   HA ))
    0.000   0.000   3.830
ASSI {   33}
 (( segid "    " and resid   4 and name   HA ))
 (( segid "    " and resid  66 and name  HB% ))
    0.000   0.000   6.380
ASSI {   34}
 (( segid "    " and resid   4 and name   HA ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   3.270
ASSI {   35}
 (( segid "    " and resid   4 and name  HB2 ))
 (( segid "    " and resid   5 and name   HN ))
    0.000   0.000   4.110
ASSI {   36}
 (( segid "    " and resid   4 and name  HB3 ))
 (( segid "    " and resid   5 and name   HN ))
    0.000   0.000   4.110
ASSI {   37}
 (( segid "    " and resid   4 and name  HB% ))
 (( segid "    " and resid   5 and name   HN ))
    0.000   0.000   3.510
ASSI {   38}
 (( segid "    " and resid   4 and name  HB% ))
 (( segid "    " and resid  40 and name   HN ))
    0.000   0.000   5.050
ASSI {   39}
 (( segid "    " and resid   4 and name  HB% ))
 (( segid "    " and resid  54 and name   HN ))
    0.000   0.000   6.380
ASSI {   40}
 (( segid "    " and resid   4 and name  HB% ))
 (( segid "    " and resid  54 and name   HA ))
    0.000   0.000   6.350
ASSI {   41}
 (( segid "    " and resid   4 and name  HB% ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   6.380
ASSI {   42}
 (( segid "    " and resid   4 and name HD1% ))
 (( segid "    " and resid  40 and name   HN ))
    0.000   0.000   6.530
ASSI {   43}
 (( segid "    " and resid   4 and name HD1% ))
 (( segid "    " and resid  57 and name HG1% ))
    0.000   0.000   10.700
ASSI {   44}
 (( segid "    " and resid   4 and name HD1% ))
 (( segid "    " and resid  57 and name HG2% ))
    0.000   0.000   10.700
ASSI {   45}
 (( segid "    " and resid   4 and name HD2% ))
 (( segid "    " and resid  40 and name   HN ))
    0.000   0.000   6.530
ASSI {   46}
 (( segid "    " and resid   4 and name HD2% ))
 (( segid "    " and resid  57 and name HG1% ))
    0.000   0.000   10.700
ASSI {   47}
 (( segid "    " and resid   4 and name HD2% ))
 (( segid "    " and resid  57 and name HG2% ))
    0.000   0.000   10.700
ASSI {   48}
 (( segid "    " and resid   4 and name HD%% ))
 (( segid "    " and resid  40 and name   HA ))
    0.000   0.000   7.540
ASSI {   49}
 (( segid "    " and resid   4 and name HD%% ))
 (( segid "    " and resid  42 and name  CD1 ))
    0.000   0.000   5.680
ASSI {   50}
 (( segid "    " and resid   4 and name HD%% ))
 (( segid "    " and resid  42 and name HD%% ))
    0.000   0.000   10.390
ASSI {   51}
 (( segid "    " and resid   4 and name HD%% ))
 (( segid "    " and resid  57 and name HG%% ))
    0.000   0.000   9.000
ASSI {   52}
 (( segid "    " and resid   4 and name HD%% ))
 (( segid "    " and resid  64 and name   HA ))
    0.000   0.000   8.100
ASSI {   53}
 (( segid "    " and resid   4 and name HD%% ))
 (( segid "    " and resid  65 and name   HN ))
    0.000   0.000   8.100
ASSI {   54}
 (( segid "    " and resid   4 and name HD%% ))
 (( segid "    " and resid  66 and name   HA ))
    0.000   0.000   7.570
ASSI {   55}
 (( segid "    " and resid   5 and name   HN ))
 (( segid "    " and resid   5 and name  HB2 ))
    0.000   0.000   3.520
ASSI {   56}
 (( segid "    " and resid   5 and name   HN ))
 (( segid "    " and resid   5 and name  HB3 ))
    0.000   0.000   3.520
ASSI {   57}
 (( segid "    " and resid   5 and name   HN ))
 (( segid "    " and resid   5 and name  HB% ))
    0.000   0.000   3.270
ASSI {   58}
 (( segid "    " and resid   5 and name   HN ))
 (( segid "    " and resid   5 and name  HD% ))
    0.000   0.000   6.380
ASSI {   59}
 (( segid "    " and resid   5 and name   HN ))
 (( segid "    " and resid  65 and name   HN ))
    0.000   0.000   3.170
ASSI {   60}
 (( segid "    " and resid   5 and name   HN ))
 (( segid "    " and resid  66 and name   HA ))
    0.000   0.000   4.010
ASSI {   61}
 (( segid "    " and resid   5 and name   HN ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   3.830
ASSI {   62}
 (( segid "    " and resid   5 and name   HA ))
 (( segid "    " and resid   6 and name   HN ))
    0.000   0.000   2.400
ASSI {   63}
 (( segid "    " and resid   5 and name   HA ))
 (( segid "    " and resid  39 and name   HA ))
    0.000   0.000   4.850
ASSI {   64}
 (( segid "    " and resid   5 and name   HA ))
 (( segid "    " and resid  39 and name HG2% ))
    0.000   0.000   6.370
ASSI {   65}
 (( segid "    " and resid   5 and name   HA ))
 (( segid "    " and resid  40 and name   HN ))
    0.000   0.000   4.140
ASSI {   66}
 (( segid "    " and resid   5 and name  HB2 ))
 (( segid "    " and resid   6 and name   HN ))
    0.000   0.000   4.260
ASSI {   67}
 (( segid "    " and resid   5 and name  HB2 ))
 (( segid "    " and resid  65 and name   HN ))
    0.000   0.000   5.500
ASSI {   68}
 (( segid "    " and resid   5 and name  HB3 ))
 (( segid "    " and resid   6 and name   HN ))
    0.000   0.000   4.260
ASSI {   69}
 (( segid "    " and resid   5 and name  HB3 ))
 (( segid "    " and resid  65 and name   HN ))
    0.000   0.000   5.500
ASSI {   70}
 (( segid "    " and resid   5 and name  HB% ))
 (( segid "    " and resid  67 and name   HA ))
    0.000   0.000   6.380
ASSI {   71}
 (( segid "    " and resid   5 and name  HB% ))
 (( segid "    " and resid  67 and name  HB% ))
    0.000   0.000   6.850
ASSI {   72}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid   6 and name   HB ))
    0.000   0.000   2.550
ASSI {   73}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid   6 and name HD1% ))
    0.000   0.000   6.500
ASSI {   74}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid   7 and name   HN ))
    0.000   0.000   4.600
ASSI {   75}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid  38 and name  HA1 ))
    0.000   0.000   5.220
ASSI {   76}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid  38 and name  HA2 ))
    0.000   0.000   5.220
ASSI {   77}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid  38 and name  HA% ))
    0.000   0.000   4.990
ASSI {   78}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid  39 and name   HA ))
    0.000   0.000   3.170
ASSI {   79}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid  39 and name HG2% ))
    0.000   0.000   6.530
ASSI {   80}
 (( segid "    " and resid   6 and name   HN ))
 (( segid "    " and resid  57 and name HG%% ))
    0.000   0.000   7.470
ASSI {   81}
 (( segid "    " and resid   6 and name   HA ))
 (( segid "    " and resid   7 and name   HN ))
    0.000   0.000   2.460
ASSI {   82}
 (( segid "    " and resid   6 and name   HA ))
 (( segid "    " and resid  64 and name   HA ))
    0.000   0.000   3.520
ASSI {   83}
 (( segid "    " and resid   6 and name   HA ))
 (( segid "    " and resid  64 and name  HB% ))
    0.000   0.000   6.530
ASSI {   84}
 (( segid "    " and resid   6 and name   HA ))
 (( segid "    " and resid  65 and name   HN ))
    0.000   0.000   4.260
ASSI {   85}
 (( segid "    " and resid   6 and name HG2% ))
 (( segid "    " and resid   7 and name   HN ))
    0.000   0.000   4.260
ASSI {   86}
 (( segid "    " and resid   6 and name HG2% ))
 (( segid "    " and resid   9 and name   HN ))
    0.000   0.000   6.530
ASSI {   87}
 (( segid "    " and resid   6 and name HG2% ))
 (( segid "    " and resid  63 and name   HN ))
    0.000   0.000   5.940
ASSI {   88}
 (( segid "    " and resid   6 and name HG2% ))
 (( segid "    " and resid  64 and name   HA ))
    0.000   0.000   6.530
ASSI {   89}
 (( segid "    " and resid   6 and name HD1% ))
 (( segid "    " and resid  62 and name  HB2 ))
    0.000   0.000   6.530
ASSI {   90}
 (( segid "    " and resid   6 and name HD1% ))
 (( segid "    " and resid  62 and name  HB3 ))
    0.000   0.000   6.530
ASSI {   91}
 (( segid "    " and resid   6 and name HD1% ))
 (( segid "    " and resid  62 and name  HB% ))
    0.000   0.000   5.950
ASSI {   92}
 (( segid "    " and resid   7 and name   HN ))
 (( segid "    " and resid   7 and name   HB ))
    0.000   0.000   3.420
ASSI {   93}
 (( segid "    " and resid   7 and name   HN ))
 (( segid "    " and resid   9 and name   HN ))
    0.000   0.000   4.630
ASSI {   94}
 (( segid "    " and resid   7 and name   HN ))
 (( segid "    " and resid  62 and name  HB% ))
    0.000   0.000   6.380
ASSI {   95}
 (( segid "    " and resid   7 and name   HN ))
 (( segid "    " and resid  63 and name   HN ))
    0.000   0.000   3.670
ASSI {   96}
 (( segid "    " and resid   7 and name   HN ))
 (( segid "    " and resid  63 and name  HB% ))
    0.000   0.000   6.380
ASSI {   97}
 (( segid "    " and resid   7 and name   HN ))
 (( segid "    " and resid  63 and name  HD% ))
    0.000   0.000   6.380
ASSI {   98}
 (( segid "    " and resid   7 and name   HN ))
 (( segid "    " and resid  64 and name   HA ))
    0.000   0.000   3.890
ASSI {   99}
 (( segid "    " and resid   7 and name   HA ))
 (( segid "    " and resid   7 and name   HB ))
    0.000   0.000   2.960
ASSI {  100}
 (( segid "    " and resid   7 and name   HA ))
 (( segid "    " and resid   8 and name   HN ))
    0.000   0.000   2.620
ASSI {  101}
 (( segid "    " and resid   7 and name   HA ))
 (( segid "    " and resid   9 and name   HN ))
    0.000   0.000   3.980
ASSI {  102}
 (( segid "    " and resid   7 and name   HB ))
 (( segid "    " and resid   8 and name   HN ))
    0.000   0.000   3.360
ASSI {  103}
 (( segid "    " and resid   7 and name   HB ))
 (( segid "    " and resid  63 and name   HN ))
    0.000   0.000   5.250
ASSI {  104}
 (( segid "    " and resid   7 and name HG2% ))
 (( segid "    " and resid   8 and name   HN ))
    0.000   0.000   5.630
ASSI {  105}
 (( segid "    " and resid   7 and name  HG1 ))
 (( segid "    " and resid   9 and name   HN ))
    0.000   0.000   5.500
ASSI {  106}
 (( segid "    " and resid   7 and name  HG1 ))
 (( segid "    " and resid  64 and name   HA ))
    0.000   0.000   2.930
ASSI {  107}
 (( segid "    " and resid   8 and name   HN ))
 (( segid "    " and resid   8 and name  HA1 ))
    0.000   0.000   2.930
ASSI {  108}
 (( segid "    " and resid   8 and name   HN ))
 (( segid "    " and resid   8 and name  HA2 ))
    0.000   0.000   2.930
ASSI {  109}
 (( segid "    " and resid   8 and name   HN ))
 (( segid "    " and resid   8 and name  HA% ))
    0.000   0.000   2.560
ASSI {  110}
 (( segid "    " and resid   8 and name   HN ))
 (( segid "    " and resid   9 and name   HN ))
    0.000   0.000   3.890
ASSI {  111}
 (( segid "    " and resid   9 and name   HN ))
 (( segid "    " and resid   9 and name  HB2 ))
    0.000   0.000   2.960
ASSI {  112}
 (( segid "    " and resid   9 and name   HN ))
 (( segid "    " and resid   9 and name  HB3 ))
    0.000   0.000   3.830
ASSI {  113}
 (( segid "    " and resid   9 and name   HN ))
 (( segid "    " and resid   9 and name  HG2 ))
    0.000   0.000   4.480
ASSI {  114}
 (( segid "    " and resid   9 and name   HN ))
 (( segid "    " and resid   9 and name  HG3 ))
    0.000   0.000   3.140
ASSI {  115}
 (( segid "    " and resid   9 and name   HA ))
 (( segid "    " and resid   9 and name  HB3 ))
    0.000   0.000   2.650
ASSI {  116}
 (( segid "    " and resid   9 and name   HA ))
 (( segid "    " and resid   9 and name  HG2 ))
    0.000   0.000   2.620
ASSI {  117}
 (( segid "    " and resid   9 and name   HA ))
 (( segid "    " and resid   9 and name  HG3 ))
    0.000   0.000   3.860
ASSI {  118}
 (( segid "    " and resid   9 and name  HB2 ))
 (( segid "    " and resid  11 and name   HN ))
    0.000   0.000   5.280
ASSI {  119}
 (( segid "    " and resid   9 and name  HB2 ))
 (( segid "    " and resid  14 and name  HB2 ))
    0.000   0.000   3.210
ASSI {  120}
 (( segid "    " and resid   9 and name  HB2 ))
 (( segid "    " and resid  14 and name  HB3 ))
    0.000   0.000   2.590
ASSI {  121}
 (( segid "    " and resid   9 and name  HB3 ))
 (( segid "    " and resid   9 and name  HG2 ))
    0.000   0.000   2.740
ASSI {  122}
 (( segid "    " and resid   9 and name  HB3 ))
 (( segid "    " and resid   9 and name  HG3 ))
    0.000   0.000   3.050
ASSI {  123}
 (( segid "    " and resid   9 and name  HB3 ))
 (( segid "    " and resid  11 and name   HN ))
    0.000   0.000   3.760
ASSI {  124}
 (( segid "    " and resid   9 and name  HB3 ))
 (( segid "    " and resid  14 and name  HB2 ))
    0.000   0.000   2.830
ASSI {  125}
 (( segid "    " and resid   9 and name  HB3 ))
 (( segid "    " and resid  14 and name  HB3 ))
    0.000   0.000   3.480
ASSI {  126}
 (( segid "    " and resid  10 and name   HN ))
 (( segid "    " and resid  10 and name   HB ))
    0.000   0.000   3.080
ASSI {  127}
 (( segid "    " and resid  10 and name   HN ))
 (( segid "    " and resid  11 and name   HN ))
    0.000   0.000   3.210
ASSI {  128}
 (( segid "    " and resid  10 and name   HB ))
 (( segid "    " and resid  11 and name   HN ))
    0.000   0.000   4.010
ASSI {  129}
 (( segid "    " and resid  10 and name HG2% ))
 (( segid "    " and resid  11 and name   HN ))
    0.000   0.000   6.530
ASSI {  130}
 (( segid "    " and resid  11 and name   HN ))
 (( segid "    " and resid  11 and name  HB2 ))
    0.000   0.000   3.980
ASSI {  131}
 (( segid "    " and resid  11 and name   HN ))
 (( segid "    " and resid  11 and name  HB3 ))
    0.000   0.000   3.610
ASSI {  132}
 (( segid "    " and resid  11 and name   HN ))
 (( segid "    " and resid  14 and name  HB2 ))
    0.000   0.000   3.210
ASSI {  133}
 (( segid "    " and resid  11 and name   HN ))
 (( segid "    " and resid  14 and name  HB3 ))
    0.000   0.000   4.510
ASSI {  134}
 (( segid "    " and resid  11 and name   HA ))
 (( segid "    " and resid  11 and name  HB2 ))
    0.000   0.000   2.400
ASSI {  135}
 (( segid "    " and resid  11 and name   HA ))
 (( segid "    " and resid  11 and name  HB3 ))
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ASSI {  280}
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ASSI {  281}
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ASSI {  282}
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ASSI {  283}
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ASSI {  284}
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ASSI {  285}
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ASSI {  286}
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ASSI {  289}
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ASSI {  419}
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ASSI {  711}
 (( segid "    " and resid  63 and name   HN ))
 (( segid "    " and resid  63 and name  HD% ))
    0.000   0.000   5.320
ASSI {  712}
 (( segid "    " and resid  63 and name   HA ))
 (( segid "    " and resid  64 and name   HN ))
    0.000   0.000   2.620
ASSI {  713}
 (( segid "    " and resid  63 and name  HB% ))
 (( segid "    " and resid  64 and name   HN ))
    0.000   0.000   5.040
ASSI {  714}
 (( segid "    " and resid  63 and name  HD% ))
 (( segid "    " and resid  64 and name   HN ))
    0.000   0.000   6.380
ASSI {  715}
 (( segid "    " and resid  64 and name   HA ))
 (( segid "    " and resid  65 and name   HN ))
    0.000   0.000   2.430
ASSI {  716}
 (( segid "    " and resid  65 and name   HN ))
 (( segid "    " and resid  65 and name   HB ))
    0.000   0.000   3.580
ASSI {  717}
 (( segid "    " and resid  65 and name   HN ))
 (( segid "    " and resid  65 and name HG2% ))
    0.000   0.000   4.920
ASSI {  718}
 (( segid "    " and resid  65 and name   HN ))
 (( segid "    " and resid  65 and name  HG1 ))
    0.000   0.000   5.070
ASSI {  719}
 (( segid "    " and resid  65 and name   HA ))
 (( segid "    " and resid  66 and name   HN ))
    0.000   0.000   2.930
ASSI {  720}
 (( segid "    " and resid  65 and name   HB ))
 (( segid "    " and resid  66 and name   HN ))
    0.000   0.000   3.360
ASSI {  721}
 (( segid "    " and resid  65 and name HG2% ))
 (( segid "    " and resid  66 and name   HN ))
    0.000   0.000   5.350
ASSI {  722}
 (( segid "    " and resid  66 and name   HN ))
 (( segid "    " and resid  66 and name   HG ))
    0.000   0.000   3.670
ASSI {  723}
 (( segid "    " and resid  66 and name   HN ))
 (( segid "    " and resid  66 and name HD%% ))
    0.000   0.000   7.630
ASSI {  724}
 (( segid "    " and resid  66 and name   HA ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   2.520
ASSI {  725}
 (( segid "    " and resid  66 and name  HB% ))
 (( segid "    " and resid  67 and name   HN ))
    0.000   0.000   4.430
ASSI {  726}
 (( segid "    " and resid  67 and name   HA ))
 (( segid "    " and resid  68 and name   HN ))
    0.000   0.000   2.620
ASSI {  727}
 (( segid "    " and resid  68 and name   HN ))
 (( segid "    " and resid  68 and name   HA ))
    0.000   0.000   2.680
ASSI {  728}
 (( segid "    " and resid  68 and name   HN ))
 (( segid "    " and resid  68 and name  HB2 ))
    0.000   0.000   3.790
ASSI {  729}
 (( segid "    " and resid  68 and name   HN ))
 (( segid "    " and resid  68 and name  HB3 ))
    0.000   0.000   3.790
ASSI {  730}
 (( segid "    " and resid  68 and name   HN ))
 (( segid "    " and resid  68 and name  HB% ))
    0.000   0.000   3.350
ASSI {  731}
 (( segid "    " and resid  68 and name   HA ))
 (( segid "    " and resid  69 and name   HN ))
    0.000   0.000   3.450
ASSI {  732}
 (( segid "    " and resid  68 and name  HB2 ))
 (( segid "    " and resid  69 and name   HN ))
    0.000   0.000   5.250
ASSI {  733}
 (( segid "    " and resid  68 and name  HB3 ))
 (( segid "    " and resid  69 and name   HN ))
    0.000   0.000   5.250
ASSI {  734}
 (( segid "    " and resid  65 and name    O ))
 (( segid "    " and resid   5 and name   HN ))
    0.000   0.000   2.400
ASSI {  735}
 (( segid "    " and resid  65 and name    O ))
 (( segid "    " and resid   5 and name    N ))
    0.000   0.000   3.200
ASSI {  736}
 (( segid "    " and resid   5 and name    O ))
 (( segid "    " and resid  65 and name   HN ))
    0.000   0.000   2.400
ASSI {  737}
 (( segid "    " and resid   5 and name    O ))
 (( segid "    " and resid  65 and name    N ))
    0.000   0.000   3.200
ASSI {  738}
 (( segid "    " and resid  63 and name    O ))
 (( segid "    " and resid   7 and name   HN ))
    0.000   0.000   2.400
ASSI {  739}
 (( segid "    " and resid  63 and name    O ))
 (( segid "    " and resid   7 and name    N ))
    0.000   0.000   3.200
ASSI {  740}
 (( segid "    " and resid   7 and name    O ))
 (( segid "    " and resid  63 and name   HN ))
    0.000   0.000   2.400
ASSI {  741}
 (( segid "    " and resid   7 and name    O ))
 (( segid "    " and resid  63 and name    N ))
    0.000   0.000   3.200
ASSI {  742}
 (( segid "    " and resid  40 and name    O ))
 (( segid "    " and resid   4 and name   HN ))
    0.000   0.000   2.400
ASSI {  743}
 (( segid "    " and resid  40 and name    O ))
 (( segid "    " and resid   4 and name    N ))
    0.000   0.000   3.200
ASSI {  744}
 (( segid "    " and resid   4 and name    O ))
 (( segid "    " and resid  40 and name   HN ))
    0.000   0.000   2.400
ASSI {  745}
 (( segid "    " and resid   4 and name    O ))
 (( segid "    " and resid  40 and name    N ))
    0.000   0.000   3.200
ASSI {  746}
 (( segid "    " and resid  38 and name    O ))
 (( segid "    " and resid   6 and name   HN ))
    0.000   0.000   2.400
ASSI {  747}
 (( segid "    " and resid  38 and name    O ))
 (( segid "    " and resid   6 and name    N ))
    0.000   0.000   3.200
ASSI {  748}
 (( segid "    " and resid  30 and name    O ))
 (( segid "    " and resid  43 and name   HN ))
    0.000   0.000   2.400
ASSI {  749}
 (( segid "    " and resid  30 and name    O ))
 (( segid "    " and resid  43 and name    N ))
    0.000   0.000   3.200
ASSI {  750}
 (( segid "    " and resid  43 and name    O ))
 (( segid "    " and resid  30 and name   HN ))
    0.000   0.000   2.400
ASSI {  751}
 (( segid "    " and resid  43 and name    O ))
 (( segid "    " and resid  30 and name    N ))
    0.000   0.000   3.200
ASSI {  752}
 (( segid "    " and resid  32 and name    O ))
 (( segid "    " and resid  41 and name   HN ))
    0.000   0.000   2.400
ASSI {  753}
 (( segid "    " and resid  32 and name    O ))
 (( segid "    " and resid  41 and name    N ))
    0.000   0.000   3.200
ASSI {  754}
 (( segid "    " and resid  41 and name    O ))
 (( segid "    " and resid  32 and name   HN ))
    0.000   0.000   2.400
ASSI {  755}
 (( segid "    " and resid  41 and name    O ))
 (( segid "    " and resid  32 and name    N ))
    0.000   0.000   3.200
ASSI {  756}
 (( segid "    " and resid  38 and name    O ))
 (( segid "    " and resid   6 and name   HN ))
    0.000   0.000   2.400
ASSI {  757}
 (( segid "    " and resid  38 and name    O ))
 (( segid "    " and resid   6 and name    N ))
    0.000   0.000   3.200
ASSI {  758}
 (( segid "    " and resid  39 and name    O ))
 (( segid "    " and resid  34 and name   HN ))
    0.000   0.000   2.400
ASSI {  759}
 (( segid "    " and resid  39 and name    O ))
 (( segid "    " and resid  34 and name    N ))
    0.000   0.000   3.200
ASSI {  760}
 (( segid "    " and resid  34 and name    O ))
 (( segid "    " and resid  39 and name   HN ))
    0.000   0.000   2.400
ASSI {  761}
 (( segid "    " and resid  34 and name    O ))
 (( segid "    " and resid  39 and name    N ))
    0.000   0.000   3.200
ASSI {  762}
 (( segid "    " and resid  54 and name    O ))
 (( segid "    " and resid  58 and name   HN ))
    0.000   0.000   2.000
ASSI {  763}
 (( segid "    " and resid  54 and name    O ))
 (( segid "    " and resid  58 and name    N ))
    0.000   0.000   2.800
ASSI {  764}
 (( segid "    " and resid  53 and name    O ))
 (( segid "    " and resid  57 and name   HN ))
    0.000   0.000   2.000
ASSI {  765}
 (( segid "    " and resid  53 and name    O ))
 (( segid "    " and resid  57 and name    N ))
    0.000   0.000   2.800
ASSI {  766}
 (( segid "    " and resid  52 and name    O ))
 (( segid "    " and resid  56 and name   HN ))
    0.000   0.000   2.000
ASSI {  767}
 (( segid "    " and resid  52 and name    O ))
 (( segid "    " and resid  56 and name    N ))
    0.000   0.000   2.800
ASSI {  768}
 (( segid "    " and resid  20 and name    O ))
 (( segid "    " and resid  24 and name   HN ))
    0.000   0.000   2.000
ASSI {  769}
 (( segid "    " and resid  20 and name    O ))
 (( segid "    " and resid  24 and name    N ))
    0.000   0.000   2.800
ASSI {  770}
 (( segid "    " and resid  19 and name    O ))
 (( segid "    " and resid  23 and name   HN ))
    0.000   0.000   2.200
ASSI {  771}
 (( segid "    " and resid  19 and name    O ))
 (( segid "    " and resid  23 and name    N ))
    0.000   0.000   3.000
ASSI {  772}
 (( segid "    " and resid  18 and name    O ))
 (( segid "    " and resid  22 and name   HN ))
    0.000   0.000   2.200
ASSI {  773}
 (( segid "    " and resid  18 and name    O ))
 (( segid "    " and resid  22 and name    N ))
    0.000   0.000   3.000
ASSI {  774}
 (( segid "    " and resid  17 and name    O ))
 (( segid "    " and resid  21 and name   HN ))
    0.000   0.000   2.000
ASSI {  775}
 (( segid "    " and resid  17 and name    O ))
 (( segid "    " and resid  21 and name    N ))
    0.000   0.000   2.800
ASSI {  776}
 (( segid "    " and resid  16 and name    O ))
 (( segid "    " and resid  20 and name   HN ))
    0.000   0.000   2.000
ASSI {  777}
 (( segid "    " and resid  16 and name    O ))
 (( segid "    " and resid  20 and name    N ))
    0.000   0.000   2.800
ASSI {  778}
 (( segid "    " and resid  15 and name    O ))
 (( segid "    " and resid  19 and name   HN ))
    0.000   0.000   2.000
ASSI {  779}
 (( segid "    " and resid  15 and name    O ))
 (( segid "    " and resid  19 and name    N ))
    0.000   0.000   2.800

! dihedral angle  restraints
assign (resid   1 and name N ) (resid   1 and name CA)
       (resid   1 and name C ) (resid   2 and name N )  1.00  60   165   2
assign (resid   1 and name C ) (resid   2 and name N )
       (resid   2 and name CA) (resid   2 and name C )  1.00  -180   155   2
assign (resid   1 and name C ) (resid   2 and name N )
       (resid   2 and name CA) (resid   2 and name C )  1.00  -55   150   2
assign (resid   2 and name N ) (resid   2 and name CA)
       (resid   2 and name C ) (resid   3 and name N )  1.00  125   60   2
assign (resid   2 and name C ) (resid   3 and name N )
       (resid   3 and name CA) (resid   3 and name C )  1.00  -165   140   2
assign (resid   2 and name C ) (resid   3 and name N )
       (resid   3 and name CA) (resid   3 and name C )  1.00  -55   130   2
assign (resid   3 and name N ) (resid   3 and name CA)
       (resid   3 and name C ) (resid   4 and name N )  1.00  145   30   2
assign (resid   3 and name C ) (resid   4 and name N )
       (resid   4 and name CA) (resid   4 and name C )  1.00  -120   35   2
assign (resid   4 and name N ) (resid   4 and name CA)
       (resid   4 and name C ) (resid   5 and name N )  1.00  160   25   2
assign (resid   4 and name C ) (resid   5 and name N )
       (resid   5 and name CA) (resid   5 and name C )  1.00  -120   35   2
assign (resid   5 and name N ) (resid   5 and name CA)
       (resid   5 and name C ) (resid   6 and name N )  1.00  130   45   2
assign (resid   5 and name C ) (resid   6 and name N )
       (resid   6 and name CA) (resid   6 and name C )  1.00  -115   30   2
assign (resid   6 and name N ) (resid   6 and name CA)
       (resid   6 and name C ) (resid   7 and name N )  1.00  135   50   2
assign (resid   6 and name C ) (resid   7 and name N )
       (resid   7 and name CA) (resid   7 and name C )  1.00  -120   35   2
assign (resid   7 and name N ) (resid   7 and name CA)
       (resid   7 and name C ) (resid   8 and name N )  1.00  160   35   2
assign (resid   7 and name C ) (resid   8 and name N )
       (resid   8 and name CA) (resid   8 and name C )  1.00  -180   155   2
assign (resid   7 and name C ) (resid   8 and name N )
       (resid   8 and name CA) (resid   8 and name C )  1.00  0   155   2
assign (resid   8 and name N ) (resid   8 and name CA)
       (resid   8 and name C ) (resid   9 and name N )  1.00  0   145   2
assign (resid   8 and name C ) (resid   9 and name N )
       (resid   9 and name CA) (resid   9 and name C )  1.00  165   140   2
assign (resid   8 and name C ) (resid   9 and name N )
       (resid   9 and name CA) (resid   9 and name C )  1.00  -25   60   2
assign (resid   9 and name N ) (resid   9 and name CA)
       (resid   9 and name C ) (resid   10 and name N )  1.00  -150   175   2
assign (resid   9 and name N ) (resid   9 and name CA)
       (resid   9 and name C ) (resid   10 and name N )  1.00  60   165   2
assign (resid   9 and name C ) (resid   10 and name N )
       (resid   10 and name CA) (resid   10 and name C )  1.00  -165   140   2
assign (resid   9 and name C ) (resid   10 and name N )
       (resid   10 and name CA) (resid   10 and name C )  1.00  -55   140   2
assign (resid   10 and name N ) (resid   10 and name CA)
       (resid   10 and name C ) (resid   11 and name N )  1.00  -40   75   2
assign (resid   10 and name C ) (resid   11 and name N )
       (resid   11 and name CA) (resid   11 and name C )  1.00  170   135   2
assign (resid   10 and name C ) (resid   11 and name N )
       (resid   11 and name CA) (resid   11 and name C )  1.00  -70   115   2
assign (resid   10 and name C ) (resid   11 and name N )
       (resid   11 and name CA) (resid   11 and name C )  1.00  65   140   2
assign (resid   11 and name N ) (resid   11 and name CA)
       (resid   11 and name C ) (resid   12 and name N )  1.00  180   45   2
assign (resid   11 and name C ) (resid   12 and name N )
       (resid   12 and name CA) (resid   12 and name C )  1.00  -180   155   2
assign (resid   11 and name C ) (resid   12 and name N )
       (resid   12 and name CA) (resid   12 and name C )  1.00  -60   155   2
assign (resid   12 and name N ) (resid   12 and name CA)
       (resid   12 and name C ) (resid   13 and name N )  1.00  55   160   2
assign (resid   12 and name C ) (resid   13 and name N )
       (resid   13 and name CA) (resid   13 and name C )  1.00  -180   155   2
assign (resid   12 and name C ) (resid   13 and name N )
       (resid   13 and name CA) (resid   13 and name C )  1.00  -60   155   2
assign (resid   13 and name N ) (resid   13 and name CA)
       (resid   13 and name C ) (resid   14 and name N )  1.00  60   175   2
assign (resid   13 and name C ) (resid   14 and name N )
       (resid   14 and name CA) (resid   14 and name C )  1.00  -115   70   2
assign (resid   14 and name N ) (resid   14 and name CA)
       (resid   14 and name C ) (resid   15 and name N )  1.00  -60   25   2
assign (resid   14 and name C ) (resid   15 and name N )
       (resid   15 and name CA) (resid   15 and name C )  1.00  -160   115   2
assign (resid   14 and name C ) (resid   15 and name N )
       (resid   15 and name CA) (resid   15 and name C )  1.00  -50   145   2
assign (resid   14 and name C ) (resid   15 and name N )
       (resid   15 and name CA) (resid   15 and name C )  1.00  60   135   2
assign (resid   15 and name N ) (resid   15 and name CA)
       (resid   15 and name C ) (resid   16 and name N )  1.00  0   95   2
assign (resid   15 and name C ) (resid   16 and name N )
       (resid   16 and name CA) (resid   16 and name C )  1.00  -160   115   2
assign (resid   15 and name C ) (resid   16 and name N )
       (resid   16 and name CA) (resid   16 and name C )  1.00  -50   145   2
assign (resid   15 and name C ) (resid   16 and name N )
       (resid   16 and name CA) (resid   16 and name C )  1.00  60   135   2
assign (resid   16 and name N ) (resid   16 and name CA)
       (resid   16 and name C ) (resid   17 and name N )  1.00  -5   90   2
assign (resid   16 and name C ) (resid   17 and name N )
       (resid   17 and name CA) (resid   17 and name C )  1.00  -60   15   2
assign (resid   17 and name N ) (resid   17 and name CA)
       (resid   17 and name C ) (resid   18 and name N )  1.00  -55   30   2
assign (resid   17 and name C ) (resid   18 and name N )
       (resid   18 and name CA) (resid   18 and name C )  1.00  -55   20   2
assign (resid   18 and name N ) (resid   18 and name CA)
       (resid   18 and name C ) (resid   19 and name N )  1.00  -60   35   2
assign (resid   18 and name C ) (resid   19 and name N )
       (resid   19 and name CA) (resid   19 and name C )  1.00  -50   15   2
assign (resid   19 and name N ) (resid   19 and name CA)
       (resid   19 and name C ) (resid   20 and name N )  1.00  -40   35   2
assign (resid   19 and name C ) (resid   20 and name N )
       (resid   20 and name CA) (resid   20 and name C )  1.00  -120   85   2
assign (resid   19 and name C ) (resid   20 and name N )
       (resid   20 and name CA) (resid   20 and name C )  1.00  65   130   2
assign (resid   20 and name N ) (resid   20 and name CA)
       (resid   20 and name C ) (resid   21 and name N )  1.00  -140   135   2
assign (resid   20 and name C ) (resid   21 and name N )
       (resid   21 and name CA) (resid   21 and name C )  1.00  -160   115   2
assign (resid   20 and name C ) (resid   21 and name N )
       (resid   21 and name CA) (resid   21 and name C )  1.00  -50   145   2
assign (resid   20 and name C ) (resid   21 and name N )
       (resid   21 and name CA) (resid   21 and name C )  1.00  60   135   2
assign (resid   21 and name N ) (resid   21 and name CA)
       (resid   21 and name C ) (resid   22 and name N )  1.00  0   95   2
assign (resid   21 and name C ) (resid   22 and name N )
       (resid   22 and name CA) (resid   22 and name C )  1.00  -50   15   2
assign (resid   22 and name N ) (resid   22 and name CA)
       (resid   22 and name C ) (resid   23 and name N )  1.00  -40   25   2
assign (resid   22 and name C ) (resid   23 and name N )
       (resid   23 and name CA) (resid   23 and name C )  1.00  -60   15   2
assign (resid   23 and name N ) (resid   23 and name CA)
       (resid   23 and name C ) (resid   24 and name N )  1.00  -40   45   2
assign (resid   23 and name C ) (resid   24 and name N )
       (resid   24 and name CA) (resid   24 and name C )  1.00  -90   15   2
assign (resid   24 and name N ) (resid   24 and name CA)
       (resid   24 and name C ) (resid   25 and name N )  1.00  -10   35   2
assign (resid   24 and name C ) (resid   25 and name N )
       (resid   25 and name CA) (resid   25 and name C )  1.00  -70   15   2
assign (resid   25 and name N ) (resid   25 and name CA)
       (resid   25 and name C ) (resid   26 and name N )  1.00  -150   105   2
assign (resid   25 and name N ) (resid   25 and name CA)
       (resid   25 and name C ) (resid   26 and name N )  1.00  60   115   2
assign (resid   26 and name N ) (resid   26 and name CA)
       (resid   26 and name C ) (resid   27 and name N )  1.00  -130   135   2
assign (resid   26 and name N ) (resid   26 and name CA)
       (resid   26 and name C ) (resid   27 and name N )  1.00  55   150   2
assign (resid   26 and name C ) (resid   27 and name N )
       (resid   27 and name CA) (resid   27 and name C )  1.00  -180   145   2
assign (resid   27 and name N ) (resid   27 and name CA)
       (resid   27 and name C ) (resid   28 and name N )  1.00  0   95   2
assign (resid   27 and name C ) (resid   28 and name N )
       (resid   28 and name CA) (resid   28 and name C )  1.00  -80   15   2
assign (resid   28 and name N ) (resid   28 and name CA)
       (resid   28 and name C ) (resid   29 and name N )  1.00  110   105   2
assign (resid   28 and name C ) (resid   29 and name N )
       (resid   29 and name CA) (resid   29 and name C )  1.00  165   120   2
assign (resid   28 and name C ) (resid   29 and name N )
       (resid   29 and name CA) (resid   29 and name C )  1.00  -40   125   2
assign (resid   29 and name N ) (resid   29 and name CA)
       (resid   29 and name C ) (resid   30 and name N )  1.00  -125   170   2
assign (resid   29 and name N ) (resid   29 and name CA)
       (resid   29 and name C ) (resid   30 and name N )  1.00  -5   90   2
assign (resid   29 and name C ) (resid   30 and name N )
       (resid   30 and name CA) (resid   30 and name C )  1.00  165   140   2
assign (resid   29 and name C ) (resid   30 and name N )
       (resid   30 and name CA) (resid   30 and name C )  1.00  -45   140   2
assign (resid   29 and name C ) (resid   30 and name N )
       (resid   30 and name CA) (resid   30 and name C )  1.00  60   145   2
assign (resid   30 and name N ) (resid   30 and name CA)
       (resid   30 and name C ) (resid   31 and name N )  1.00  115   60   2
assign (resid   30 and name C ) (resid   31 and name N )
       (resid   31 and name CA) (resid   31 and name C )  1.00  165   120   2
assign (resid   30 and name C ) (resid   31 and name N )
       (resid   31 and name CA) (resid   31 and name C )  1.00  -40   115   2
assign (resid   31 and name N ) (resid   31 and name CA)
       (resid   31 and name C ) (resid   32 and name N )  1.00  115   60   2
assign (resid   31 and name C ) (resid   32 and name N )
       (resid   32 and name CA) (resid   32 and name C )  1.00  170   115   2
assign (resid   31 and name C ) (resid   32 and name N )
       (resid   32 and name CA) (resid   32 and name C )  1.00  -40   115   2
assign (resid   32 and name N ) (resid   32 and name CA)
       (resid   32 and name C ) (resid   33 and name N )  1.00  115   60   2
assign (resid   32 and name C ) (resid   33 and name N )
       (resid   33 and name CA) (resid   33 and name C )  1.00  -165   140   2
assign (resid   32 and name C ) (resid   33 and name N )
       (resid   33 and name CA) (resid   33 and name C )  1.00  -55   130   2
assign (resid   33 and name N ) (resid   33 and name CA)
       (resid   33 and name C ) (resid   34 and name N )  1.00  140   35   2
assign (resid   33 and name C ) (resid   34 and name N )
       (resid   34 and name CA) (resid   34 and name C )  1.00  -120   35   2
assign (resid   34 and name N ) (resid   34 and name CA)
       (resid   34 and name C ) (resid   35 and name N )  1.00  115   60   2
assign (resid   34 and name C ) (resid   35 and name N )
       (resid   35 and name CA) (resid   35 and name C )  1.00  165   140   2
assign (resid   34 and name C ) (resid   35 and name N )
       (resid   35 and name CA) (resid   35 and name C )  1.00  -65   120   2
assign (resid   34 and name C ) (resid   35 and name N )
       (resid   35 and name CA) (resid   35 and name C )  1.00  60   145   2
assign (resid   35 and name N ) (resid   35 and name CA)
       (resid   35 and name C ) (resid   36 and name N )  1.00  -175   130   2
assign (resid   35 and name N ) (resid   35 and name CA)
       (resid   35 and name C ) (resid   36 and name N )  1.00  65   120   2
assign (resid   36 and name N ) (resid   36 and name CA)
       (resid   36 and name C ) (resid   37 and name N )  1.00  -150   165   2
assign (resid   36 and name N ) (resid   36 and name CA)
       (resid   36 and name C ) (resid   37 and name N )  1.00  -35   140   2
assign (resid   36 and name N ) (resid   36 and name CA)
       (resid   36 and name C ) (resid   37 and name N )  1.00  55   150   2
assign (resid   36 and name C ) (resid   37 and name N )
       (resid   37 and name CA) (resid   37 and name C )  1.00  -90   15   2
assign (resid   37 and name N ) (resid   37 and name CA)
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assign (resid   37 and name C ) (resid   38 and name N )
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assign (resid   38 and name N ) (resid   38 and name CA)
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assign (resid   38 and name C ) (resid   39 and name N )
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assign (resid   39 and name N ) (resid   39 and name CA)
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assign (resid   39 and name C ) (resid   40 and name N )
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assign (resid   39 and name C ) (resid   40 and name N )
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assign (resid   40 and name N ) (resid   40 and name CA)
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assign (resid   40 and name C ) (resid   41 and name N )
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assign (resid   41 and name N ) (resid   41 and name CA)
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assign (resid   41 and name C ) (resid   42 and name N )
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assign (resid   41 and name C ) (resid   42 and name N )
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assign (resid   42 and name N ) (resid   42 and name CA)
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assign (resid   42 and name C ) (resid   43 and name N )
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assign (resid   42 and name C ) (resid   43 and name N )
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assign (resid   43 and name N ) (resid   43 and name CA)
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assign (resid   43 and name C ) (resid   44 and name N )
       (resid   44 and name CA) (resid   44 and name C )  1.00  -120   35   2
assign (resid   44 and name N ) (resid   44 and name CA)
       (resid   44 and name C ) (resid   45 and name N )  1.00  160   35   2
assign (resid   44 and name C ) (resid   45 and name N )
       (resid   45 and name CA) (resid   45 and name C )  1.00  165   140   2
assign (resid   44 and name C ) (resid   45 and name N )
       (resid   45 and name CA) (resid   45 and name C )  1.00  -55   120   2
assign (resid   44 and name C ) (resid   45 and name N )
       (resid   45 and name CA) (resid   45 and name C )  1.00  60   145   2
assign (resid   45 and name N ) (resid   45 and name CA)
       (resid   45 and name C ) (resid   46 and name N )  1.00  -175   130   2
assign (resid   45 and name N ) (resid   45 and name CA)
       (resid   45 and name C ) (resid   46 and name N )  1.00  60   115   2
assign (resid   46 and name N ) (resid   46 and name CA)
       (resid   46 and name C ) (resid   47 and name N )  1.00  -150   165   2
assign (resid   46 and name N ) (resid   46 and name CA)
       (resid   46 and name C ) (resid   47 and name N )  1.00  55   150   2
assign (resid   46 and name C ) (resid   47 and name N )
       (resid   47 and name CA) (resid   47 and name C )  1.00  -180   155   2
assign (resid   47 and name N ) (resid   47 and name CA)
       (resid   47 and name C ) (resid   48 and name N )  1.00  0   105   2
assign (resid   47 and name C ) (resid   48 and name N )
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assign (resid   48 and name N ) (resid   48 and name CA)
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assign (resid   48 and name C ) (resid   49 and name N )
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assign (resid   48 and name C ) (resid   49 and name N )
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assign (resid   48 and name C ) (resid   49 and name N )
       (resid   49 and name CA) (resid   49 and name C )  1.00  60   165   2
assign (resid   49 and name N ) (resid   49 and name CA)
       (resid   49 and name C ) (resid   50 and name N )  1.00  120   65   2
assign (resid   50 and name N ) (resid   50 and name CA)
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assign (resid   50 and name C ) (resid   51 and name N )
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assign (resid   51 and name N ) (resid   51 and name CA)
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assign (resid   51 and name C ) (resid   52 and name N )
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assign (resid   51 and name C ) (resid   52 and name N )
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assign (resid   51 and name C ) (resid   52 and name N )
       (resid   52 and name CA) (resid   52 and name C )  1.00  65   140   2
assign (resid   52 and name N ) (resid   52 and name CA)
       (resid   52 and name C ) (resid   53 and name N )  1.00  -5   80   2
assign (resid   53 and name C ) (resid   54 and name N )
       (resid   54 and name CA) (resid   54 and name C )  1.00  170   145   2
assign (resid   53 and name C ) (resid   54 and name N )
       (resid   54 and name CA) (resid   54 and name C )  1.00  -70   115   2
assign (resid   53 and name C ) (resid   54 and name N )
       (resid   54 and name CA) (resid   54 and name C )  1.00  65   140   2
assign (resid   54 and name N ) (resid   54 and name CA)
       (resid   54 and name C ) (resid   55 and name N )  1.00  -120   105   2
assign (resid   54 and name C ) (resid   55 and name N )
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assign (resid   54 and name C ) (resid   55 and name N )
       (resid   55 and name CA) (resid   55 and name C )  1.00  65   130   2
assign (resid   55 and name N ) (resid   55 and name CA)
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assign (resid   55 and name N ) (resid   55 and name CA)
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assign (resid   55 and name C ) (resid   56 and name N )
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assign (resid   55 and name C ) (resid   56 and name N )
       (resid   56 and name CA) (resid   56 and name C )  1.00  65   130   2
assign (resid   56 and name N ) (resid   56 and name CA)
       (resid   56 and name C ) (resid   57 and name N )  1.00  -170   165   2
assign (resid   56 and name N ) (resid   56 and name CA)
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assign (resid   56 and name C ) (resid   57 and name N )
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assign (resid   56 and name C ) (resid   57 and name N )
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assign (resid   57 and name N ) (resid   57 and name CA)
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assign (resid   57 and name C ) (resid   58 and name N )
       (resid   58 and name CA) (resid   58 and name C )  1.00  -125   80   2
assign (resid   57 and name C ) (resid   58 and name N )
       (resid   58 and name CA) (resid   58 and name C )  1.00  65   130   2
assign (resid   58 and name N ) (resid   58 and name CA)
       (resid   58 and name C ) (resid   59 and name N )  1.00  -170   165   2
assign (resid   58 and name N ) (resid   58 and name CA)
       (resid   58 and name C ) (resid   59 and name N )  1.00  15   70   2
assign (resid   58 and name C ) (resid   59 and name N )
       (resid   59 and name CA) (resid   59 and name C )  1.00  -180   145   2
assign (resid   59 and name N ) (resid   59 and name CA)
       (resid   59 and name C ) (resid   60 and name N )  1.00  0   95   2
assign (resid   60 and name C ) (resid   61 and name N )
       (resid   61 and name CA) (resid   61 and name C )  1.00  -180   145   2
assign (resid   61 and name N ) (resid   61 and name CA)
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assign (resid   61 and name C ) (resid   62 and name N )
       (resid   62 and name CA) (resid   62 and name C )  1.00  -120   35   2
assign (resid   62 and name N ) (resid   62 and name CA)
       (resid   62 and name C ) (resid   63 and name N )  1.00  -175   30   2
assign (resid   62 and name C ) (resid   63 and name N )
       (resid   63 and name CA) (resid   63 and name C )  1.00  -120   35   2
assign (resid   63 and name N ) (resid   63 and name CA)
       (resid   63 and name C ) (resid   64 and name N )  1.00  115   80   2
assign (resid   63 and name C ) (resid   64 and name N )
       (resid   64 and name CA) (resid   64 and name C )  1.00  165   110   2
assign (resid   63 and name C ) (resid   64 and name N )
       (resid   64 and name CA) (resid   64 and name C )  1.00  -45   110   2
assign (resid   64 and name N ) (resid   64 and name CA)
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assign (resid   64 and name C ) (resid   65 and name N )
       (resid   65 and name CA) (resid   65 and name C )  1.00  165   120   2
assign (resid   64 and name C ) (resid   65 and name N )
       (resid   65 and name CA) (resid   65 and name C )  1.00  -40   115   2
assign (resid   65 and name N ) (resid   65 and name CA)
       (resid   65 and name C ) (resid   66 and name N )  1.00  175   50   2
assign (resid   65 and name C ) (resid   66 and name N )
       (resid   66 and name CA) (resid   66 and name C )  1.00  125   80   2
assign (resid   65 and name C ) (resid   66 and name N )
       (resid   66 and name CA) (resid   66 and name C )  1.00  -55   110   2
assign (resid   66 and name N ) (resid   66 and name CA)
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assign (resid   66 and name C ) (resid   67 and name N )
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assign (resid   66 and name C ) (resid   67 and name N )
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assign (resid   67 and name N ) (resid   67 and name CA)
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assign (resid   67 and name C ) (resid   68 and name N )
       (resid   68 and name CA) (resid   68 and name C )  1.00  -180   155   2
assign (resid   67 and name C ) (resid   68 and name N )
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assign (resid   67 and name C ) (resid   68 and name N )
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assign (resid   68 and name N ) (resid   68 and name CA)
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assign (resid   68 and name C ) (resid   69 and name N )
       (resid   69 and name CA) (resid   69 and name C )  1.00  -180   155   2
assign (resid   68 and name C ) (resid   69 and name N )
       (resid   69 and name CA) (resid   69 and name C )  1.00  -55   150   2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1   2.158   1.679  -0.372
    2    H2   MET   1           H2       MET   1   1.276   0.285  -0.768
    3    H3   MET   1           H3       MET   1   0.461   1.730  -0.417
    4    HA   MET   1           HA       MET   1   1.394   2.776  -2.361
    5    HB2  MET   1           HB2      MET   1   3.424   1.160  -2.269
    6    HB3  MET   1           HB3      MET   1   2.411   0.078  -3.214
    7    HG2  MET   1           HG2      MET   1   2.479   2.780  -4.279
    8    HG3  MET   1           HG3      MET   1   4.073   2.037  -4.192
    9    HE1  MET   1           HE1      MET   1   4.206  -0.563  -4.692
   10    HE2  MET   1           HE2      MET   1   2.602  -1.284  -4.816
   11    HE3  MET   1           HE3      MET   1   3.644  -1.201  -6.236
   12    H    THR   2           HN       THR   2   0.436  -0.667  -2.401
   13    HA   THR   2           HA       THR   2  -1.320  -0.214  -4.634
   14    HB   THR   2           HB       THR   2  -1.682  -2.774  -3.344
   15    HG1  THR   2           HG1      THR   2   0.419  -3.462  -3.325
   16   HG21  THR   2          HG21      THR   2  -0.747  -3.528  -5.571
   17   HG22  THR   2          HG22      THR   2  -0.576  -1.822  -5.984
   18   HG23  THR   2          HG23      THR   2  -2.173  -2.494  -5.658
   19    H    HIS   3           HN       HIS   3  -2.643   1.392  -3.477
   20    HA   HIS   3           HA       HIS   3  -4.888  -0.021  -2.192
   21    HB2  HIS   3           HB2      HIS   3  -3.621   2.563  -1.499
   22    HB3  HIS   3           HB3      HIS   3  -5.366   2.497  -1.410
   23    HD1  HIS   3           HD1      HIS   3  -2.285   1.402   0.327
   24    HD2  HIS   3           HD2      HIS   3  -6.393   0.804   0.616
   25    HE1  HIS   3           HE1      HIS   3  -2.666   0.383   2.593
   26    HE2  HIS   3           HE2      HIS   3  -5.170   0.312   2.848
   27    H    LEU   4           HN       LEU   4  -6.885   0.502  -2.910
   28    HA   LEU   4           HA       LEU   4  -7.042   2.265  -5.255
   29    HB2  LEU   4           HB2      LEU   4  -7.396  -0.537  -5.216
   30    HB3  LEU   4           HB3      LEU   4  -8.990   0.163  -5.405
   31    HG   LEU   4           HG       LEU   4  -7.939   1.542  -7.316
   32   HD11  LEU   4          HD11      LEU   4  -5.970   0.786  -8.311
   33   HD12  LEU   4          HD12      LEU   4  -5.599   0.799  -6.587
   34   HD13  LEU   4          HD13      LEU   4  -5.977  -0.721  -7.396
   35   HD21  LEU   4          HD21      LEU   4  -9.233   0.142  -8.443
   36   HD22  LEU   4          HD22      LEU   4  -7.894  -1.005  -8.503
   37   HD23  LEU   4          HD23      LEU   4  -9.062  -1.081  -7.183
   38    H    LYS   5           HN       LYS   5  -9.055   3.291  -5.555
   39    HA   LYS   5           HA       LYS   5 -10.636   3.409  -3.068
   40    HB2  LYS   5           HB2      LYS   5  -9.271   5.446  -4.000
   41    HB3  LYS   5           HB3      LYS   5 -10.647   5.620  -5.080
   42    HG2  LYS   5           HG2      LYS   5 -12.089   5.600  -2.991
   43    HG3  LYS   5           HG3      LYS   5 -10.585   5.812  -2.088
   44    HD2  LYS   5           HD2      LYS   5 -10.739   8.000  -2.458
   45    HD3  LYS   5           HD3      LYS   5 -10.511   7.686  -4.179
   46    HE2  LYS   5           HE2      LYS   5 -12.506   8.729  -4.327
   47    HE3  LYS   5           HE3      LYS   5 -13.115   7.111  -3.973
   48    HZ1  LYS   5           HZ1      LYS   5 -14.016   7.862  -2.119
   49    HZ2  LYS   5           HZ2      LYS   5 -13.514   9.436  -2.507
   50    HZ3  LYS   5           HZ3      LYS   5 -12.521   8.440  -1.561
   51    H    ILE   6           HN       ILE   6 -12.789   3.147  -3.133
   52    HA   ILE   6           HA       ILE   6 -13.910   2.231  -5.667
   53    HB   ILE   6           HB       ILE   6 -14.476   1.729  -2.819
   54   HG12  ILE   6          HG12      ILE   6 -15.254  -0.463  -3.859
   55   HG13  ILE   6          HG13      ILE   6 -14.736   0.199  -5.405
   56   HG21  ILE   6          HG21      ILE   6 -16.818   1.206  -3.077
   57   HG22  ILE   6          HG22      ILE   6 -16.551   2.905  -3.470
   58   HG23  ILE   6          HG23      ILE   6 -16.783   1.726  -4.762
   59   HD11  ILE   6          HD11      ILE   6 -12.717  -0.595  -4.989
   60   HD12  ILE   6          HD12      ILE   6 -12.577   0.556  -3.659
   61   HD13  ILE   6          HD13      ILE   6 -13.192  -1.071  -3.358
   62    H    THR   7           HN       THR   7 -15.378   3.330  -6.811
   63    HA   THR   7           HA       THR   7 -16.809   5.562  -5.580
   64    HB   THR   7           HB       THR   7 -16.048   6.401  -8.194
   65    HG1  THR   7           HG1      THR   7 -14.081   5.050  -6.819
   66   HG21  THR   7          HG21      THR   7 -16.629   7.734  -6.097
   67   HG22  THR   7          HG22      THR   7 -15.297   8.345  -7.080
   68   HG23  THR   7          HG23      THR   7 -14.961   7.455  -5.595
   69    H    GLY   8           HN       GLY   8 -18.570   6.351  -7.059
   70    HA2  GLY   8           HA1      GLY   8 -20.226   6.008  -8.658
   71    HA3  GLY   8           HA2      GLY   8 -19.373   4.567  -9.194
   72    H    MET   9           HN       MET   9 -19.219   3.057  -6.979
   73    HA   MET   9           HA       MET   9 -21.963   2.196  -6.620
   74    HB2  MET   9           HB2      MET   9 -19.388   1.005  -5.576
   75    HB3  MET   9           HB3      MET   9 -20.976   0.260  -5.482
   76    HG2  MET   9           HG2      MET   9 -21.072  -0.120  -7.766
   77    HG3  MET   9           HG3      MET   9 -19.797   1.044  -8.114
   78    HE1  MET   9           HE1      MET   9 -17.355   0.712  -7.833
   79    HE2  MET   9           HE2      MET   9 -17.402   0.306  -6.117
   80    HE3  MET   9           HE3      MET   9 -16.544  -0.740  -7.251
   81    H    THR  10           HN       THR  10 -21.903   1.059  -4.122
   82    HA   THR  10           HA       THR  10 -21.578   3.380  -2.349
   83    HB   THR  10           HB       THR  10 -23.338   0.978  -1.827
   84    HG1  THR  10           HG1      THR  10 -23.864   3.468  -3.118
   85   HG21  THR  10          HG21      THR  10 -24.341   3.232  -0.549
   86   HG22  THR  10          HG22      THR  10 -22.596   3.359  -0.333
   87   HG23  THR  10          HG23      THR  10 -23.446   1.912   0.208
   88    H    CYS  11           HN       CYS  11 -21.764  -0.147  -1.787
   89    HA   CYS  11           HA       CYS  11 -19.092  -0.530  -1.069
   90    HB2  CYS  11           HB2      CYS  11 -19.390  -0.689   1.413
   91    HB3  CYS  11           HB3      CYS  11 -19.401   0.945   0.767
   92    HG   CYS  11           HG       CYS  11 -22.483  -0.206   0.882
   93    H    ASP  12           HN       ASP  12 -19.024  -2.448   0.668
   94    HA   ASP  12           HA       ASP  12 -19.386  -4.617   1.097
   95    HB2  ASP  12           HB2      ASP  12 -21.326  -3.544   2.270
   96    HB3  ASP  12           HB3      ASP  12 -22.318  -3.950   0.873
   97    H    SER  13           HN       SER  13 -22.399  -4.749  -0.646
   98    HA   SER  13           HA       SER  13 -21.595  -7.005  -2.109
   99    HB2  SER  13           HB2      SER  13 -23.742  -5.544  -3.400
  100    HB3  SER  13           HB3      SER  13 -23.789  -7.105  -2.578
  101    HG   SER  13           HG       SER  13 -24.108  -6.061  -0.635
  102    H    CYS  14           HN       CYS  14 -21.447  -3.589  -2.773
  103    HA   CYS  14           HA       CYS  14 -20.739  -3.780  -5.512
  104    HB2  CYS  14           HB2      CYS  14 -19.859  -1.602  -3.616
  105    HB3  CYS  14           HB3      CYS  14 -20.118  -1.494  -5.343
  106    HG   CYS  14           HG       CYS  14 -22.993  -2.266  -4.658
  107    H    ALA  15           HN       ALA  15 -18.912  -3.750  -2.495
  108    HA   ALA  15           HA       ALA  15 -16.345  -3.674  -3.737
  109    HB1  ALA  15           HB1      ALA  15 -15.449  -3.951  -1.577
  110    HB2  ALA  15           HB2      ALA  15 -16.921  -3.003  -1.357
  111    HB3  ALA  15           HB3      ALA  15 -16.918  -4.727  -0.982
  112    H    ALA  16           HN       ALA  16 -18.624  -6.166  -3.064
  113    HA   ALA  16           HA       ALA  16 -16.890  -8.383  -2.910
  114    HB1  ALA  16           HB1      ALA  16 -19.689  -7.933  -2.877
  115    HB2  ALA  16           HB2      ALA  16 -19.353  -9.183  -4.075
  116    HB3  ALA  16           HB3      ALA  16 -18.805  -9.387  -2.411
  117    H    HIS  17           HN       HIS  17 -18.619  -6.923  -5.651
  118    HA   HIS  17           HA       HIS  17 -17.614  -8.809  -7.541
  119    HB2  HIS  17           HB2      HIS  17 -19.681  -7.209  -7.723
  120    HB3  HIS  17           HB3      HIS  17 -18.501  -6.074  -8.361
  121    HD1  HIS  17           HD1      HIS  17 -19.845  -6.245 -10.659
  122    HD2  HIS  17           HD2      HIS  17 -17.884  -9.711  -9.444
  123    HE1  HIS  17           HE1      HIS  17 -19.727  -7.714 -12.698
  124    HE2  HIS  17           HE2      HIS  17 -18.323  -9.684 -11.993
  125    H    VAL  18           HN       VAL  18 -16.602  -5.675  -6.377
  126    HA   VAL  18           HA       VAL  18 -14.521  -5.191  -8.202
  127    HB   VAL  18           HB       VAL  18 -14.796  -4.405  -5.296
  128   HG11  VAL  18          HG11      VAL  18 -12.799  -3.314  -7.271
  129   HG12  VAL  18          HG12      VAL  18 -12.973  -2.873  -5.573
  130   HG13  VAL  18          HG13      VAL  18 -12.411  -4.486  -6.013
  131   HG21  VAL  18          HG21      VAL  18 -14.856  -2.350  -7.370
  132   HG22  VAL  18          HG22      VAL  18 -16.164  -3.526  -7.494
  133   HG23  VAL  18          HG23      VAL  18 -15.938  -2.613  -6.001
  134    H    LYS  19           HN       LYS  19 -14.497  -6.849  -5.056
  135    HA   LYS  19           HA       LYS  19 -11.795  -7.640  -5.133
  136    HB2  LYS  19           HB2      LYS  19 -13.064  -7.684  -3.063
  137    HB3  LYS  19           HB3      LYS  19 -14.174  -8.870  -3.732
  138    HG2  LYS  19           HG2      LYS  19 -11.683 -10.063  -3.981
  139    HG3  LYS  19           HG3      LYS  19 -11.630  -9.257  -2.412
  140    HD2  LYS  19           HD2      LYS  19 -13.942 -10.332  -2.032
  141    HD3  LYS  19           HD3      LYS  19 -13.508 -11.383  -3.381
  142    HE2  LYS  19           HE2      LYS  19 -11.331 -11.192  -1.516
  143    HE3  LYS  19           HE3      LYS  19 -12.806 -11.683  -0.684
  144    HZ1  LYS  19           HZ1      LYS  19 -12.956 -13.288  -2.755
  145    HZ2  LYS  19           HZ2      LYS  19 -12.066 -13.699  -1.373
  146    HZ3  LYS  19           HZ3      LYS  19 -11.272 -13.085  -2.743
  147    H    GLU  20           HN       GLU  20 -14.744  -9.159  -6.319
  148    HA   GLU  20           HA       GLU  20 -13.596 -11.618  -7.072
  149    HB2  GLU  20           HB2      GLU  20 -16.101 -10.850  -6.893
  150    HB3  GLU  20           HB3      GLU  20 -15.884 -10.421  -8.584
  151    HG2  GLU  20           HG2      GLU  20 -14.867 -13.042  -8.206
  152    HG3  GLU  20           HG3      GLU  20 -16.461 -12.952  -7.458
  153    H    ALA  21           HN       ALA  21 -14.092  -8.605  -8.839
  154    HA   ALA  21           HA       ALA  21 -13.118  -9.541 -11.332
  155    HB1  ALA  21           HB1      ALA  21 -14.042  -7.586 -11.878
  156    HB2  ALA  21           HB2      ALA  21 -14.000  -7.026 -10.207
  157    HB3  ALA  21           HB3      ALA  21 -12.592  -6.808 -11.245
  158    H    LEU  22           HN       LEU  22 -11.623  -8.164  -8.493
  159    HA   LEU  22           HA       LEU  22  -9.035  -7.766  -9.574
  160    HB2  LEU  22           HB2      LEU  22 -10.187  -8.001  -6.831
  161    HB3  LEU  22           HB3      LEU  22  -8.448  -8.124  -7.020
  162    HG   LEU  22           HG       LEU  22  -9.942  -5.793  -8.180
  163   HD11  LEU  22          HD11      LEU  22 -10.657  -5.624  -5.972
  164   HD12  LEU  22          HD12      LEU  22  -9.132  -6.237  -5.330
  165   HD13  LEU  22          HD13      LEU  22  -9.210  -4.618  -6.024
  166   HD21  LEU  22          HD21      LEU  22  -7.122  -6.480  -7.524
  167   HD22  LEU  22          HD22      LEU  22  -7.791  -5.708  -8.962
  168   HD23  LEU  22          HD23      LEU  22  -7.627  -4.791  -7.464
  169    H    GLU  23           HN       GLU  23 -10.553 -10.444  -7.828
  170    HA   GLU  23           HA       GLU  23  -8.206 -12.084  -7.931
  171    HB2  GLU  23           HB2      GLU  23 -10.984 -12.387  -6.935
  172    HB3  GLU  23           HB3      GLU  23 -10.113 -13.864  -7.333
  173    HG2  GLU  23           HG2      GLU  23  -8.381 -13.351  -5.790
  174    HG3  GLU  23           HG3      GLU  23  -9.014 -11.729  -5.529
  175    H    LYS  24           HN       LYS  24 -10.683 -11.357 -10.136
  176    HA   LYS  24           HA       LYS  24 -10.485 -13.739 -11.714
  177    HB2  LYS  24           HB2      LYS  24 -11.843 -11.159 -11.875
  178    HB3  LYS  24           HB3      LYS  24 -11.223 -11.683 -13.435
  179    HG2  LYS  24           HG2      LYS  24 -12.685 -13.392 -13.597
  180    HG3  LYS  24           HG3      LYS  24 -12.684 -13.708 -11.861
  181    HD2  LYS  24           HD2      LYS  24 -14.353 -12.201 -11.450
  182    HD3  LYS  24           HD3      LYS  24 -13.890 -11.160 -12.797
  183    HE2  LYS  24           HE2      LYS  24 -15.162 -12.291 -14.289
  184    HE3  LYS  24           HE3      LYS  24 -14.892 -13.846 -13.505
  185    HZ1  LYS  24           HZ1      LYS  24 -16.379 -12.349 -11.715
  186    HZ2  LYS  24           HZ2      LYS  24 -16.920 -13.650 -12.663
  187    HZ3  LYS  24           HZ3      LYS  24 -17.086 -12.066 -13.232
  188    H    VAL  25           HN       VAL  25  -8.647 -10.892 -11.259
  189    HA   VAL  25           HA       VAL  25  -7.027 -11.245 -13.637
  190    HB   VAL  25           HB       VAL  25  -6.758  -9.383 -11.270
  191   HG11  VAL  25          HG11      VAL  25  -4.734 -10.162 -13.001
  192   HG12  VAL  25          HG12      VAL  25  -5.288  -8.618 -13.650
  193   HG13  VAL  25          HG13      VAL  25  -4.746  -8.727 -11.976
  194   HG21  VAL  25          HG21      VAL  25  -8.678  -8.905 -12.698
  195   HG22  VAL  25          HG22      VAL  25  -7.453  -7.644 -12.840
  196   HG23  VAL  25          HG23      VAL  25  -7.625  -8.855 -14.111
  197    HA   PRO  26           HA       PRO  26  -4.622 -14.334 -11.482
  198    HB2  PRO  26           HB2      PRO  26  -2.794 -14.769 -13.435
  199    HB3  PRO  26           HB3      PRO  26  -4.450 -15.386 -13.516
  200    HG2  PRO  26           HG2      PRO  26  -3.269 -12.951 -14.800
  201    HG3  PRO  26           HG3      PRO  26  -4.358 -14.164 -15.496
  202    HD2  PRO  26           HD2      PRO  26  -5.236 -11.762 -14.615
  203    HD3  PRO  26           HD3      PRO  26  -6.229 -13.231 -14.515
  204    H    GLY  27           HN       GLY  27  -3.777 -11.199 -11.892
  205    HA2  GLY  27           HA1      GLY  27  -0.976 -11.537 -11.103
  206    HA3  GLY  27           HA2      GLY  27  -1.745 -10.023 -11.560
  207    H    VAL  28           HN       VAL  28  -3.952 -11.361  -9.640
  208    HA   VAL  28           HA       VAL  28  -3.239  -9.674  -7.418
  209    HB   VAL  28           HB       VAL  28  -5.614 -10.202  -8.403
  210   HG11  VAL  28          HG11      VAL  28  -5.796 -12.159  -6.173
  211   HG12  VAL  28          HG12      VAL  28  -6.781 -12.002  -7.627
  212   HG13  VAL  28          HG13      VAL  28  -5.169 -12.711  -7.726
  213   HG21  VAL  28          HG21      VAL  28  -5.503 -10.141  -5.417
  214   HG22  VAL  28          HG22      VAL  28  -4.851  -8.795  -6.353
  215   HG23  VAL  28          HG23      VAL  28  -6.548  -9.246  -6.521
  216    H    GLN  29           HN       GLN  29  -2.707 -10.255  -5.377
  217    HA   GLN  29           HA       GLN  29  -1.993 -13.084  -4.946
  218    HB2  GLN  29           HB2      GLN  29  -0.897 -10.556  -3.694
  219    HB3  GLN  29           HB3      GLN  29  -0.474 -12.176  -3.163
  220    HG2  GLN  29           HG2      GLN  29  -0.022 -12.154  -5.918
  221    HG3  GLN  29           HG3      GLN  29   0.598 -10.617  -5.322
  222   HE21  GLN  29          HE21      GLN  29   1.791 -13.266  -6.268
  223   HE22  GLN  29          HE22      GLN  29   2.998 -13.608  -5.074
  224    H    SER  30           HN       SER  30  -3.228 -10.184  -3.347
  225    HA   SER  30           HA       SER  30  -5.123 -11.741  -1.814
  226    HB2  SER  30           HB2      SER  30  -3.764 -10.049   0.081
  227    HB3  SER  30           HB3      SER  30  -4.022 -11.792   0.145
  228    HG   SER  30           HG       SER  30  -2.015 -12.069  -0.396
  229    H    ALA  31           HN       ALA  31  -6.798 -10.576  -2.607
  230    HA   ALA  31           HA       ALA  31  -6.670  -7.651  -2.455
  231    HB1  ALA  31           HB1      ALA  31  -8.706  -9.424  -3.804
  232    HB2  ALA  31           HB2      ALA  31  -8.643  -7.663  -3.889
  233    HB3  ALA  31           HB3      ALA  31  -7.347  -8.627  -4.597
  234    H    LEU  32           HN       LEU  32  -7.215  -6.965  -0.449
  235    HA   LEU  32           HA       LEU  32  -9.755  -7.992   0.629
  236    HB2  LEU  32           HB2      LEU  32  -8.906  -7.163   2.860
  237    HB3  LEU  32           HB3      LEU  32  -8.117  -8.583   2.207
  238    HG   LEU  32           HG       LEU  32  -6.725  -6.155   1.443
  239   HD11  LEU  32          HD11      LEU  32  -6.077  -6.454   4.199
  240   HD12  LEU  32          HD12      LEU  32  -6.647  -5.020   3.345
  241   HD13  LEU  32          HD13      LEU  32  -7.808  -6.143   4.058
  242   HD21  LEU  32          HD21      LEU  32  -4.826  -7.386   2.066
  243   HD22  LEU  32          HD22      LEU  32  -5.741  -8.402   3.180
  244   HD23  LEU  32          HD23      LEU  32  -5.953  -8.588   1.440
  245    H    VAL  33           HN       VAL  33 -11.315  -6.622   0.220
  246    HA   VAL  33           HA       VAL  33 -10.707  -3.779  -0.082
  247    HB   VAL  33           HB       VAL  33 -13.372  -5.096  -0.582
  248   HG11  VAL  33          HG11      VAL  33 -12.198  -2.676  -1.923
  249   HG12  VAL  33          HG12      VAL  33 -13.880  -3.205  -1.887
  250   HG13  VAL  33          HG13      VAL  33 -13.124  -2.573  -0.424
  251   HG21  VAL  33          HG21      VAL  33 -10.977  -4.942  -2.390
  252   HG22  VAL  33          HG22      VAL  33 -11.949  -6.352  -1.967
  253   HG23  VAL  33          HG23      VAL  33 -12.619  -5.102  -3.015
  254    H    SER  34           HN       SER  34 -11.381  -2.256   1.319
  255    HA   SER  34           HA       SER  34 -12.840  -3.150   3.690
  256    HB2  SER  34           HB2      SER  34 -11.856  -0.394   3.677
  257    HB3  SER  34           HB3      SER  34 -11.586  -1.680   4.854
  258    HG   SER  34           HG       SER  34  -9.638  -1.641   4.050
  259    H    TYR  35           HN       TYR  35 -14.938  -3.154   3.081
  260    HA   TYR  35           HA       TYR  35 -16.165  -1.274   1.430
  261    HB2  TYR  35           HB2      TYR  35 -17.915  -2.651   1.570
  262    HB3  TYR  35           HB3      TYR  35 -16.880  -3.674   2.538
  263    HD1  TYR  35           HD1      TYR  35 -19.410  -0.946   2.842
  264    HD2  TYR  35           HD2      TYR  35 -17.532  -4.290   4.684
  265    HE1  TYR  35           HE1      TYR  35 -21.022  -0.825   4.690
  266    HE2  TYR  35           HE2      TYR  35 -19.140  -4.175   6.539
  267    HH   TYR  35           HH       TYR  35 -21.386  -1.500   6.853
  268    HA   PRO  36           HA       PRO  36 -17.661   1.082   5.366
  269    HB2  PRO  36           HB2      PRO  36 -15.630   0.597   7.412
  270    HB3  PRO  36           HB3      PRO  36 -17.385   0.448   7.528
  271    HG2  PRO  36           HG2      PRO  36 -15.761  -1.699   7.570
  272    HG3  PRO  36           HG3      PRO  36 -17.377  -1.749   6.841
  273    HD2  PRO  36           HD2      PRO  36 -14.704  -1.458   5.508
  274    HD3  PRO  36           HD3      PRO  36 -16.087  -2.477   5.047
  275    H    LYS  37           HN       LYS  37 -14.560   0.757   4.125
  276    HA   LYS  37           HA       LYS  37 -13.715   3.438   4.956
  277    HB2  LYS  37           HB2      LYS  37 -12.335   0.965   4.059
  278    HB3  LYS  37           HB3      LYS  37 -11.611   2.495   3.587
  279    HG2  LYS  37           HG2      LYS  37 -12.374   2.363   6.403
  280    HG3  LYS  37           HG3      LYS  37 -11.145   1.188   5.924
  281    HD2  LYS  37           HD2      LYS  37 -10.231   3.406   4.681
  282    HD3  LYS  37           HD3      LYS  37 -10.999   4.120   6.101
  283    HE2  LYS  37           HE2      LYS  37  -9.297   1.748   6.563
  284    HE3  LYS  37           HE3      LYS  37  -8.469   3.229   6.083
  285    HZ1  LYS  37           HZ1      LYS  37 -10.475   3.474   8.181
  286    HZ2  LYS  37           HZ2      LYS  37  -8.977   4.251   8.013
  287    HZ3  LYS  37           HZ3      LYS  37  -9.048   2.657   8.595
  288    H    GLY  38           HN       GLY  38 -14.625   1.492   2.209
  289    HA2  GLY  38           HA1      GLY  38 -15.261   2.179   0.079
  290    HA3  GLY  38           HA2      GLY  38 -14.809   3.825   0.507
  291    H    THR  39           HN       THR  39 -12.571   1.304   1.143
  292    HA   THR  39           HA       THR  39 -11.000   2.037  -1.227
  293    HB   THR  39           HB       THR  39  -9.225   1.573   0.963
  294    HG1  THR  39           HG1      THR  39 -11.381   3.338   1.465
  295   HG21  THR  39          HG21      THR  39  -9.510   4.341   0.075
  296   HG22  THR  39          HG22      THR  39  -9.363   3.192  -1.256
  297   HG23  THR  39          HG23      THR  39  -8.116   3.265  -0.011
  298    H    ALA  40           HN       ALA  40  -9.311   0.471  -1.726
  299    HA   ALA  40           HA       ALA  40  -9.874  -2.205  -0.623
  300    HB1  ALA  40           HB1      ALA  40  -8.773  -2.399  -3.248
  301    HB2  ALA  40           HB2      ALA  40 -10.342  -2.950  -2.662
  302    HB3  ALA  40           HB3      ALA  40 -10.162  -1.313  -3.290
  303    H    GLN  41           HN       GLN  41  -8.171  -3.327   0.107
  304    HA   GLN  41           HA       GLN  41  -5.488  -2.239  -0.430
  305    HB2  GLN  41           HB2      GLN  41  -6.442  -2.497   1.992
  306    HB3  GLN  41           HB3      GLN  41  -6.078  -4.203   1.764
  307    HG2  GLN  41           HG2      GLN  41  -3.791  -2.805   0.949
  308    HG3  GLN  41           HG3      GLN  41  -4.330  -2.041   2.442
  309   HE21  GLN  41          HE21      GLN  41  -3.526  -5.161   0.996
  310   HE22  GLN  41          HE22      GLN  41  -2.987  -5.904   2.466
  311    H    LEU  42           HN       LEU  42  -5.511  -3.317  -2.471
  312    HA   LEU  42           HA       LEU  42  -5.544  -6.225  -2.337
  313    HB2  LEU  42           HB2      LEU  42  -5.859  -6.260  -4.724
  314    HB3  LEU  42           HB3      LEU  42  -7.059  -5.246  -3.969
  315    HG   LEU  42           HG       LEU  42  -6.581  -4.083  -5.892
  316   HD11  LEU  42          HD11      LEU  42  -5.537  -2.066  -5.368
  317   HD12  LEU  42          HD12      LEU  42  -6.177  -2.666  -3.839
  318   HD13  LEU  42          HD13      LEU  42  -4.456  -2.823  -4.198
  319   HD21  LEU  42          HD21      LEU  42  -4.697  -4.154  -7.144
  320   HD22  LEU  42          HD22      LEU  42  -3.626  -4.238  -5.744
  321   HD23  LEU  42          HD23      LEU  42  -4.521  -5.669  -6.258
  322    H    ALA  43           HN       ALA  43  -3.771  -7.325  -2.275
  323    HA   ALA  43           HA       ALA  43  -1.241  -6.107  -3.072
  324    HB1  ALA  43           HB1      ALA  43  -0.300  -7.456  -1.553
  325    HB2  ALA  43           HB2      ALA  43  -1.941  -7.849  -1.036
  326    HB3  ALA  43           HB3      ALA  43  -1.112  -8.880  -2.204
  327    H    ILE  44           HN       ILE  44  -0.147  -6.664  -4.878
  328    HA   ILE  44           HA       ILE  44  -1.209  -8.884  -6.484
  329    HB   ILE  44           HB       ILE  44  -0.680  -7.390  -8.528
  330   HG12  ILE  44          HG12      ILE  44  -1.465  -5.121  -6.743
  331   HG13  ILE  44          HG13      ILE  44   0.231  -5.591  -6.818
  332   HG21  ILE  44          HG21      ILE  44  -3.051  -7.621  -6.861
  333   HG22  ILE  44          HG22      ILE  44  -3.061  -6.180  -7.878
  334   HG23  ILE  44          HG23      ILE  44  -2.871  -7.774  -8.608
  335   HD11  ILE  44          HD11      ILE  44  -0.321  -5.446  -9.441
  336   HD12  ILE  44          HD12      ILE  44  -1.458  -4.250  -8.820
  337   HD13  ILE  44          HD13      ILE  44   0.264  -4.083  -8.487
  338    H    VAL  45           HN       VAL  45   0.247  -9.595  -8.173
  339    HA   VAL  45           HA       VAL  45   2.950  -9.785  -7.258
  340    HB   VAL  45           HB       VAL  45   1.327 -11.378  -8.787
  341   HG11  VAL  45          HG11      VAL  45   3.433 -10.587 -10.749
  342   HG12  VAL  45          HG12      VAL  45   1.930 -11.473 -11.009
  343   HG13  VAL  45          HG13      VAL  45   1.889  -9.736 -10.709
  344   HG21  VAL  45          HG21      VAL  45   4.311 -11.390  -8.461
  345   HG22  VAL  45          HG22      VAL  45   3.103 -12.292  -7.547
  346   HG23  VAL  45          HG23      VAL  45   3.431 -12.711  -9.229
  347    HA   PRO  46           HA       PRO  46   4.699  -6.329  -9.471
  348    HB2  PRO  46           HB2      PRO  46   7.102  -7.966  -9.942
  349    HB3  PRO  46           HB3      PRO  46   6.926  -6.470  -9.020
  350    HG2  PRO  46           HG2      PRO  46   7.336  -8.821  -7.800
  351    HG3  PRO  46           HG3      PRO  46   6.287  -7.578  -7.094
  352    HD2  PRO  46           HD2      PRO  46   5.531 -10.056  -8.604
  353    HD3  PRO  46           HD3      PRO  46   4.809  -9.372  -7.131
  354    H    GLY  47           HN       GLY  47   3.020  -7.341 -11.127
  355    HA2  GLY  47           HA1      GLY  47   4.401  -7.310 -13.685
  356    HA3  GLY  47           HA2      GLY  47   3.468  -8.764 -13.341
  357    H    THR  48           HN       THR  48   1.410  -7.509 -11.863
  358    HA   THR  48           HA       THR  48  -0.253  -6.436 -13.914
  359    HB   THR  48           HB       THR  48  -1.307  -5.912 -11.313
  360    HG1  THR  48           HG1      THR  48  -0.462  -7.479 -10.185
  361   HG21  THR  48          HG21      THR  48  -1.969  -7.412 -13.724
  362   HG22  THR  48          HG22      THR  48  -3.023  -6.532 -12.615
  363   HG23  THR  48          HG23      THR  48  -2.546  -8.190 -12.251
  364    H    SER  49           HN       SER  49  -1.520  -4.374 -13.418
  365    HA   SER  49           HA       SER  49   0.244  -2.365 -12.284
  366    HB2  SER  49           HB2      SER  49  -1.068  -1.033 -14.329
  367    HB3  SER  49           HB3      SER  49   0.606  -1.590 -14.367
  368    HG   SER  49           HG       SER  49  -0.839  -2.284 -16.135
  369    HA   PRO  50           HA       PRO  50  -3.402  -1.399 -10.029
  370    HB2  PRO  50           HB2      PRO  50  -2.280   1.273  -9.558
  371    HB3  PRO  50           HB3      PRO  50  -2.632  -0.012  -8.398
  372    HG2  PRO  50           HG2      PRO  50  -0.107   0.660  -9.064
  373    HG3  PRO  50           HG3      PRO  50  -0.572  -1.005  -8.671
  374    HD2  PRO  50           HD2      PRO  50  -0.108   0.251 -11.349
  375    HD3  PRO  50           HD3      PRO  50   0.351  -1.364 -10.767
  376    H    ASP  51           HN       ASP  51  -2.244   0.772 -12.504
  377    HA   ASP  51           HA       ASP  51  -4.631   2.311 -12.643
  378    HB2  ASP  51           HB2      ASP  51  -3.639   3.329 -14.525
  379    HB3  ASP  51           HB3      ASP  51  -2.288   2.960 -13.472
  380    H    ALA  52           HN       ALA  52  -3.577  -0.745 -13.712
  381    HA   ALA  52           HA       ALA  52  -5.399  -0.944 -15.932
  382    HB1  ALA  52           HB1      ALA  52  -3.120  -2.247 -15.402
  383    HB2  ALA  52           HB2      ALA  52  -4.276  -3.413 -14.760
  384    HB3  ALA  52           HB3      ALA  52  -4.382  -2.905 -16.444
  385    H    LEU  53           HN       LEU  53  -5.253  -1.940 -12.597
  386    HA   LEU  53           HA       LEU  53  -7.692  -3.414 -12.614
  387    HB2  LEU  53           HB2      LEU  53  -6.400  -2.113 -10.226
  388    HB3  LEU  53           HB3      LEU  53  -7.445  -3.519 -10.248
  389    HG   LEU  53           HG       LEU  53  -4.853  -3.657 -11.716
  390   HD11  LEU  53          HD11      LEU  53  -4.514  -2.663  -9.381
  391   HD12  LEU  53          HD12      LEU  53  -4.983  -4.256  -8.787
  392   HD13  LEU  53          HD13      LEU  53  -3.569  -4.084  -9.826
  393   HD21  LEU  53          HD21      LEU  53  -5.050  -5.946 -11.391
  394   HD22  LEU  53          HD22      LEU  53  -6.112  -5.755  -9.996
  395   HD23  LEU  53          HD23      LEU  53  -6.724  -5.438 -11.619
  396    H    THR  54           HN       THR  54  -6.747  -0.130 -11.717
  397    HA   THR  54           HA       THR  54  -9.227   0.841 -10.911
  398    HB   THR  54           HB       THR  54  -7.049   2.324 -12.400
  399    HG1  THR  54           HG1      THR  54  -6.173   1.531 -10.522
  400   HG21  THR  54          HG21      THR  54  -9.572   3.178 -11.126
  401   HG22  THR  54          HG22      THR  54  -8.659   3.919 -12.440
  402   HG23  THR  54          HG23      THR  54  -8.150   4.158 -10.769
  403    H    ALA  55           HN       ALA  55  -7.764   0.801 -14.161
  404    HA   ALA  55           HA       ALA  55 -10.006   1.905 -15.485
  405    HB1  ALA  55           HB1      ALA  55  -7.449   0.750 -16.238
  406    HB2  ALA  55           HB2      ALA  55  -8.734   0.331 -17.370
  407    HB3  ALA  55           HB3      ALA  55  -8.387   2.024 -17.017
  408    H    ALA  56           HN       ALA  56  -9.084  -1.387 -14.655
  409    HA   ALA  56           HA       ALA  56 -11.041  -2.742 -16.144
  410    HB1  ALA  56           HB1      ALA  56 -10.426  -4.628 -15.012
  411    HB2  ALA  56           HB2      ALA  56  -9.029  -3.611 -14.661
  412    HB3  ALA  56           HB3      ALA  56 -10.310  -3.793 -13.462
  413    H    VAL  57           HN       VAL  57 -11.152  -1.530 -12.794
  414    HA   VAL  57           HA       VAL  57 -13.833  -2.332 -12.341
  415    HB   VAL  57           HB       VAL  57 -12.260  -0.172 -10.957
  416   HG11  VAL  57          HG11      VAL  57 -14.219   0.343 -10.012
  417   HG12  VAL  57          HG12      VAL  57 -14.996  -1.112 -10.635
  418   HG13  VAL  57          HG13      VAL  57 -14.058  -1.183  -9.143
  419   HG21  VAL  57          HG21      VAL  57 -11.473  -2.665 -10.989
  420   HG22  VAL  57          HG22      VAL  57 -11.454  -1.743  -9.486
  421   HG23  VAL  57          HG23      VAL  57 -12.768  -2.874  -9.808
  422    H    ALA  58           HN       ALA  58 -12.372   0.720 -13.409
  423    HA   ALA  58           HA       ALA  58 -14.770   2.206 -13.511
  424    HB1  ALA  58           HB1      ALA  58 -12.218   2.886 -13.734
  425    HB2  ALA  58           HB2      ALA  58 -12.606   2.801 -15.452
  426    HB3  ALA  58           HB3      ALA  58 -13.512   3.885 -14.396
  427    H    GLY  59           HN       GLY  59 -13.287  -0.034 -15.727
  428    HA2  GLY  59           HA1      GLY  59 -15.148   0.638 -17.867
  429    HA3  GLY  59           HA2      GLY  59 -13.846  -0.543 -17.947
  430    H    LEU  60           HN       LEU  60 -15.544  -0.982 -15.119
  431    HA   LEU  60           HA       LEU  60 -17.081  -3.168 -16.307
  432    HB2  LEU  60           HB2      LEU  60 -15.622  -2.805 -13.844
  433    HB3  LEU  60           HB3      LEU  60 -17.254  -3.362 -13.533
  434    HG   LEU  60           HG       LEU  60 -15.523  -4.759 -15.539
  435   HD11  LEU  60          HD11      LEU  60 -15.157  -6.344 -13.467
  436   HD12  LEU  60          HD12      LEU  60 -14.067  -4.997 -13.800
  437   HD13  LEU  60          HD13      LEU  60 -15.324  -4.831 -12.576
  438   HD21  LEU  60          HD21      LEU  60 -16.975  -6.563 -15.220
  439   HD22  LEU  60          HD22      LEU  60 -17.608  -5.906 -13.711
  440   HD23  LEU  60          HD23      LEU  60 -18.030  -5.150 -15.250
  441    H    GLY  61           HN       GLY  61 -17.651  -0.142 -15.882
  442    HA2  GLY  61           HA1      GLY  61 -19.801   0.846 -15.989
  443    HA3  GLY  61           HA2      GLY  61 -20.456  -0.555 -15.153
  444    H    TYR  62           HN       TYR  62 -17.817   0.020 -13.453
  445    HA   TYR  62           HA       TYR  62 -19.205   1.793 -11.573
  446    HB2  TYR  62           HB2      TYR  62 -16.795   0.125 -10.886
  447    HB3  TYR  62           HB3      TYR  62 -18.053   0.734  -9.822
  448    HD1  TYR  62           HD2      TYR  62 -20.527  -0.188 -10.772
  449    HD2  TYR  62           HD1      TYR  62 -16.766  -2.166 -10.991
  450    HE1  TYR  62           HE2      TYR  62 -21.679  -2.359 -10.888
  451    HE2  TYR  62           HE1      TYR  62 -17.908  -4.341 -11.104
  452    HH   TYR  62           HH       TYR  62 -21.415  -4.572 -11.375
  453    H    LYS  63           HN       LYS  63 -17.046   2.610 -10.048
  454    HA   LYS  63           HA       LYS  63 -15.145   3.781 -11.940
  455    HB2  LYS  63           HB2      LYS  63 -17.113   5.343 -11.082
  456    HB3  LYS  63           HB3      LYS  63 -16.083   5.468  -9.662
  457    HG2  LYS  63           HG2      LYS  63 -14.785   5.892 -12.286
  458    HG3  LYS  63           HG3      LYS  63 -15.914   7.134 -11.737
  459    HD2  LYS  63           HD2      LYS  63 -14.668   7.436  -9.702
  460    HD3  LYS  63           HD3      LYS  63 -13.612   6.079 -10.098
  461    HE2  LYS  63           HE2      LYS  63 -13.840   8.449 -11.919
  462    HE3  LYS  63           HE3      LYS  63 -12.763   8.477 -10.525
  463    HZ1  LYS  63           HZ1      LYS  63 -11.582   7.786 -12.499
  464    HZ2  LYS  63           HZ2      LYS  63 -12.680   6.525 -12.762
  465    HZ3  LYS  63           HZ3      LYS  63 -11.661   6.492 -11.405
  466    H    ALA  64           HN       ALA  64 -13.104   3.580 -11.281
  467    HA   ALA  64           HA       ALA  64 -12.660   3.090  -8.416
  468    HB1  ALA  64           HB1      ALA  64 -12.201   1.143  -9.941
  469    HB2  ALA  64           HB2      ALA  64 -10.887   2.094 -10.632
  470    HB3  ALA  64           HB3      ALA  64 -10.849   1.647  -8.926
  471    H    THR  65           HN       THR  65 -10.832   4.013  -7.482
  472    HA   THR  65           HA       THR  65  -9.222   5.814  -9.146
  473    HB   THR  65           HB       THR  65  -9.435   6.875  -6.472
  474    HG1  THR  65           HG1      THR  65 -11.811   6.071  -7.657
  475   HG21  THR  65          HG21      THR  65  -9.938   7.852  -9.263
  476   HG22  THR  65          HG22      THR  65  -8.659   8.310  -8.139
  477   HG23  THR  65          HG23      THR  65 -10.311   8.868  -7.871
  478    H    LEU  66           HN       LEU  66  -7.462   6.635  -7.112
  479    HA   LEU  66           HA       LEU  66  -6.605   4.254  -5.723
  480    HB2  LEU  66           HB2      LEU  66  -5.137   3.573  -7.245
  481    HB3  LEU  66           HB3      LEU  66  -5.548   4.920  -8.286
  482    HG   LEU  66           HG       LEU  66  -3.854   6.110  -6.499
  483   HD11  LEU  66          HD11      LEU  66  -2.271   3.725  -7.146
  484   HD12  LEU  66          HD12      LEU  66  -2.269   4.735  -5.699
  485   HD13  LEU  66          HD13      LEU  66  -3.499   3.487  -5.904
  486   HD21  LEU  66          HD21      LEU  66  -2.135   5.711  -8.372
  487   HD22  LEU  66          HD22      LEU  66  -3.447   4.868  -9.196
  488   HD23  LEU  66          HD23      LEU  66  -3.624   6.570  -8.769
  489    H    ALA  67           HN       ALA  67  -5.909   4.795  -3.847
  490    HA   ALA  67           HA       ALA  67  -4.213   7.059  -3.354
  491    HB1  ALA  67           HB1      ALA  67  -6.349   7.371  -1.481
  492    HB2  ALA  67           HB2      ALA  67  -5.714   8.544  -2.636
  493    HB3  ALA  67           HB3      ALA  67  -7.009   7.446  -3.116
  494    H    ASP  68           HN       ASP  68  -2.802   6.336  -1.876
  495    HA   ASP  68           HA       ASP  68  -3.307   3.808  -0.662
  496    HB2  ASP  68           HB2      ASP  68  -1.102   4.415  -1.649
  497    HB3  ASP  68           HB3      ASP  68  -0.874   5.552  -0.321
  498    H    ALA  69           HN       ALA  69  -4.914   4.180   0.858
  499    HA   ALA  69           HA       ALA  69  -3.857   5.306   3.354
  500    HB1  ALA  69           HB1      ALA  69  -6.629   5.556   3.527
  501    HB2  ALA  69           HB2      ALA  69  -5.458   6.860   3.329
  502    HB3  ALA  69           HB3      ALA  69  -6.222   6.138   1.912
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1   2.137  -1.143   1.236
    2    H2   MET   1           H2       MET   1   1.353   0.228   0.621
    3    H3   MET   1           H3       MET   1   1.898  -0.980  -0.435
    4    HA   MET   1           HA       MET   1   0.328  -2.533   0.356
    5    HB2  MET   1           HB2      MET   1  -1.419  -1.623   2.047
    6    HB3  MET   1           HB3      MET   1   0.137  -2.170   2.653
    7    HG2  MET   1           HG2      MET   1   0.756  -0.109   3.317
    8    HG3  MET   1           HG3      MET   1  -0.044   0.687   1.962
    9    HE1  MET   1           HE1      MET   1  -0.050   1.989   4.804
   10    HE2  MET   1           HE2      MET   1  -0.915   2.670   3.427
   11    HE3  MET   1           HE3      MET   1  -1.740   2.465   4.971
   12    H    THR   2           HN       THR   2  -0.208  -2.140  -1.781
   13    HA   THR   2           HA       THR   2  -1.282   0.127  -2.904
   14    HB   THR   2           HB       THR   2  -2.473  -2.044  -4.244
   15    HG1  THR   2           HG1      THR   2  -1.339  -3.637  -3.343
   16   HG21  THR   2          HG21      THR   2  -0.710   0.053  -4.759
   17   HG22  THR   2          HG22      THR   2  -1.378  -1.077  -5.938
   18   HG23  THR   2          HG23      THR   2   0.187  -1.402  -5.191
   19    H    HIS   3           HN       HIS   3  -3.058   1.210  -2.339
   20    HA   HIS   3           HA       HIS   3  -5.505  -0.349  -1.911
   21    HB2  HIS   3           HB2      HIS   3  -6.162   1.940  -0.613
   22    HB3  HIS   3           HB3      HIS   3  -5.605   0.479   0.168
   23    HD1  HIS   3           HD1      HIS   3  -5.011   2.231   2.088
   24    HD2  HIS   3           HD2      HIS   3  -2.646   2.423  -1.329
   25    HE1  HIS   3           HE1      HIS   3  -2.960   3.525   2.750
   26    HE2  HIS   3           HE2      HIS   3  -1.450   3.425   0.744
   27    H    LEU   4           HN       LEU   4  -6.910  -0.064  -3.401
   28    HA   LEU   4           HA       LEU   4  -6.834   2.308  -5.110
   29    HB2  LEU   4           HB2      LEU   4  -7.588  -0.490  -5.417
   30    HB3  LEU   4           HB3      LEU   4  -8.823   0.590  -6.029
   31    HG   LEU   4           HG       LEU   4  -7.076   1.680  -7.453
   32   HD11  LEU   4          HD11      LEU   4  -5.343  -0.703  -6.982
   33   HD12  LEU   4          HD12      LEU   4  -4.921   0.886  -7.622
   34   HD13  LEU   4          HD13      LEU   4  -5.224   0.681  -5.896
   35   HD21  LEU   4          HD21      LEU   4  -8.501   0.147  -8.530
   36   HD22  LEU   4          HD22      LEU   4  -6.869  -0.326  -9.000
   37   HD23  LEU   4          HD23      LEU   4  -7.729  -1.238  -7.758
   38    H    LYS   5           HN       LYS   5  -8.979   3.263  -5.708
   39    HA   LYS   5           HA       LYS   5 -10.669   3.398  -3.303
   40    HB2  LYS   5           HB2      LYS   5  -9.505   5.411  -4.849
   41    HB3  LYS   5           HB3      LYS   5 -11.208   5.454  -5.260
   42    HG2  LYS   5           HG2      LYS   5 -10.678   5.260  -2.390
   43    HG3  LYS   5           HG3      LYS   5 -10.055   6.726  -3.145
   44    HD2  LYS   5           HD2      LYS   5 -12.881   5.756  -2.941
   45    HD3  LYS   5           HD3      LYS   5 -12.210   7.326  -2.499
   46    HE2  LYS   5           HE2      LYS   5 -11.839   6.765  -5.312
   47    HE3  LYS   5           HE3      LYS   5 -13.538   6.663  -4.857
   48    HZ1  LYS   5           HZ1      LYS   5 -13.535   8.873  -4.119
   49    HZ2  LYS   5           HZ2      LYS   5 -12.684   8.909  -5.578
   50    HZ3  LYS   5           HZ3      LYS   5 -11.845   8.976  -4.104
   51    H    ILE   6           HN       ILE   6 -12.720   2.805  -3.381
   52    HA   ILE   6           HA       ILE   6 -13.771   1.893  -5.981
   53    HB   ILE   6           HB       ILE   6 -14.508   0.906  -3.223
   54   HG12  ILE   6          HG12      ILE   6 -12.247   0.216  -3.717
   55   HG13  ILE   6          HG13      ILE   6 -13.307  -1.176  -3.898
   56   HG21  ILE   6          HG21      ILE   6 -15.124  -0.630  -5.684
   57   HG22  ILE   6          HG22      ILE   6 -16.016  -0.512  -4.167
   58   HG23  ILE   6          HG23      ILE   6 -16.102   0.797  -5.347
   59   HD11  ILE   6          HD11      ILE   6 -12.267  -1.489  -5.840
   60   HD12  ILE   6          HD12      ILE   6 -13.243  -0.145  -6.432
   61   HD13  ILE   6          HD13      ILE   6 -11.604   0.147  -5.851
   62    H    THR   7           HN       THR   7 -15.209   3.330  -6.756
   63    HA   THR   7           HA       THR   7 -17.133   4.504  -4.877
   64    HB   THR   7           HB       THR   7 -16.681   6.463  -6.822
   65    HG1  THR   7           HG1      THR   7 -14.625   5.159  -7.089
   66   HG21  THR   7          HG21      THR   7 -15.815   6.204  -3.949
   67   HG22  THR   7          HG22      THR   7 -17.242   7.025  -4.579
   68   HG23  THR   7          HG23      THR   7 -15.637   7.693  -4.879
   69    H    GLY   8           HN       GLY   8 -18.846   5.775  -6.257
   70    HA2  GLY   8           HA1      GLY   8 -20.245   5.859  -8.145
   71    HA3  GLY   8           HA2      GLY   8 -19.392   4.474  -8.813
   72    H    MET   9           HN       MET   9 -19.565   2.731  -6.647
   73    HA   MET   9           HA       MET   9 -22.343   1.928  -6.885
   74    HB2  MET   9           HB2      MET   9 -19.826   0.620  -5.961
   75    HB3  MET   9           HB3      MET   9 -21.361  -0.030  -5.406
   76    HG2  MET   9           HG2      MET   9 -22.027  -0.612  -7.557
   77    HG3  MET   9           HG3      MET   9 -20.845   0.455  -8.314
   78    HE1  MET   9           HE1      MET   9 -17.901  -1.250  -6.297
   79    HE2  MET   9           HE2      MET   9 -17.621  -0.862  -7.994
   80    HE3  MET   9           HE3      MET   9 -18.510   0.263  -6.968
   81    H    THR  10           HN       THR  10 -20.876   0.881  -3.995
   82    HA   THR  10           HA       THR  10 -21.871   3.005  -2.327
   83    HB   THR  10           HB       THR  10 -23.038   0.320  -1.733
   84    HG1  THR  10           HG1      THR  10 -23.844   2.087  -3.769
   85   HG21  THR  10          HG21      THR  10 -23.486   1.736   0.021
   86   HG22  THR  10          HG22      THR  10 -24.904   2.029  -0.987
   87   HG23  THR  10          HG23      THR  10 -23.553   3.162  -1.013
   88    H    CYS  11           HN       CYS  11 -21.519  -0.460  -1.565
   89    HA   CYS  11           HA       CYS  11 -18.976  -0.032  -0.274
   90    HB2  CYS  11           HB2      CYS  11 -20.049  -0.913   1.928
   91    HB3  CYS  11           HB3      CYS  11 -20.031   0.798   1.551
   92    HG   CYS  11           HG       CYS  11 -22.655  -1.321   1.735
   93    H    ASP  12           HN       ASP  12 -20.001  -2.287   1.618
   94    HA   ASP  12           HA       ASP  12 -18.418  -4.270   0.734
   95    HB2  ASP  12           HB2      ASP  12 -19.716  -5.838   2.149
   96    HB3  ASP  12           HB3      ASP  12 -19.336  -4.317   2.946
   97    H    SER  13           HN       SER  13 -21.943  -4.265   0.035
   98    HA   SER  13           HA       SER  13 -21.871  -6.764  -1.273
   99    HB2  SER  13           HB2      SER  13 -23.945  -4.710  -1.953
  100    HB3  SER  13           HB3      SER  13 -24.132  -6.445  -1.691
  101    HG   SER  13           HG       SER  13 -23.269  -5.556   0.589
  102    H    CYS  14           HN       CYS  14 -21.327  -3.518  -2.355
  103    HA   CYS  14           HA       CYS  14 -21.310  -4.162  -5.162
  104    HB2  CYS  14           HB2      CYS  14 -20.149  -1.739  -3.788
  105    HB3  CYS  14           HB3      CYS  14 -20.662  -1.869  -5.465
  106    HG   CYS  14           HG       CYS  14 -23.369  -2.574  -4.113
  107    H    ALA  15           HN       ALA  15 -18.950  -3.547  -2.627
  108    HA   ALA  15           HA       ALA  15 -16.629  -3.628  -4.200
  109    HB1  ALA  15           HB1      ALA  15 -17.159  -4.034  -1.278
  110    HB2  ALA  15           HB2      ALA  15 -15.536  -4.184  -1.952
  111    HB3  ALA  15           HB3      ALA  15 -16.411  -2.661  -2.094
  112    H    ALA  16           HN       ALA  16 -18.635  -6.175  -2.981
  113    HA   ALA  16           HA       ALA  16 -16.837  -8.308  -2.909
  114    HB1  ALA  16           HB1      ALA  16 -19.778  -8.184  -3.523
  115    HB2  ALA  16           HB2      ALA  16 -18.890  -9.705  -3.435
  116    HB3  ALA  16           HB3      ALA  16 -18.991  -8.660  -2.019
  117    H    HIS  17           HN       HIS  17 -18.804  -7.084  -5.598
  118    HA   HIS  17           HA       HIS  17 -17.965  -8.954  -7.520
  119    HB2  HIS  17           HB2      HIS  17 -19.881  -7.149  -7.584
  120    HB3  HIS  17           HB3      HIS  17 -18.628  -6.148  -8.314
  121    HD1  HIS  17           HD1      HIS  17 -19.471  -6.080 -10.692
  122    HD2  HIS  17           HD2      HIS  17 -19.170  -9.949  -9.189
  123    HE1  HIS  17           HE1      HIS  17 -19.843  -7.610 -12.657
  124    HE2  HIS  17           HE2      HIS  17 -19.511  -9.942 -11.749
  125    H    VAL  18           HN       VAL  18 -16.711  -5.803  -6.583
  126    HA   VAL  18           HA       VAL  18 -14.714  -5.608  -8.573
  127    HB   VAL  18           HB       VAL  18 -14.727  -4.371  -5.813
  128   HG11  VAL  18          HG11      VAL  18 -13.102  -2.872  -6.547
  129   HG12  VAL  18          HG12      VAL  18 -12.563  -4.419  -7.202
  130   HG13  VAL  18          HG13      VAL  18 -13.380  -3.255  -8.246
  131   HG21  VAL  18          HG21      VAL  18 -15.645  -3.091  -8.372
  132   HG22  VAL  18          HG22      VAL  18 -16.744  -3.937  -7.283
  133   HG23  VAL  18          HG23      VAL  18 -15.864  -2.516  -6.719
  134    H    LYS  19           HN       LYS  19 -14.677  -6.822  -5.245
  135    HA   LYS  19           HA       LYS  19 -11.947  -7.419  -5.083
  136    HB2  LYS  19           HB2      LYS  19 -13.472  -7.383  -3.142
  137    HB3  LYS  19           HB3      LYS  19 -14.256  -8.838  -3.739
  138    HG2  LYS  19           HG2      LYS  19 -11.445  -9.299  -3.564
  139    HG3  LYS  19           HG3      LYS  19 -12.024  -8.632  -2.036
  140    HD2  LYS  19           HD2      LYS  19 -13.970 -10.429  -2.547
  141    HD3  LYS  19           HD3      LYS  19 -12.596 -11.227  -3.316
  142    HE2  LYS  19           HE2      LYS  19 -12.446 -10.137  -0.521
  143    HE3  LYS  19           HE3      LYS  19 -13.048 -11.760  -0.858
  144    HZ1  LYS  19           HZ1      LYS  19 -10.818 -11.935  -2.185
  145    HZ2  LYS  19           HZ2      LYS  19 -10.842 -12.168  -0.502
  146    HZ3  LYS  19           HZ3      LYS  19 -10.331 -10.686  -1.145
  147    H    GLU  20           HN       GLU  20 -14.684  -9.456  -6.065
  148    HA   GLU  20           HA       GLU  20 -13.130 -11.748  -6.593
  149    HB2  GLU  20           HB2      GLU  20 -15.632 -11.654  -6.276
  150    HB3  GLU  20           HB3      GLU  20 -15.745 -11.013  -7.909
  151    HG2  GLU  20           HG2      GLU  20 -14.185 -13.310  -8.136
  152    HG3  GLU  20           HG3      GLU  20 -15.483 -13.733  -7.020
  153    H    ALA  21           HN       ALA  21 -14.128  -9.038  -8.607
  154    HA   ALA  21           HA       ALA  21 -13.207 -10.077 -11.068
  155    HB1  ALA  21           HB1      ALA  21 -13.503  -7.908 -11.959
  156    HB2  ALA  21           HB2      ALA  21 -14.746  -8.077 -10.718
  157    HB3  ALA  21           HB3      ALA  21 -13.285  -7.147 -10.382
  158    H    LEU  22           HN       LEU  22 -11.709  -8.254  -8.485
  159    HA   LEU  22           HA       LEU  22  -9.228  -7.771  -9.763
  160    HB2  LEU  22           HB2      LEU  22 -10.215  -7.728  -6.947
  161    HB3  LEU  22           HB3      LEU  22  -8.484  -7.720  -7.225
  162    HG   LEU  22           HG       LEU  22 -10.262  -5.706  -8.565
  163   HD11  LEU  22          HD11      LEU  22 -10.582  -5.762  -6.038
  164   HD12  LEU  22          HD12      LEU  22  -8.904  -5.229  -5.932
  165   HD13  LEU  22          HD13      LEU  22 -10.098  -4.225  -6.755
  166   HD21  LEU  22          HD21      LEU  22  -7.345  -5.828  -7.829
  167   HD22  LEU  22          HD22      LEU  22  -8.048  -5.818  -9.445
  168   HD23  LEU  22          HD23      LEU  22  -8.143  -4.377  -8.431
  169    H    GLU  23           HN       GLU  23 -10.302 -10.272  -7.478
  170    HA   GLU  23           HA       GLU  23  -7.757 -11.580  -7.525
  171    HB2  GLU  23           HB2      GLU  23 -10.355 -12.001  -6.172
  172    HB3  GLU  23           HB3      GLU  23  -9.324 -13.416  -6.369
  173    HG2  GLU  23           HG2      GLU  23  -7.605 -12.488  -5.106
  174    HG3  GLU  23           HG3      GLU  23  -8.247 -10.859  -5.251
  175    H    LYS  24           HN       LYS  24 -10.360 -11.587  -9.643
  176    HA   LYS  24           HA       LYS  24  -9.928 -14.209 -10.726
  177    HB2  LYS  24           HB2      LYS  24 -11.636 -11.931 -11.280
  178    HB3  LYS  24           HB3      LYS  24 -10.957 -12.587 -12.761
  179    HG2  LYS  24           HG2      LYS  24 -12.065 -14.574 -12.562
  180    HG3  LYS  24           HG3      LYS  24 -12.149 -14.475 -10.802
  181    HD2  LYS  24           HD2      LYS  24 -14.335 -14.031 -11.317
  182    HD3  LYS  24           HD3      LYS  24 -13.684 -12.390 -11.338
  183    HE2  LYS  24           HE2      LYS  24 -13.295 -13.534 -13.910
  184    HE3  LYS  24           HE3      LYS  24 -14.966 -13.825 -13.432
  185    HZ1  LYS  24           HZ1      LYS  24 -15.204 -11.455 -12.985
  186    HZ2  LYS  24           HZ2      LYS  24 -14.744 -11.731 -14.595
  187    HZ3  LYS  24           HZ3      LYS  24 -13.601 -11.189 -13.469
  188    H    VAL  25           HN       VAL  25  -8.344 -11.189 -10.882
  189    HA   VAL  25           HA       VAL  25  -6.910 -11.753 -13.339
  190    HB   VAL  25           HB       VAL  25  -6.671  -9.536 -11.299
  191   HG11  VAL  25          HG11      VAL  25  -5.349  -8.563 -13.428
  192   HG12  VAL  25          HG12      VAL  25  -4.556  -9.377 -12.078
  193   HG13  VAL  25          HG13      VAL  25  -4.918 -10.269 -13.556
  194   HG21  VAL  25          HG21      VAL  25  -8.125  -9.884 -13.846
  195   HG22  VAL  25          HG22      VAL  25  -8.529  -8.921 -12.425
  196   HG23  VAL  25          HG23      VAL  25  -7.350  -8.320 -13.590
  197    HA   PRO  26           HA       PRO  26  -4.002 -14.371 -11.241
  198    HB2  PRO  26           HB2      PRO  26  -2.066 -14.358 -13.188
  199    HB3  PRO  26           HB3      PRO  26  -3.515 -15.365 -13.234
  200    HG2  PRO  26           HG2      PRO  26  -2.979 -12.754 -14.587
  201    HG3  PRO  26           HG3      PRO  26  -3.786 -14.199 -15.222
  202    HD2  PRO  26           HD2      PRO  26  -5.180 -12.057 -14.394
  203    HD3  PRO  26           HD3      PRO  26  -5.780 -13.709 -14.143
  204    H    GLY  27           HN       GLY  27  -3.297 -11.136 -12.232
  205    HA2  GLY  27           HA1      GLY  27  -0.648 -11.054 -11.108
  206    HA3  GLY  27           HA2      GLY  27  -1.585  -9.676 -11.658
  207    H    VAL  28           HN       VAL  28  -3.795 -10.903  -9.823
  208    HA   VAL  28           HA       VAL  28  -2.936  -9.422  -7.452
  209    HB   VAL  28           HB       VAL  28  -5.658 -10.493  -8.227
  210   HG11  VAL  28          HG11      VAL  28  -5.391 -10.384  -5.800
  211   HG12  VAL  28          HG12      VAL  28  -4.870  -8.703  -5.926
  212   HG13  VAL  28          HG13      VAL  28  -6.518  -9.152  -6.368
  213   HG21  VAL  28          HG21      VAL  28  -5.213  -7.592  -7.998
  214   HG22  VAL  28          HG22      VAL  28  -4.387  -8.382  -9.342
  215   HG23  VAL  28          HG23      VAL  28  -6.137  -8.513  -9.184
  216    H    GLN  29           HN       GLN  29  -2.305 -10.438  -5.671
  217    HA   GLN  29           HA       GLN  29  -2.495 -13.332  -5.546
  218    HB2  GLN  29           HB2      GLN  29  -0.516 -11.669  -4.821
  219    HB3  GLN  29           HB3      GLN  29  -1.363 -11.781  -3.283
  220    HG2  GLN  29           HG2      GLN  29  -0.904 -14.017  -3.039
  221    HG3  GLN  29           HG3      GLN  29  -0.690 -14.273  -4.768
  222   HE21  GLN  29          HE21      GLN  29   0.905 -14.317  -1.994
  223   HE22  GLN  29          HE22      GLN  29   2.481 -13.792  -2.507
  224    H    SER  30           HN       SER  30  -3.486 -10.529  -3.614
  225    HA   SER  30           HA       SER  30  -5.848 -11.946  -2.717
  226    HB2  SER  30           HB2      SER  30  -4.175 -10.758  -0.528
  227    HB3  SER  30           HB3      SER  30  -5.393 -12.029  -0.435
  228    HG   SER  30           HG       SER  30  -3.744 -13.234  -1.800
  229    H    ALA  31           HN       ALA  31  -7.505 -10.547  -2.494
  230    HA   ALA  31           HA       ALA  31  -6.833  -7.677  -2.318
  231    HB1  ALA  31           HB1      ALA  31  -7.572  -7.882  -4.511
  232    HB2  ALA  31           HB2      ALA  31  -8.797  -9.081  -4.090
  233    HB3  ALA  31           HB3      ALA  31  -9.028  -7.391  -3.644
  234    H    LEU  32           HN       LEU  32  -7.565  -6.787  -0.521
  235    HA   LEU  32           HA       LEU  32 -10.051  -7.834   0.647
  236    HB2  LEU  32           HB2      LEU  32  -8.783  -8.263   2.444
  237    HB3  LEU  32           HB3      LEU  32  -7.434  -7.342   1.814
  238    HG   LEU  32           HG       LEU  32  -9.087  -5.340   2.615
  239   HD11  LEU  32          HD11      LEU  32  -9.291  -7.168   4.938
  240   HD12  LEU  32          HD12      LEU  32 -10.344  -5.844   4.439
  241   HD13  LEU  32          HD13      LEU  32 -10.441  -7.404   3.621
  242   HD21  LEU  32          HD21      LEU  32  -6.589  -6.142   3.162
  243   HD22  LEU  32          HD22      LEU  32  -7.402  -4.847   4.041
  244   HD23  LEU  32          HD23      LEU  32  -7.350  -6.475   4.718
  245    H    VAL  33           HN       VAL  33 -11.622  -6.462   0.151
  246    HA   VAL  33           HA       VAL  33 -11.009  -3.620  -0.134
  247    HB   VAL  33           HB       VAL  33 -13.678  -4.875  -0.693
  248   HG11  VAL  33          HG11      VAL  33 -13.921  -2.578  -0.765
  249   HG12  VAL  33          HG12      VAL  33 -12.303  -2.325  -1.421
  250   HG13  VAL  33          HG13      VAL  33 -13.582  -2.968  -2.451
  251   HG21  VAL  33          HG21      VAL  33 -11.449  -4.593  -2.697
  252   HG22  VAL  33          HG22      VAL  33 -11.895  -6.111  -1.919
  253   HG23  VAL  33          HG23      VAL  33 -13.048  -5.284  -2.967
  254    H    SER  34           HN       SER  34 -11.716  -2.110   1.224
  255    HA   SER  34           HA       SER  34 -13.069  -3.032   3.646
  256    HB2  SER  34           HB2      SER  34 -11.863  -0.307   3.328
  257    HB3  SER  34           HB3      SER  34 -12.016  -1.296   4.782
  258    HG   SER  34           HG       SER  34 -10.524  -2.547   2.902
  259    H    TYR  35           HN       TYR  35 -15.182  -2.939   3.454
  260    HA   TYR  35           HA       TYR  35 -16.672  -1.234   1.835
  261    HB2  TYR  35           HB2      TYR  35 -18.386  -2.488   2.493
  262    HB3  TYR  35           HB3      TYR  35 -17.192  -3.440   3.340
  263    HD1  TYR  35           HD1      TYR  35 -19.622  -0.667   3.786
  264    HD2  TYR  35           HD2      TYR  35 -17.331  -3.714   5.682
  265    HE1  TYR  35           HE1      TYR  35 -20.810  -0.243   5.894
  266    HE2  TYR  35           HE2      TYR  35 -18.521  -3.300   7.793
  267    HH   TYR  35           HH       TYR  35 -20.097  -2.130   8.828
  268    HA   PRO  36           HA       PRO  36 -17.421   1.689   5.518
  269    HB2  PRO  36           HB2      PRO  36 -15.935   1.604   7.733
  270    HB3  PRO  36           HB3      PRO  36 -17.272   0.473   7.490
  271    HG2  PRO  36           HG2      PRO  36 -14.335   0.039   7.142
  272    HG3  PRO  36           HG3      PRO  36 -15.549  -1.037   7.858
  273    HD2  PRO  36           HD2      PRO  36 -14.589  -1.235   5.278
  274    HD3  PRO  36           HD3      PRO  36 -16.143  -1.890   5.830
  275    H    LYS  37           HN       LYS  37 -14.411   1.000   4.184
  276    HA   LYS  37           HA       LYS  37 -13.381   3.692   4.753
  277    HB2  LYS  37           HB2      LYS  37 -12.131   1.184   4.731
  278    HB3  LYS  37           HB3      LYS  37 -11.570   1.988   3.272
  279    HG2  LYS  37           HG2      LYS  37 -10.756   3.858   4.559
  280    HG3  LYS  37           HG3      LYS  37 -11.422   3.167   6.039
  281    HD2  LYS  37           HD2      LYS  37  -9.642   1.372   4.555
  282    HD3  LYS  37           HD3      LYS  37  -8.861   2.828   5.174
  283    HE2  LYS  37           HE2      LYS  37 -10.455   1.942   7.269
  284    HE3  LYS  37           HE3      LYS  37  -9.770   0.471   6.583
  285    HZ1  LYS  37           HZ1      LYS  37  -8.427   2.695   7.926
  286    HZ2  LYS  37           HZ2      LYS  37  -7.589   1.919   6.673
  287    HZ3  LYS  37           HZ3      LYS  37  -8.122   1.030   8.016
  288    H    GLY  38           HN       GLY  38 -14.527   1.561   2.272
  289    HA2  GLY  38           HA1      GLY  38 -15.217   2.045   0.121
  290    HA3  GLY  38           HA2      GLY  38 -14.731   3.717   0.378
  291    H    THR  39           HN       THR  39 -12.469   1.212   1.073
  292    HA   THR  39           HA       THR  39 -11.018   1.858  -1.412
  293    HB   THR  39           HB       THR  39  -9.028   1.422   0.478
  294    HG1  THR  39           HG1      THR  39 -10.712   3.395   1.597
  295   HG21  THR  39          HG21      THR  39  -8.303   3.526  -0.116
  296   HG22  THR  39          HG22      THR  39  -9.930   4.208  -0.114
  297   HG23  THR  39          HG23      THR  39  -9.405   3.180  -1.449
  298    H    ALA  40           HN       ALA  40  -9.578   0.273  -2.165
  299    HA   ALA  40           HA       ALA  40 -10.101  -2.414  -1.075
  300    HB1  ALA  40           HB1      ALA  40  -9.396  -3.115  -3.465
  301    HB2  ALA  40           HB2      ALA  40 -11.011  -2.455  -3.210
  302    HB3  ALA  40           HB3      ALA  40  -9.739  -1.435  -3.881
  303    H    GLN  41           HN       GLN  41  -8.412  -3.149   0.031
  304    HA   GLN  41           HA       GLN  41  -5.722  -2.247  -0.707
  305    HB2  GLN  41           HB2      GLN  41  -7.010  -2.864   1.771
  306    HB3  GLN  41           HB3      GLN  41  -5.655  -3.963   1.555
  307    HG2  GLN  41           HG2      GLN  41  -4.133  -2.121   1.296
  308    HG3  GLN  41           HG3      GLN  41  -5.467  -0.968   1.341
  309   HE21  GLN  41          HE21      GLN  41  -4.233  -3.672   3.282
  310   HE22  GLN  41          HE22      GLN  41  -4.384  -2.868   4.807
  311    H    LEU  42           HN       LEU  42  -4.885  -3.456  -2.280
  312    HA   LEU  42           HA       LEU  42  -5.358  -6.356  -2.170
  313    HB2  LEU  42           HB2      LEU  42  -5.312  -6.378  -4.610
  314    HB3  LEU  42           HB3      LEU  42  -6.604  -5.367  -3.995
  315    HG   LEU  42           HG       LEU  42  -4.129  -3.897  -4.553
  316   HD11  LEU  42          HD11      LEU  42  -4.320  -3.970  -6.953
  317   HD12  LEU  42          HD12      LEU  42  -4.046  -5.600  -6.336
  318   HD13  LEU  42          HD13      LEU  42  -5.661  -5.109  -6.846
  319   HD21  LEU  42          HD21      LEU  42  -6.423  -2.977  -3.995
  320   HD22  LEU  42          HD22      LEU  42  -5.622  -2.280  -5.404
  321   HD23  LEU  42          HD23      LEU  42  -6.908  -3.468  -5.618
  322    H    ALA  43           HN       ALA  43  -3.681  -7.675  -2.330
  323    HA   ALA  43           HA       ALA  43  -1.013  -6.510  -2.635
  324    HB1  ALA  43           HB1      ALA  43  -1.343  -9.393  -2.041
  325    HB2  ALA  43           HB2      ALA  43  -0.212  -8.219  -1.369
  326    HB3  ALA  43           HB3      ALA  43  -1.881  -8.259  -0.800
  327    H    ILE  44           HN       ILE  44  -0.354  -6.391  -4.662
  328    HA   ILE  44           HA       ILE  44  -1.168  -8.481  -6.560
  329    HB   ILE  44           HB       ILE  44  -0.036  -6.599  -8.142
  330   HG12  ILE  44          HG12      ILE  44  -1.615  -4.794  -6.419
  331   HG13  ILE  44          HG13      ILE  44  -0.043  -5.260  -5.776
  332   HG21  ILE  44          HG21      ILE  44  -2.056  -7.175  -8.926
  333   HG22  ILE  44          HG22      ILE  44  -2.767  -7.276  -7.314
  334   HG23  ILE  44          HG23      ILE  44  -2.591  -5.709  -8.103
  335   HD11  ILE  44          HD11      ILE  44   0.496  -4.598  -8.397
  336   HD12  ILE  44          HD12      ILE  44  -0.712  -3.413  -7.900
  337   HD13  ILE  44          HD13      ILE  44   0.781  -3.590  -6.978
  338    H    VAL  45           HN       VAL  45   0.443  -9.053  -8.233
  339    HA   VAL  45           HA       VAL  45   3.071  -9.459  -7.097
  340    HB   VAL  45           HB       VAL  45   2.065 -10.109  -9.879
  341   HG11  VAL  45          HG11      VAL  45   4.657 -10.375  -8.575
  342   HG12  VAL  45          HG12      VAL  45   4.057 -11.894  -9.239
  343   HG13  VAL  45          HG13      VAL  45   4.232 -10.483 -10.283
  344   HG21  VAL  45          HG21      VAL  45   0.743 -11.495  -8.647
  345   HG22  VAL  45          HG22      VAL  45   2.195 -12.494  -8.719
  346   HG23  VAL  45          HG23      VAL  45   1.858 -11.529  -7.282
  347    HA   PRO  46           HA       PRO  46   4.698  -5.536  -8.454
  348    HB2  PRO  46           HB2      PRO  46   7.223  -7.124  -8.475
  349    HB3  PRO  46           HB3      PRO  46   6.883  -5.558  -7.728
  350    HG2  PRO  46           HG2      PRO  46   7.022  -7.750  -6.235
  351    HG3  PRO  46           HG3      PRO  46   5.793  -6.512  -5.909
  352    HD2  PRO  46           HD2      PRO  46   5.506  -9.175  -7.228
  353    HD3  PRO  46           HD3      PRO  46   4.388  -8.325  -6.144
  354    H    GLY  47           HN       GLY  47   4.237  -5.014 -10.482
  355    HA2  GLY  47           HA1      GLY  47   5.489  -4.991 -12.718
  356    HA3  GLY  47           HA2      GLY  47   5.243  -6.733 -12.656
  357    H    THR  48           HN       THR  48   2.626  -6.600 -11.475
  358    HA   THR  48           HA       THR  48   1.039  -6.239 -13.809
  359    HB   THR  48           HB       THR  48  -0.302  -6.333 -11.163
  360    HG1  THR  48           HG1      THR  48   1.298  -7.745 -10.630
  361   HG21  THR  48          HG21      THR  48  -1.385  -6.579 -13.457
  362   HG22  THR  48          HG22      THR  48  -1.779  -7.814 -12.262
  363   HG23  THR  48          HG23      THR  48  -0.610  -8.160 -13.536
  364    H    SER  49           HN       SER  49  -0.134  -4.546 -14.472
  365    HA   SER  49           HA       SER  49   0.492  -2.020 -13.337
  366    HB2  SER  49           HB2      SER  49  -1.566  -1.733 -15.253
  367    HB3  SER  49           HB3      SER  49   0.163  -1.465 -15.477
  368    HG   SER  49           HG       SER  49  -0.485  -3.001 -16.955
  369    HA   PRO  50           HA       PRO  50  -3.051  -2.043 -10.612
  370    HB2  PRO  50           HB2      PRO  50  -2.111   0.552  -9.682
  371    HB3  PRO  50           HB3      PRO  50  -2.168  -0.981  -8.810
  372    HG2  PRO  50           HG2      PRO  50   0.154   0.203  -9.582
  373    HG3  PRO  50           HG3      PRO  50  -0.030  -1.552  -9.413
  374    HD2  PRO  50           HD2      PRO  50  -0.075   0.132 -11.890
  375    HD3  PRO  50           HD3      PRO  50   0.675  -1.456 -11.618
  376    H    ASP  51           HN       ASP  51  -2.117   0.481 -12.818
  377    HA   ASP  51           HA       ASP  51  -4.523   2.007 -12.532
  378    HB2  ASP  51           HB2      ASP  51  -2.110   2.512 -13.707
  379    HB3  ASP  51           HB3      ASP  51  -3.097   2.144 -15.118
  380    H    ALA  52           HN       ALA  52  -3.586  -0.879 -14.050
  381    HA   ALA  52           HA       ALA  52  -5.563  -0.851 -16.135
  382    HB1  ALA  52           HB1      ALA  52  -3.532  -2.119 -16.481
  383    HB2  ALA  52           HB2      ALA  52  -3.866  -3.096 -15.051
  384    HB3  ALA  52           HB3      ALA  52  -4.913  -3.216 -16.466
  385    H    LEU  53           HN       LEU  53  -5.220  -2.211 -12.927
  386    HA   LEU  53           HA       LEU  53  -7.679  -3.623 -12.907
  387    HB2  LEU  53           HB2      LEU  53  -6.285  -2.462 -10.500
  388    HB3  LEU  53           HB3      LEU  53  -7.341  -3.862 -10.556
  389    HG   LEU  53           HG       LEU  53  -4.765  -3.881 -12.084
  390   HD11  LEU  53          HD11      LEU  53  -3.506  -3.824 -10.269
  391   HD12  LEU  53          HD12      LEU  53  -4.936  -3.513  -9.284
  392   HD13  LEU  53          HD13      LEU  53  -4.413  -5.171  -9.579
  393   HD21  LEU  53          HD21      LEU  53  -5.334  -5.989 -12.469
  394   HD22  LEU  53          HD22      LEU  53  -5.488  -6.305 -10.741
  395   HD23  LEU  53          HD23      LEU  53  -6.869  -5.694 -11.652
  396    H    THR  54           HN       THR  54  -6.674  -0.418 -11.835
  397    HA   THR  54           HA       THR  54  -9.099   0.572 -10.913
  398    HB   THR  54           HB       THR  54  -7.099   2.178 -12.510
  399    HG1  THR  54           HG1      THR  54  -5.885   1.137 -10.948
  400   HG21  THR  54          HG21      THR  54  -9.135   2.836 -10.402
  401   HG22  THR  54          HG22      THR  54  -8.942   3.537 -12.010
  402   HG23  THR  54          HG23      THR  54  -7.773   3.902 -10.740
  403    H    ALA  55           HN       ALA  55  -7.744   0.648 -14.210
  404    HA   ALA  55           HA       ALA  55  -9.996   1.886 -15.403
  405    HB1  ALA  55           HB1      ALA  55  -7.543   1.534 -16.275
  406    HB2  ALA  55           HB2      ALA  55  -8.238   0.078 -16.987
  407    HB3  ALA  55           HB3      ALA  55  -8.894   1.662 -17.403
  408    H    ALA  56           HN       ALA  56  -9.175  -1.458 -14.742
  409    HA   ALA  56           HA       ALA  56 -11.231  -2.651 -16.255
  410    HB1  ALA  56           HB1      ALA  56  -9.696  -3.538 -13.838
  411    HB2  ALA  56           HB2      ALA  56 -10.997  -4.521 -14.509
  412    HB3  ALA  56           HB3      ALA  56  -9.590  -4.126 -15.498
  413    H    VAL  57           HN       VAL  57 -11.151  -1.566 -12.863
  414    HA   VAL  57           HA       VAL  57 -13.833  -2.295 -12.315
  415    HB   VAL  57           HB       VAL  57 -12.193  -0.190 -10.927
  416   HG11  VAL  57          HG11      VAL  57 -14.860  -1.311 -10.468
  417   HG12  VAL  57          HG12      VAL  57 -13.817  -1.301  -9.044
  418   HG13  VAL  57          HG13      VAL  57 -14.152   0.203  -9.904
  419   HG21  VAL  57          HG21      VAL  57 -11.276  -2.607 -11.110
  420   HG22  VAL  57          HG22      VAL  57 -11.292  -1.810  -9.536
  421   HG23  VAL  57          HG23      VAL  57 -12.539  -2.989  -9.940
  422    H    ALA  58           HN       ALA  58 -12.341   0.812 -13.244
  423    HA   ALA  58           HA       ALA  58 -14.702   2.315 -13.332
  424    HB1  ALA  58           HB1      ALA  58 -12.417   2.742 -15.226
  425    HB2  ALA  58           HB2      ALA  58 -13.487   3.942 -14.500
  426    HB3  ALA  58           HB3      ALA  58 -12.285   3.115 -13.508
  427    H    GLY  59           HN       GLY  59 -13.179   0.264 -15.739
  428    HA2  GLY  59           HA1      GLY  59 -14.999   0.883 -17.846
  429    HA3  GLY  59           HA2      GLY  59 -13.878  -0.470 -17.803
  430    H    LEU  60           HN       LEU  60 -15.266  -1.043 -15.068
  431    HA   LEU  60           HA       LEU  60 -17.226  -2.858 -16.156
  432    HB2  LEU  60           HB2      LEU  60 -15.703  -2.604 -13.713
  433    HB3  LEU  60           HB3      LEU  60 -17.383  -2.958 -13.374
  434    HG   LEU  60           HG       LEU  60 -15.917  -4.637 -15.370
  435   HD11  LEU  60          HD11      LEU  60 -15.138  -6.107 -13.609
  436   HD12  LEU  60          HD12      LEU  60 -14.432  -4.501 -13.423
  437   HD13  LEU  60          HD13      LEU  60 -15.766  -5.005 -12.385
  438   HD21  LEU  60          HD21      LEU  60 -17.451  -6.298 -13.948
  439   HD22  LEU  60          HD22      LEU  60 -18.347  -4.800 -13.693
  440   HD23  LEU  60          HD23      LEU  60 -18.055  -5.385 -15.331
  441    H    GLY  61           HN       GLY  61 -17.398   0.234 -15.768
  442    HA2  GLY  61           HA1      GLY  61 -19.425   1.447 -15.969
  443    HA3  GLY  61           HA2      GLY  61 -20.248   0.171 -15.085
  444    H    TYR  62           HN       TYR  62 -17.799   0.332 -13.192
  445    HA   TYR  62           HA       TYR  62 -19.091   2.221 -11.398
  446    HB2  TYR  62           HB2      TYR  62 -16.640   0.710 -10.609
  447    HB3  TYR  62           HB3      TYR  62 -18.050   1.128  -9.648
  448    HD1  TYR  62           HD2      TYR  62 -20.275  -0.003 -11.076
  449    HD2  TYR  62           HD1      TYR  62 -16.361  -1.593 -10.570
  450    HE1  TYR  62           HE2      TYR  62 -21.162  -2.274 -11.392
  451    HE2  TYR  62           HE1      TYR  62 -17.239  -3.866 -10.889
  452    HH   TYR  62           HH       TYR  62 -19.384  -5.060 -10.649
  453    H    LYS  63           HN       LYS  63 -17.278   3.317  -9.873
  454    HA   LYS  63           HA       LYS  63 -15.440   4.695 -11.709
  455    HB2  LYS  63           HB2      LYS  63 -17.469   5.749  -9.960
  456    HB3  LYS  63           HB3      LYS  63 -15.889   6.333  -9.453
  457    HG2  LYS  63           HG2      LYS  63 -16.152   6.509 -12.309
  458    HG3  LYS  63           HG3      LYS  63 -17.493   7.328 -11.510
  459    HD2  LYS  63           HD2      LYS  63 -15.946   9.023 -11.594
  460    HD3  LYS  63           HD3      LYS  63 -15.583   8.323 -10.013
  461    HE2  LYS  63           HE2      LYS  63 -13.536   7.703 -10.655
  462    HE3  LYS  63           HE3      LYS  63 -14.138   7.007 -12.160
  463    HZ1  LYS  63           HZ1      LYS  63 -13.954   9.034 -13.259
  464    HZ2  LYS  63           HZ2      LYS  63 -12.541   8.959 -12.323
  465    HZ3  LYS  63           HZ3      LYS  63 -13.842   9.928 -11.824
  466    H    ALA  64           HN       ALA  64 -13.536   3.693 -11.312
  467    HA   ALA  64           HA       ALA  64 -12.792   3.283  -8.503
  468    HB1  ALA  64           HB1      ALA  64 -12.479   1.693 -10.824
  469    HB2  ALA  64           HB2      ALA  64 -10.870   2.163 -10.271
  470    HB3  ALA  64           HB3      ALA  64 -11.974   1.337  -9.172
  471    H    THR  65           HN       THR  65 -10.936   4.063  -7.666
  472    HA   THR  65           HA       THR  65  -9.124   5.597  -9.374
  473    HB   THR  65           HB       THR  65  -9.213   6.937  -6.871
  474    HG1  THR  65           HG1      THR  65 -11.788   6.784  -8.108
  475   HG21  THR  65          HG21      THR  65  -9.631   8.871  -8.193
  476   HG22  THR  65          HG22      THR  65 -10.351   7.910  -9.485
  477   HG23  THR  65          HG23      THR  65  -8.619   7.804  -9.168
  478    H    LEU  66           HN       LEU  66  -7.534   6.436  -7.065
  479    HA   LEU  66           HA       LEU  66  -6.938   4.008  -5.622
  480    HB2  LEU  66           HB2      LEU  66  -4.458   4.246  -6.335
  481    HB3  LEU  66           HB3      LEU  66  -5.576   3.376  -7.366
  482    HG   LEU  66           HG       LEU  66  -5.691   5.994  -8.303
  483   HD11  LEU  66          HD11      LEU  66  -3.504   6.793  -8.552
  484   HD12  LEU  66          HD12      LEU  66  -3.605   6.311  -6.858
  485   HD13  LEU  66          HD13      LEU  66  -2.793   5.267  -8.025
  486   HD21  LEU  66          HD21      LEU  66  -3.880   4.623  -9.916
  487   HD22  LEU  66          HD22      LEU  66  -4.886   3.371  -9.188
  488   HD23  LEU  66          HD23      LEU  66  -5.633   4.684 -10.098
  489    H    ALA  67           HN       ALA  67  -6.066   4.393  -3.696
  490    HA   ALA  67           HA       ALA  67  -5.127   7.137  -3.152
  491    HB1  ALA  67           HB1      ALA  67  -5.687   6.524  -0.733
  492    HB2  ALA  67           HB2      ALA  67  -7.050   6.792  -1.818
  493    HB3  ALA  67           HB3      ALA  67  -6.563   5.148  -1.403
  494    H    ASP  68           HN       ASP  68  -3.426   5.489  -4.338
  495    HA   ASP  68           HA       ASP  68  -2.094   3.653  -2.678
  496    HB2  ASP  68           HB2      ASP  68  -2.186   3.574  -5.183
  497    HB3  ASP  68           HB3      ASP  68  -1.023   4.896  -5.201
  498    H    ALA  69           HN       ALA  69  -1.250   4.465  -0.877
  499    HA   ALA  69           HA       ALA  69   1.221   5.926  -1.123
  500    HB1  ALA  69           HB1      ALA  69  -0.935   6.998   0.697
  501    HB2  ALA  69           HB2      ALA  69   0.671   7.674   0.429
  502    HB3  ALA  69           HB3      ALA  69  -0.526   7.705  -0.866
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1   2.749  -2.203  -1.550
    2    H2   MET   1           H2       MET   1   2.106  -0.719  -2.068
    3    H3   MET   1           H3       MET   1   2.471  -1.929  -3.202
    4    HA   MET   1           HA       MET   1   0.599  -3.055  -2.850
    5    HB2  MET   1           HB2      MET   1   1.352  -3.580  -0.508
    6    HB3  MET   1           HB3      MET   1   0.554  -2.106   0.023
    7    HG2  MET   1           HG2      MET   1  -1.564  -3.076  -1.003
    8    HG3  MET   1           HG3      MET   1  -0.684  -4.601  -1.081
    9    HE1  MET   1           HE1      MET   1  -2.333  -5.978   1.793
   10    HE2  MET   1           HE2      MET   1  -3.396  -4.852   0.953
   11    HE3  MET   1           HE3      MET   1  -2.232  -5.810   0.039
   12    H    THR   2           HN       THR   2  -0.339  -1.643  -4.282
   13    HA   THR   2           HA       THR   2  -1.016   1.019  -3.741
   14    HB   THR   2           HB       THR   2  -2.544  -0.560  -5.764
   15    HG1  THR   2           HG1      THR   2   0.165   0.225  -6.150
   16   HG21  THR   2          HG21      THR   2  -1.065   1.972  -6.306
   17   HG22  THR   2          HG22      THR   2  -2.513   2.048  -5.302
   18   HG23  THR   2          HG23      THR   2  -2.613   1.410  -6.942
   19    H    HIS   3           HN       HIS   3  -2.594   1.882  -2.594
   20    HA   HIS   3           HA       HIS   3  -4.904   0.266  -1.830
   21    HB2  HIS   3           HB2      HIS   3  -4.260   3.110  -1.055
   22    HB3  HIS   3           HB3      HIS   3  -5.493   2.092  -0.342
   23    HD1  HIS   3           HD1      HIS   3  -1.692   1.881  -0.778
   24    HD2  HIS   3           HD2      HIS   3  -4.680   1.087   2.012
   25    HE1  HIS   3           HE1      HIS   3  -0.507   1.048   1.278
   26    HE2  HIS   3           HE2      HIS   3  -2.339   0.402   2.883
   27    H    LEU   4           HN       LEU   4  -6.752   0.399  -2.821
   28    HA   LEU   4           HA       LEU   4  -7.086   2.419  -4.921
   29    HB2  LEU   4           HB2      LEU   4  -7.222  -0.273  -5.122
   30    HB3  LEU   4           HB3      LEU   4  -8.904   0.089  -4.801
   31    HG   LEU   4           HG       LEU   4  -8.197   1.888  -6.802
   32   HD11  LEU   4          HD11      LEU   4  -7.447   0.008  -8.503
   33   HD12  LEU   4          HD12      LEU   4  -6.272   0.962  -7.596
   34   HD13  LEU   4          HD13      LEU   4  -6.699  -0.662  -7.053
   35   HD21  LEU   4          HD21      LEU   4 -10.331   0.908  -6.753
   36   HD22  LEU   4          HD22      LEU   4  -9.573   0.282  -8.215
   37   HD23  LEU   4          HD23      LEU   4  -9.674  -0.729  -6.773
   38    H    LYS   5           HN       LYS   5  -9.114   3.418  -5.220
   39    HA   LYS   5           HA       LYS   5 -10.784   3.465  -2.794
   40    HB2  LYS   5           HB2      LYS   5  -9.883   5.608  -4.657
   41    HB3  LYS   5           HB3      LYS   5 -11.454   5.768  -3.901
   42    HG2  LYS   5           HG2      LYS   5  -8.793   5.555  -2.517
   43    HG3  LYS   5           HG3      LYS   5  -9.855   6.963  -2.593
   44    HD2  LYS   5           HD2      LYS   5 -10.991   4.454  -1.491
   45    HD3  LYS   5           HD3      LYS   5  -9.810   5.316  -0.500
   46    HE2  LYS   5           HE2      LYS   5 -12.013   6.875  -1.747
   47    HE3  LYS   5           HE3      LYS   5 -12.395   5.851  -0.366
   48    HZ1  LYS   5           HZ1      LYS   5 -10.301   7.054   0.620
   49    HZ2  LYS   5           HZ2      LYS   5 -11.837   7.770   0.689
   50    HZ3  LYS   5           HZ3      LYS   5 -10.731   8.254  -0.502
   51    H    ILE   6           HN       ILE   6 -12.797   2.819  -3.005
   52    HA   ILE   6           HA       ILE   6 -13.819   2.121  -5.632
   53    HB   ILE   6           HB       ILE   6 -15.186   1.794  -2.954
   54   HG12  ILE   6          HG12      ILE   6 -13.125   0.596  -2.776
   55   HG13  ILE   6          HG13      ILE   6 -14.379  -0.595  -3.111
   56   HG21  ILE   6          HG21      ILE   6 -15.966  -0.251  -4.646
   57   HG22  ILE   6          HG22      ILE   6 -16.902   1.189  -4.242
   58   HG23  ILE   6          HG23      ILE   6 -15.902   1.167  -5.693
   59   HD11  ILE   6          HD11      ILE   6 -13.623  -0.960  -5.271
   60   HD12  ILE   6          HD12      ILE   6 -12.740   0.565  -5.325
   61   HD13  ILE   6          HD13      ILE   6 -12.137  -0.770  -4.343
   62    H    THR   7           HN       THR   7 -15.217   3.334  -6.763
   63    HA   THR   7           HA       THR   7 -16.685   5.441  -5.346
   64    HB   THR   7           HB       THR   7 -16.110   6.426  -7.934
   65    HG1  THR   7           HG1      THR   7 -14.296   4.847  -7.719
   66   HG21  THR   7          HG21      THR   7 -16.385   7.496  -5.543
   67   HG22  THR   7          HG22      THR   7 -15.426   8.298  -6.788
   68   HG23  THR   7          HG23      THR   7 -14.624   7.364  -5.524
   69    H    GLY   8           HN       GLY   8 -18.666   6.060  -6.285
   70    HA2  GLY   8           HA1      GLY   8 -20.475   5.766  -7.791
   71    HA3  GLY   8           HA2      GLY   8 -19.668   4.345  -8.446
   72    H    MET   9           HN       MET   9 -19.262   2.632  -6.624
   73    HA   MET   9           HA       MET   9 -21.864   2.068  -5.441
   74    HB2  MET   9           HB2      MET   9 -19.357   0.366  -5.408
   75    HB3  MET   9           HB3      MET   9 -20.969  -0.135  -4.917
   76    HG2  MET   9           HG2      MET   9 -21.741   0.278  -7.246
   77    HG3  MET   9           HG3      MET   9 -20.068   0.594  -7.697
   78    HE1  MET   9           HE1      MET   9 -22.650  -2.445  -6.728
   79    HE2  MET   9           HE2      MET   9 -22.625  -1.486  -8.209
   80    HE3  MET   9           HE3      MET   9 -22.080  -3.163  -8.234
   81    H    THR  10           HN       THR  10 -22.204   1.750  -3.227
   82    HA   THR  10           HA       THR  10 -20.553   3.448  -1.588
   83    HB   THR  10           HB       THR  10 -22.786   1.847  -0.427
   84    HG1  THR  10           HG1      THR  10 -23.357   4.205  -1.878
   85   HG21  THR  10          HG21      THR  10 -22.573   3.368   1.191
   86   HG22  THR  10          HG22      THR  10 -22.880   4.670   0.041
   87   HG23  THR  10          HG23      THR  10 -21.232   4.099   0.303
   88    H    CYS  11           HN       CYS  11 -21.726   0.075  -1.150
   89    HA   CYS  11           HA       CYS  11 -19.282  -0.981  -0.292
   90    HB2  CYS  11           HB2      CYS  11 -19.761  -1.130   2.152
   91    HB3  CYS  11           HB3      CYS  11 -19.362   0.485   1.585
   92    HG   CYS  11           HG       CYS  11 -22.613   0.161   1.458
   93    H    ASP  12           HN       ASP  12 -19.466  -3.107   0.637
   94    HA   ASP  12           HA       ASP  12 -20.301  -5.177   0.941
   95    HB2  ASP  12           HB2      ASP  12 -21.642  -4.100   2.678
   96    HB3  ASP  12           HB3      ASP  12 -22.890  -3.717   1.496
   97    H    SER  13           HN       SER  13 -20.567  -6.654  -0.529
   98    HA   SER  13           HA       SER  13 -21.196  -7.771  -2.400
   99    HB2  SER  13           HB2      SER  13 -23.582  -5.914  -2.585
  100    HB3  SER  13           HB3      SER  13 -23.397  -7.492  -3.352
  101    HG   SER  13           HG       SER  13 -24.217  -6.867  -0.835
  102    H    CYS  14           HN       CYS  14 -21.759  -4.289  -2.720
  103    HA   CYS  14           HA       CYS  14 -20.809  -3.986  -5.336
  104    HB2  CYS  14           HB2      CYS  14 -20.263  -1.922  -3.237
  105    HB3  CYS  14           HB3      CYS  14 -20.828  -1.713  -4.884
  106    HG   CYS  14           HG       CYS  14 -22.642  -2.512  -2.110
  107    H    ALA  15           HN       ALA  15 -19.202  -3.860  -2.208
  108    HA   ALA  15           HA       ALA  15 -16.584  -3.431  -3.196
  109    HB1  ALA  15           HB1      ALA  15 -17.063  -2.941  -0.900
  110    HB2  ALA  15           HB2      ALA  15 -17.560  -4.605  -0.595
  111    HB3  ALA  15           HB3      ALA  15 -15.869  -4.240  -0.938
  112    H    ALA  16           HN       ALA  16 -18.564  -6.252  -2.792
  113    HA   ALA  16           HA       ALA  16 -16.443  -8.164  -2.975
  114    HB1  ALA  16           HB1      ALA  16 -18.073  -9.432  -2.158
  115    HB2  ALA  16           HB2      ALA  16 -19.284  -8.212  -2.548
  116    HB3  ALA  16           HB3      ALA  16 -18.824  -9.413  -3.754
  117    H    HIS  17           HN       HIS  17 -18.714  -6.678  -5.203
  118    HA   HIS  17           HA       HIS  17 -18.107  -8.178  -7.493
  119    HB2  HIS  17           HB2      HIS  17 -19.504  -5.705  -6.860
  120    HB3  HIS  17           HB3      HIS  17 -18.640  -5.586  -8.387
  121    HD1  HIS  17           HD1      HIS  17 -20.668  -5.660  -9.904
  122    HD2  HIS  17           HD2      HIS  17 -20.461  -8.883  -7.276
  123    HE1  HIS  17           HE1      HIS  17 -22.442  -7.274 -10.660
  124    HE2  HIS  17           HE2      HIS  17 -22.398  -9.147  -8.974
  125    H    VAL  18           HN       VAL  18 -16.769  -5.123  -6.279
  126    HA   VAL  18           HA       VAL  18 -14.823  -4.794  -8.289
  127    HB   VAL  18           HB       VAL  18 -14.734  -3.822  -5.425
  128   HG11  VAL  18          HG11      VAL  18 -12.682  -3.097  -5.915
  129   HG12  VAL  18          HG12      VAL  18 -12.844  -3.609  -7.594
  130   HG13  VAL  18          HG13      VAL  18 -13.415  -2.016  -7.099
  131   HG21  VAL  18          HG21      VAL  18 -16.612  -3.185  -7.286
  132   HG22  VAL  18          HG22      VAL  18 -16.099  -2.122  -5.974
  133   HG23  VAL  18          HG23      VAL  18 -15.395  -1.943  -7.580
  134    H    LYS  19           HN       LYS  19 -14.695  -6.340  -5.101
  135    HA   LYS  19           HA       LYS  19 -11.997  -7.041  -5.076
  136    HB2  LYS  19           HB2      LYS  19 -13.604  -7.259  -3.164
  137    HB3  LYS  19           HB3      LYS  19 -14.266  -8.689  -3.947
  138    HG2  LYS  19           HG2      LYS  19 -12.290  -9.913  -3.624
  139    HG3  LYS  19           HG3      LYS  19 -11.356  -8.466  -3.243
  140    HD2  LYS  19           HD2      LYS  19 -11.991  -8.481  -1.090
  141    HD3  LYS  19           HD3      LYS  19 -13.659  -8.896  -1.489
  142    HE2  LYS  19           HE2      LYS  19 -12.792 -10.721  -0.252
  143    HE3  LYS  19           HE3      LYS  19 -12.853 -11.239  -1.936
  144    HZ1  LYS  19           HZ1      LYS  19 -10.365 -10.031  -1.000
  145    HZ2  LYS  19           HZ2      LYS  19 -10.613 -11.303  -2.098
  146    HZ3  LYS  19           HZ3      LYS  19 -10.730 -11.587  -0.431
  147    H    GLU  20           HN       GLU  20 -14.790  -8.824  -6.347
  148    HA   GLU  20           HA       GLU  20 -13.356 -11.073  -7.228
  149    HB2  GLU  20           HB2      GLU  20 -16.051  -9.972  -7.576
  150    HB3  GLU  20           HB3      GLU  20 -15.486 -10.890  -8.966
  151    HG2  GLU  20           HG2      GLU  20 -15.204 -12.059  -6.243
  152    HG3  GLU  20           HG3      GLU  20 -16.784 -12.055  -7.025
  153    H    ALA  21           HN       ALA  21 -14.186  -8.037  -8.785
  154    HA   ALA  21           HA       ALA  21 -13.227  -8.619 -11.353
  155    HB1  ALA  21           HB1      ALA  21 -14.196  -6.335  -9.959
  156    HB2  ALA  21           HB2      ALA  21 -12.705  -5.888 -10.787
  157    HB3  ALA  21           HB3      ALA  21 -14.049  -6.582 -11.698
  158    H    LEU  22           HN       LEU  22 -11.629  -7.382  -8.470
  159    HA   LEU  22           HA       LEU  22  -9.099  -6.914  -9.667
  160    HB2  LEU  22           HB2      LEU  22  -9.836  -7.439  -6.784
  161    HB3  LEU  22           HB3      LEU  22  -8.271  -6.877  -7.331
  162    HG   LEU  22           HG       LEU  22 -10.729  -5.294  -7.977
  163   HD11  LEU  22          HD11      LEU  22 -10.681  -5.805  -5.522
  164   HD12  LEU  22          HD12      LEU  22  -9.125  -4.978  -5.449
  165   HD13  LEU  22          HD13      LEU  22 -10.573  -4.092  -5.927
  166   HD21  LEU  22          HD21      LEU  22  -9.187  -3.470  -8.086
  167   HD22  LEU  22          HD22      LEU  22  -7.886  -4.468  -7.437
  168   HD23  LEU  22          HD23      LEU  22  -8.536  -4.803  -9.041
  169    H    GLU  23           HN       GLU  23 -10.497  -9.602  -7.869
  170    HA   GLU  23           HA       GLU  23  -8.114 -11.181  -7.968
  171    HB2  GLU  23           HB2      GLU  23 -10.955 -11.757  -7.175
  172    HB3  GLU  23           HB3      GLU  23  -9.721 -13.009  -7.195
  173    HG2  GLU  23           HG2      GLU  23  -8.388 -11.695  -5.605
  174    HG3  GLU  23           HG3      GLU  23  -9.673 -10.488  -5.556
  175    H    LYS  24           HN       LYS  24 -10.523 -10.485 -10.227
  176    HA   LYS  24           HA       LYS  24 -10.430 -12.928 -11.713
  177    HB2  LYS  24           HB2      LYS  24 -11.961 -10.644 -11.812
  178    HB3  LYS  24           HB3      LYS  24 -10.937 -10.459 -13.226
  179    HG2  LYS  24           HG2      LYS  24 -13.206 -11.608 -13.507
  180    HG3  LYS  24           HG3      LYS  24 -11.794 -12.348 -14.256
  181    HD2  LYS  24           HD2      LYS  24 -13.021 -14.104 -13.239
  182    HD3  LYS  24           HD3      LYS  24 -11.613 -13.812 -12.213
  183    HE2  LYS  24           HE2      LYS  24 -13.856 -12.170 -11.417
  184    HE3  LYS  24           HE3      LYS  24 -14.291 -13.879 -11.430
  185    HZ1  LYS  24           HZ1      LYS  24 -12.033 -14.118 -10.179
  186    HZ2  LYS  24           HZ2      LYS  24 -13.430 -13.650  -9.332
  187    HZ3  LYS  24           HZ3      LYS  24 -12.290 -12.484  -9.797
  188    H    VAL  25           HN       VAL  25  -8.466 -10.130 -11.395
  189    HA   VAL  25           HA       VAL  25  -6.859 -10.626 -13.734
  190    HB   VAL  25           HB       VAL  25  -6.455  -8.807 -11.352
  191   HG11  VAL  25          HG11      VAL  25  -4.375  -9.652 -12.698
  192   HG12  VAL  25          HG12      VAL  25  -4.945  -8.507 -13.914
  193   HG13  VAL  25          HG13      VAL  25  -4.534  -7.941 -12.294
  194   HG21  VAL  25          HG21      VAL  25  -6.767  -7.329 -13.706
  195   HG22  VAL  25          HG22      VAL  25  -7.997  -8.592 -13.773
  196   HG23  VAL  25          HG23      VAL  25  -7.927  -7.501 -12.389
  197    HA   PRO  26           HA       PRO  26  -4.682 -13.920 -11.741
  198    HB2  PRO  26           HB2      PRO  26  -2.765 -13.764 -13.943
  199    HB3  PRO  26           HB3      PRO  26  -3.910 -15.046 -13.545
  200    HG2  PRO  26           HG2      PRO  26  -4.211 -13.461 -15.705
  201    HG3  PRO  26           HG3      PRO  26  -5.592 -14.115 -14.807
  202    HD2  PRO  26           HD2      PRO  26  -4.379 -11.378 -14.690
  203    HD3  PRO  26           HD3      PRO  26  -6.093 -11.848 -14.699
  204    H    GLY  27           HN       GLY  27  -3.583 -10.823 -11.866
  205    HA2  GLY  27           HA1      GLY  27  -0.867 -11.476 -10.958
  206    HA3  GLY  27           HA2      GLY  27  -1.442  -9.876 -11.407
  207    H    VAL  28           HN       VAL  28  -3.784 -11.320  -9.566
  208    HA   VAL  28           HA       VAL  28  -3.076  -9.677  -7.278
  209    HB   VAL  28           HB       VAL  28  -5.427  -9.939  -8.400
  210   HG11  VAL  28          HG11      VAL  28  -6.868 -11.555  -7.218
  211   HG12  VAL  28          HG12      VAL  28  -5.646 -12.327  -8.227
  212   HG13  VAL  28          HG13      VAL  28  -5.429 -12.258  -6.478
  213   HG21  VAL  28          HG21      VAL  28  -6.125  -8.716  -6.671
  214   HG22  VAL  28          HG22      VAL  28  -5.885 -10.040  -5.529
  215   HG23  VAL  28          HG23      VAL  28  -4.532  -8.995  -5.969
  216    H    GLN  29           HN       GLN  29  -2.784 -10.425  -5.183
  217    HA   GLN  29           HA       GLN  29  -2.556 -13.340  -4.867
  218    HB2  GLN  29           HB2      GLN  29  -0.628 -11.211  -4.261
  219    HB3  GLN  29           HB3      GLN  29  -0.880 -12.348  -2.941
  220    HG2  GLN  29           HG2      GLN  29   0.077 -12.921  -5.728
  221    HG3  GLN  29           HG3      GLN  29   0.925 -13.181  -4.207
  222   HE21  GLN  29          HE21      GLN  29  -1.544 -14.363  -6.356
  223   HE22  GLN  29          HE22      GLN  29  -1.733 -15.921  -5.614
  224    H    SER  30           HN       SER  30  -3.225 -10.259  -3.250
  225    HA   SER  30           HA       SER  30  -5.280 -11.582  -1.697
  226    HB2  SER  30           HB2      SER  30  -4.067 -10.118   0.312
  227    HB3  SER  30           HB3      SER  30  -3.979 -11.867   0.122
  228    HG   SER  30           HG       SER  30  -1.989 -10.155   0.063
  229    H    ALA  31           HN       ALA  31  -6.892 -10.320  -2.405
  230    HA   ALA  31           HA       ALA  31  -6.518  -7.401  -2.345
  231    HB1  ALA  31           HB1      ALA  31  -7.508  -8.947  -4.346
  232    HB2  ALA  31           HB2      ALA  31  -8.991  -8.466  -3.520
  233    HB3  ALA  31           HB3      ALA  31  -7.881  -7.237  -4.126
  234    H    LEU  32           HN       LEU  32  -6.945  -6.784  -0.293
  235    HA   LEU  32           HA       LEU  32  -9.396  -7.784   0.969
  236    HB2  LEU  32           HB2      LEU  32  -8.299  -6.271   2.899
  237    HB3  LEU  32           HB3      LEU  32  -7.933  -7.969   2.678
  238    HG   LEU  32           HG       LEU  32  -6.207  -6.123   1.160
  239   HD11  LEU  32          HD11      LEU  32  -6.786  -5.414   3.779
  240   HD12  LEU  32          HD12      LEU  32  -5.263  -6.295   3.884
  241   HD13  LEU  32          HD13      LEU  32  -5.398  -4.891   2.824
  242   HD21  LEU  32          HD21      LEU  32  -4.530  -7.706   2.403
  243   HD22  LEU  32          HD22      LEU  32  -5.979  -8.665   2.701
  244   HD23  LEU  32          HD23      LEU  32  -5.488  -8.302   1.047
  245    H    VAL  33           HN       VAL  33 -11.129  -6.632   0.563
  246    HA   VAL  33           HA       VAL  33 -10.843  -3.748   0.088
  247    HB   VAL  33           HB       VAL  33 -13.224  -5.486  -0.549
  248   HG11  VAL  33          HG11      VAL  33 -12.889  -3.115  -2.154
  249   HG12  VAL  33          HG12      VAL  33 -14.266  -3.626  -1.180
  250   HG13  VAL  33          HG13      VAL  33 -12.951  -2.713  -0.438
  251   HG21  VAL  33          HG21      VAL  33 -12.000  -6.339  -2.207
  252   HG22  VAL  33          HG22      VAL  33 -12.051  -4.736  -2.943
  253   HG23  VAL  33          HG23      VAL  33 -10.686  -5.197  -1.924
  254    H    SER  34           HN       SER  34 -11.495  -2.388   1.566
  255    HA   SER  34           HA       SER  34 -12.938  -3.355   3.899
  256    HB2  SER  34           HB2      SER  34 -12.360  -0.558   4.042
  257    HB3  SER  34           HB3      SER  34 -11.628  -1.877   4.960
  258    HG   SER  34           HG       SER  34 -10.132  -2.153   3.278
  259    H    TYR  35           HN       TYR  35 -15.073  -3.469   3.562
  260    HA   TYR  35           HA       TYR  35 -16.449  -1.945   1.684
  261    HB2  TYR  35           HB2      TYR  35 -18.198  -3.278   2.123
  262    HB3  TYR  35           HB3      TYR  35 -16.990  -4.221   2.959
  263    HD1  TYR  35           HD1      TYR  35 -19.743  -1.773   3.476
  264    HD2  TYR  35           HD2      TYR  35 -17.190  -4.678   5.249
  265    HE1  TYR  35           HE1      TYR  35 -21.123  -1.735   5.514
  266    HE2  TYR  35           HE2      TYR  35 -18.553  -4.640   7.292
  267    HH   TYR  35           HH       TYR  35 -21.510  -2.694   7.506
  268    HA   PRO  36           HA       PRO  36 -18.148   0.789   5.264
  269    HB2  PRO  36           HB2      PRO  36 -16.064   0.912   7.303
  270    HB3  PRO  36           HB3      PRO  36 -17.777   0.527   7.482
  271    HG2  PRO  36           HG2      PRO  36 -15.829  -1.320   7.799
  272    HG3  PRO  36           HG3      PRO  36 -17.438  -1.724   7.174
  273    HD2  PRO  36           HD2      PRO  36 -14.875  -1.298   5.680
  274    HD3  PRO  36           HD3      PRO  36 -16.123  -2.539   5.444
  275    H    LYS  37           HN       LYS  37 -14.844   0.708   4.271
  276    HA   LYS  37           HA       LYS  37 -14.641   3.625   4.543
  277    HB2  LYS  37           HB2      LYS  37 -12.861   1.769   5.346
  278    HB3  LYS  37           HB3      LYS  37 -12.276   2.051   3.711
  279    HG2  LYS  37           HG2      LYS  37 -12.617   4.594   4.595
  280    HG3  LYS  37           HG3      LYS  37 -12.151   3.763   6.082
  281    HD2  LYS  37           HD2      LYS  37 -10.417   2.750   4.181
  282    HD3  LYS  37           HD3      LYS  37 -10.553   4.458   3.761
  283    HE2  LYS  37           HE2      LYS  37  -8.877   4.612   5.287
  284    HE3  LYS  37           HE3      LYS  37 -10.252   4.729   6.383
  285    HZ1  LYS  37           HZ1      LYS  37  -9.954   2.108   6.334
  286    HZ2  LYS  37           HZ2      LYS  37  -9.122   3.100   7.429
  287    HZ3  LYS  37           HZ3      LYS  37  -8.346   2.554   6.023
  288    H    GLY  38           HN       GLY  38 -14.928   1.073   2.263
  289    HA2  GLY  38           HA1      GLY  38 -15.230   1.150  -0.024
  290    HA3  GLY  38           HA2      GLY  38 -15.118   2.903   0.066
  291    H    THR  39           HN       THR  39 -12.647   0.842   1.374
  292    HA   THR  39           HA       THR  39 -10.818   1.785  -0.728
  293    HB   THR  39           HB       THR  39  -9.157   0.822   1.183
  294    HG1  THR  39           HG1      THR  39 -10.668   0.385   2.743
  295   HG21  THR  39          HG21      THR  39  -9.381   3.142   0.041
  296   HG22  THR  39          HG22      THR  39  -8.588   3.032   1.613
  297   HG23  THR  39          HG23      THR  39 -10.258   3.588   1.503
  298    H    ALA  40           HN       ALA  40  -9.401   0.344  -1.706
  299    HA   ALA  40           HA       ALA  40  -9.902  -2.508  -1.163
  300    HB1  ALA  40           HB1      ALA  40  -9.099  -1.923  -3.903
  301    HB2  ALA  40           HB2      ALA  40 -10.404  -2.943  -3.298
  302    HB3  ALA  40           HB3      ALA  40 -10.650  -1.205  -3.466
  303    H    GLN  41           HN       GLN  41  -8.123  -3.368  -0.347
  304    HA   GLN  41           HA       GLN  41  -5.523  -2.255  -1.152
  305    HB2  GLN  41           HB2      GLN  41  -6.528  -3.625   1.306
  306    HB3  GLN  41           HB3      GLN  41  -4.832  -3.819   0.885
  307    HG2  GLN  41           HG2      GLN  41  -4.940  -2.014   2.388
  308    HG3  GLN  41           HG3      GLN  41  -4.685  -1.309   0.794
  309   HE21  GLN  41          HE21      GLN  41  -7.277  -2.167   3.055
  310   HE22  GLN  41          HE22      GLN  41  -8.281  -0.814   2.675
  311    H    LEU  42           HN       LEU  42  -5.280  -3.349  -3.113
  312    HA   LEU  42           HA       LEU  42  -5.413  -6.261  -3.008
  313    HB2  LEU  42           HB2      LEU  42  -4.783  -5.831  -5.587
  314    HB3  LEU  42           HB3      LEU  42  -6.415  -5.926  -4.980
  315    HG   LEU  42           HG       LEU  42  -6.019  -4.110  -6.627
  316   HD11  LEU  42          HD11      LEU  42  -7.107  -2.299  -5.234
  317   HD12  LEU  42          HD12      LEU  42  -7.932  -3.854  -5.328
  318   HD13  LEU  42          HD13      LEU  42  -7.010  -3.431  -3.886
  319   HD21  LEU  42          HD21      LEU  42  -3.768  -3.458  -5.949
  320   HD22  LEU  42          HD22      LEU  42  -4.870  -2.083  -5.957
  321   HD23  LEU  42          HD23      LEU  42  -4.404  -2.832  -4.429
  322    H    ALA  43           HN       ALA  43  -3.659  -7.252  -2.360
  323    HA   ALA  43           HA       ALA  43  -1.028  -6.190  -2.924
  324    HB1  ALA  43           HB1      ALA  43  -2.148  -8.361  -1.287
  325    HB2  ALA  43           HB2      ALA  43  -0.578  -8.708  -2.013
  326    HB3  ALA  43           HB3      ALA  43  -0.777  -7.295  -0.974
  327    H    ILE  44           HN       ILE  44  -0.590  -6.233  -5.048
  328    HA   ILE  44           HA       ILE  44  -1.157  -8.689  -6.546
  329    HB   ILE  44           HB       ILE  44  -0.621  -7.224  -8.565
  330   HG12  ILE  44          HG12      ILE  44  -1.188  -4.940  -6.679
  331   HG13  ILE  44          HG13      ILE  44   0.460  -5.443  -7.047
  332   HG21  ILE  44          HG21      ILE  44  -2.919  -5.903  -8.061
  333   HG22  ILE  44          HG22      ILE  44  -2.846  -7.602  -8.525
  334   HG23  ILE  44          HG23      ILE  44  -2.998  -7.157  -6.825
  335   HD11  ILE  44          HD11      ILE  44   0.411  -4.154  -8.838
  336   HD12  ILE  44          HD12      ILE  44  -0.870  -5.164  -9.510
  337   HD13  ILE  44          HD13      ILE  44  -1.280  -3.752  -8.536
  338    H    VAL  45           HN       VAL  45   0.460  -9.360  -8.142
  339    HA   VAL  45           HA       VAL  45   3.097  -9.397  -6.963
  340    HB   VAL  45           HB       VAL  45   2.444 -10.570  -9.654
  341   HG11  VAL  45          HG11      VAL  45   4.610 -11.085  -9.350
  342   HG12  VAL  45          HG12      VAL  45   4.527 -10.862  -7.602
  343   HG13  VAL  45          HG13      VAL  45   3.967 -12.369  -8.326
  344   HG21  VAL  45          HG21      VAL  45   1.648 -12.608  -8.580
  345   HG22  VAL  45          HG22      VAL  45   1.797 -11.848  -6.995
  346   HG23  VAL  45          HG23      VAL  45   0.616 -11.241  -8.156
  347    HA   PRO  46           HA       PRO  46   4.741  -5.840  -9.095
  348    HB2  PRO  46           HB2      PRO  46   7.201  -7.528  -8.960
  349    HB3  PRO  46           HB3      PRO  46   6.974  -5.831  -8.521
  350    HG2  PRO  46           HG2      PRO  46   7.123  -7.701  -6.638
  351    HG3  PRO  46           HG3      PRO  46   5.979  -6.354  -6.489
  352    HD2  PRO  46           HD2      PRO  46   5.473  -9.202  -7.200
  353    HD3  PRO  46           HD3      PRO  46   4.457  -8.067  -6.290
  354    H    GLY  47           HN       GLY  47   4.079  -5.740 -11.126
  355    HA2  GLY  47           HA1      GLY  47   5.265  -6.217 -13.413
  356    HA3  GLY  47           HA2      GLY  47   4.761  -7.862 -13.020
  357    H    THR  48           HN       THR  48   2.355  -7.310 -11.777
  358    HA   THR  48           HA       THR  48   0.610  -6.743 -13.963
  359    HB   THR  48           HB       THR  48  -0.543  -6.654 -11.255
  360    HG1  THR  48           HG1      THR  48   1.053  -8.140 -10.773
  361   HG21  THR  48          HG21      THR  48  -2.278  -7.243 -12.522
  362   HG22  THR  48          HG22      THR  48  -1.522  -8.823 -12.737
  363   HG23  THR  48          HG23      THR  48  -1.227  -7.536 -13.907
  364    H    SER  49           HN       SER  49  -0.371  -4.894 -14.490
  365    HA   SER  49           HA       SER  49   0.555  -2.501 -13.221
  366    HB2  SER  49           HB2      SER  49  -1.535  -2.256 -15.267
  367    HB3  SER  49           HB3      SER  49   0.068  -1.520 -15.200
  368    HG   SER  49           HG       SER  49   0.476  -2.925 -16.721
  369    HA   PRO  50           HA       PRO  50  -3.060  -2.136 -10.600
  370    HB2  PRO  50           HB2      PRO  50  -2.450   0.316  -9.577
  371    HB3  PRO  50           HB3      PRO  50  -1.711  -1.183  -9.001
  372    HG2  PRO  50           HG2      PRO  50  -0.632   0.849 -10.917
  373    HG3  PRO  50           HG3      PRO  50   0.200  -0.010  -9.608
  374    HD2  PRO  50           HD2      PRO  50   0.430  -0.738 -12.208
  375    HD3  PRO  50           HD3      PRO  50   0.507  -1.910 -10.876
  376    H    ASP  51           HN       ASP  51  -2.044  -0.016 -13.121
  377    HA   ASP  51           HA       ASP  51  -4.359   1.653 -13.152
  378    HB2  ASP  51           HB2      ASP  51  -2.862   2.717 -14.458
  379    HB3  ASP  51           HB3      ASP  51  -1.949   1.254 -14.759
  380    H    ALA  52           HN       ALA  52  -3.537  -1.486 -14.154
  381    HA   ALA  52           HA       ALA  52  -5.586  -1.785 -16.131
  382    HB1  ALA  52           HB1      ALA  52  -4.230  -3.465 -16.680
  383    HB2  ALA  52           HB2      ALA  52  -3.392  -3.368 -15.132
  384    HB3  ALA  52           HB3      ALA  52  -4.858  -4.340 -15.284
  385    H    LEU  53           HN       LEU  53  -5.211  -2.517 -12.730
  386    HA   LEU  53           HA       LEU  53  -7.690  -3.863 -12.385
  387    HB2  LEU  53           HB2      LEU  53  -6.295  -2.228 -10.275
  388    HB3  LEU  53           HB3      LEU  53  -7.326  -3.628 -10.054
  389    HG   LEU  53           HG       LEU  53  -4.708  -3.879 -11.493
  390   HD11  LEU  53          HD11      LEU  53  -3.470  -3.867  -9.618
  391   HD12  LEU  53          HD12      LEU  53  -4.774  -2.860  -8.985
  392   HD13  LEU  53          HD13      LEU  53  -4.750  -4.591  -8.644
  393   HD21  LEU  53          HD21      LEU  53  -6.647  -5.646 -11.309
  394   HD22  LEU  53          HD22      LEU  53  -4.954  -6.128 -11.175
  395   HD23  LEU  53          HD23      LEU  53  -5.931  -5.930  -9.721
  396    H    THR  54           HN       THR  54  -6.610  -0.532 -11.999
  397    HA   THR  54           HA       THR  54  -8.990   0.666 -11.217
  398    HB   THR  54           HB       THR  54  -6.908   1.871 -13.059
  399    HG1  THR  54           HG1      THR  54  -5.879   1.097 -11.211
  400   HG21  THR  54          HG21      THR  54  -8.712   3.372 -12.979
  401   HG22  THR  54          HG22      THR  54  -7.607   3.960 -11.737
  402   HG23  THR  54          HG23      THR  54  -9.034   3.031 -11.278
  403    H    ALA  55           HN       ALA  55  -7.700   0.173 -14.498
  404    HA   ALA  55           HA       ALA  55  -9.949   1.284 -15.812
  405    HB1  ALA  55           HB1      ALA  55  -7.502   0.685 -16.653
  406    HB2  ALA  55           HB2      ALA  55  -8.327  -0.774 -17.204
  407    HB3  ALA  55           HB3      ALA  55  -8.869   0.809 -17.762
  408    H    ALA  56           HN       ALA  56  -9.201  -1.939 -14.672
  409    HA   ALA  56           HA       ALA  56 -11.298  -3.294 -15.991
  410    HB1  ALA  56           HB1      ALA  56 -10.063  -4.932 -15.094
  411    HB2  ALA  56           HB2      ALA  56  -9.430  -3.878 -13.829
  412    HB3  ALA  56           HB3      ALA  56 -10.998  -4.657 -13.624
  413    H    VAL  57           HN       VAL  57 -11.138  -1.783 -12.769
  414    HA   VAL  57           HA       VAL  57 -13.827  -2.401 -12.097
  415    HB   VAL  57           HB       VAL  57 -12.109  -0.199 -10.975
  416   HG11  VAL  57          HG11      VAL  57 -14.817  -0.760 -10.559
  417   HG12  VAL  57          HG12      VAL  57 -13.977  -1.385  -9.139
  418   HG13  VAL  57          HG13      VAL  57 -13.786   0.307  -9.603
  419   HG21  VAL  57          HG21      VAL  57 -11.686  -2.946 -10.861
  420   HG22  VAL  57          HG22      VAL  57 -10.940  -1.716  -9.840
  421   HG23  VAL  57          HG23      VAL  57 -12.411  -2.533  -9.310
  422    H    ALA  58           HN       ALA  58 -12.295   0.532 -13.444
  423    HA   ALA  58           HA       ALA  58 -14.672   2.042 -13.596
  424    HB1  ALA  58           HB1      ALA  58 -13.474   3.494 -15.111
  425    HB2  ALA  58           HB2      ALA  58 -12.417   3.016 -13.781
  426    HB3  ALA  58           HB3      ALA  58 -12.240   2.258 -15.366
  427    H    GLY  59           HN       GLY  59 -13.223  -0.312 -15.734
  428    HA2  GLY  59           HA1      GLY  59 -14.928   0.192 -17.961
  429    HA3  GLY  59           HA2      GLY  59 -13.928  -1.232 -17.721
  430    H    LEU  60           HN       LEU  60 -15.354  -1.512 -15.019
  431    HA   LEU  60           HA       LEU  60 -17.468  -3.203 -16.032
  432    HB2  LEU  60           HB2      LEU  60 -15.869  -3.023 -13.629
  433    HB3  LEU  60           HB3      LEU  60 -17.560  -3.282 -13.260
  434    HG   LEU  60           HG       LEU  60 -15.916  -5.030 -15.097
  435   HD11  LEU  60          HD11      LEU  60 -15.232  -6.200 -13.339
  436   HD12  LEU  60          HD12      LEU  60 -15.818  -4.883 -12.321
  437   HD13  LEU  60          HD13      LEU  60 -16.862  -6.261 -12.667
  438   HD21  LEU  60          HD21      LEU  60 -17.924  -6.580 -14.572
  439   HD22  LEU  60          HD22      LEU  60 -18.757  -5.082 -14.162
  440   HD23  LEU  60          HD23      LEU  60 -18.112  -5.315 -15.786
  441    H    GLY  61           HN       GLY  61 -17.500  -0.140 -15.870
  442    HA2  GLY  61           HA1      GLY  61 -19.411   1.203 -16.026
  443    HA3  GLY  61           HA2      GLY  61 -20.312  -0.014 -15.131
  444    H    TYR  62           HN       TYR  62 -17.828   0.088 -13.237
  445    HA   TYR  62           HA       TYR  62 -18.998   2.128 -11.520
  446    HB2  TYR  62           HB2      TYR  62 -16.694   0.398 -10.688
  447    HB3  TYR  62           HB3      TYR  62 -18.001   1.053  -9.711
  448    HD1  TYR  62           HD2      TYR  62 -20.423   0.162 -10.841
  449    HD2  TYR  62           HD1      TYR  62 -16.708  -1.908 -10.687
  450    HE1  TYR  62           HE2      TYR  62 -21.618  -1.983 -10.981
  451    HE2  TYR  62           HE1      TYR  62 -17.894  -4.055 -10.827
  452    HH   TYR  62           HH       TYR  62 -20.546  -4.730 -10.084
  453    H    LYS  63           HN       LYS  63 -16.990   3.045 -10.019
  454    HA   LYS  63           HA       LYS  63 -15.099   4.204 -11.952
  455    HB2  LYS  63           HB2      LYS  63 -16.900   5.488 -10.032
  456    HB3  LYS  63           HB3      LYS  63 -15.233   6.028  -9.888
  457    HG2  LYS  63           HG2      LYS  63 -16.370   7.505 -11.376
  458    HG3  LYS  63           HG3      LYS  63 -15.255   6.522 -12.329
  459    HD2  LYS  63           HD2      LYS  63 -16.928   5.726 -13.569
  460    HD3  LYS  63           HD3      LYS  63 -17.816   5.222 -12.129
  461    HE2  LYS  63           HE2      LYS  63 -17.954   8.064 -12.378
  462    HE3  LYS  63           HE3      LYS  63 -18.424   7.327 -13.910
  463    HZ1  LYS  63           HZ1      LYS  63 -19.755   5.804 -12.156
  464    HZ2  LYS  63           HZ2      LYS  63 -20.407   7.175 -12.911
  465    HZ3  LYS  63           HZ3      LYS  63 -19.767   7.294 -11.346
  466    H    ALA  64           HN       ALA  64 -13.079   3.587 -11.546
  467    HA   ALA  64           HA       ALA  64 -12.392   2.839  -8.794
  468    HB1  ALA  64           HB1      ALA  64 -11.843   1.036 -10.138
  469    HB2  ALA  64           HB2      ALA  64 -11.286   2.061 -11.460
  470    HB3  ALA  64           HB3      ALA  64 -10.307   1.891 -10.003
  471    H    THR  65           HN       THR  65 -11.148   4.087  -7.626
  472    HA   THR  65           HA       THR  65  -9.244   5.883  -8.972
  473    HB   THR  65           HB       THR  65 -10.381   6.678  -6.318
  474    HG1  THR  65           HG1      THR  65 -12.313   6.394  -7.360
  475   HG21  THR  65          HG21      THR  65  -8.761   8.182  -7.013
  476   HG22  THR  65          HG22      THR  65 -10.232   8.949  -7.611
  477   HG23  THR  65          HG23      THR  65  -9.202   8.036  -8.714
  478    H    LEU  66           HN       LEU  66  -7.717   6.657  -6.840
  479    HA   LEU  66           HA       LEU  66  -7.221   4.361  -5.153
  480    HB2  LEU  66           HB2      LEU  66  -4.778   4.310  -5.878
  481    HB3  LEU  66           HB3      LEU  66  -5.952   3.553  -6.937
  482    HG   LEU  66           HG       LEU  66  -5.511   6.324  -7.670
  483   HD11  LEU  66          HD11      LEU  66  -3.313   6.284  -7.003
  484   HD12  LEU  66          HD12      LEU  66  -3.153   4.548  -7.266
  485   HD13  LEU  66          HD13      LEU  66  -3.185   5.648  -8.643
  486   HD21  LEU  66          HD21      LEU  66  -6.472   5.083  -9.331
  487   HD22  LEU  66          HD22      LEU  66  -4.778   4.958  -9.805
  488   HD23  LEU  66          HD23      LEU  66  -5.550   3.634  -8.934
  489    H    ALA  67           HN       ALA  67  -5.904   4.780  -3.413
  490    HA   ALA  67           HA       ALA  67  -4.723   7.421  -3.109
  491    HB1  ALA  67           HB1      ALA  67  -6.106   7.147  -0.711
  492    HB2  ALA  67           HB2      ALA  67  -6.453   8.295  -2.003
  493    HB3  ALA  67           HB3      ALA  67  -7.289   6.742  -1.955
  494    H    ASP  68           HN       ASP  68  -2.794   6.230  -3.016
  495    HA   ASP  68           HA       ASP  68  -2.424   3.973  -1.396
  496    HB2  ASP  68           HB2      ASP  68  -0.950   5.238  -3.354
  497    HB3  ASP  68           HB3      ASP  68   0.026   5.471  -1.905
  498    H    ALA  69           HN       ALA  69  -1.941   7.382  -0.809
  499    HA   ALA  69           HA       ALA  69  -1.655   6.773   2.035
  500    HB1  ALA  69           HB1      ALA  69   0.365   8.091   0.342
  501    HB2  ALA  69           HB2      ALA  69   0.017   8.887   1.878
  502    HB3  ALA  69           HB3      ALA  69   0.552   7.207   1.858
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1   0.112  -4.219  -0.627
    2    H2   MET   1           H2       MET   1  -0.107  -3.362  -2.072
    3    H3   MET   1           H3       MET   1  -1.243  -3.219  -0.820
    4    HA   MET   1           HA       MET   1   0.551  -2.298   0.602
    5    HB2  MET   1           HB2      MET   1   2.561  -1.502  -0.401
    6    HB3  MET   1           HB3      MET   1   2.384  -3.182  -0.884
    7    HG2  MET   1           HG2      MET   1   1.576  -0.860  -2.616
    8    HG3  MET   1           HG3      MET   1   3.163  -1.624  -2.676
    9    HE1  MET   1           HE1      MET   1   1.569  -1.646  -5.522
   10    HE2  MET   1           HE2      MET   1   3.177  -2.128  -4.980
   11    HE3  MET   1           HE3      MET   1   2.159  -3.275  -5.852
   12    H    THR   2           HN       THR   2  -1.022  -1.651  -2.420
   13    HA   THR   2           HA       THR   2  -1.339   1.161  -1.637
   14    HB   THR   2           HB       THR   2  -2.407   0.591  -4.246
   15    HG1  THR   2           HG1      THR   2  -0.047   0.189  -5.006
   16   HG21  THR   2          HG21      THR   2  -1.749   2.740  -4.232
   17   HG22  THR   2          HG22      THR   2  -0.142   2.116  -4.600
   18   HG23  THR   2          HG23      THR   2  -0.590   2.466  -2.930
   19    H    HIS   3           HN       HIS   3  -3.458   2.071  -1.631
   20    HA   HIS   3           HA       HIS   3  -5.587   0.040  -1.453
   21    HB2  HIS   3           HB2      HIS   3  -6.538   2.328  -0.142
   22    HB3  HIS   3           HB3      HIS   3  -6.029   0.819   0.600
   23    HD1  HIS   3           HD1      HIS   3  -3.600   0.768   1.616
   24    HD2  HIS   3           HD2      HIS   3  -4.887   4.497   0.311
   25    HE1  HIS   3           HE1      HIS   3  -1.957   2.417   2.555
   26    HE2  HIS   3           HE2      HIS   3  -2.746   4.674   1.760
   27    H    LEU   4           HN       LEU   4  -6.878   0.099  -3.116
   28    HA   LEU   4           HA       LEU   4  -7.121   2.469  -4.754
   29    HB2  LEU   4           HB2      LEU   4  -7.456  -0.327  -5.134
   30    HB3  LEU   4           HB3      LEU   4  -8.996   0.436  -5.478
   31    HG   LEU   4           HG       LEU   4  -7.664   2.020  -7.002
   32   HD11  LEU   4          HD11      LEU   4  -5.584   1.197  -7.868
   33   HD12  LEU   4          HD12      LEU   4  -5.452   1.352  -6.115
   34   HD13  LEU   4          HD13      LEU   4  -5.676  -0.237  -6.843
   35   HD21  LEU   4          HD21      LEU   4  -7.802  -0.875  -7.817
   36   HD22  LEU   4          HD22      LEU   4  -9.207   0.185  -7.709
   37   HD23  LEU   4          HD23      LEU   4  -7.916   0.545  -8.855
   38    H    LYS   5           HN       LYS   5  -9.192   3.433  -5.238
   39    HA   LYS   5           HA       LYS   5 -10.887   3.391  -2.836
   40    HB2  LYS   5           HB2      LYS   5  -9.709   5.527  -4.366
   41    HB3  LYS   5           HB3      LYS   5 -11.453   5.720  -4.280
   42    HG2  LYS   5           HG2      LYS   5 -10.016   5.075  -1.768
   43    HG3  LYS   5           HG3      LYS   5  -9.821   6.697  -2.438
   44    HD2  LYS   5           HD2      LYS   5 -12.466   6.496  -2.654
   45    HD3  LYS   5           HD3      LYS   5 -12.229   5.379  -1.307
   46    HE2  LYS   5           HE2      LYS   5 -12.624   7.520  -0.366
   47    HE3  LYS   5           HE3      LYS   5 -10.905   7.188  -0.178
   48    HZ1  LYS   5           HZ1      LYS   5 -10.386   8.950  -1.405
   49    HZ2  LYS   5           HZ2      LYS   5 -12.015   9.421  -1.299
   50    HZ3  LYS   5           HZ3      LYS   5 -11.474   8.529  -2.637
   51    H    ILE   6           HN       ILE   6 -12.970   3.048  -2.957
   52    HA   ILE   6           HA       ILE   6 -14.106   2.174  -5.479
   53    HB   ILE   6           HB       ILE   6 -15.247   2.210  -2.676
   54   HG12  ILE   6          HG12      ILE   6 -13.456   0.625  -2.808
   55   HG13  ILE   6          HG13      ILE   6 -14.962  -0.284  -2.871
   56   HG21  ILE   6          HG21      ILE   6 -16.641   2.033  -5.083
   57   HG22  ILE   6          HG22      ILE   6 -16.548   0.382  -4.470
   58   HG23  ILE   6          HG23      ILE   6 -17.240   1.658  -3.468
   59   HD11  ILE   6          HD11      ILE   6 -13.262  -1.115  -4.441
   60   HD12  ILE   6          HD12      ILE   6 -14.730  -0.574  -5.254
   61   HD13  ILE   6          HD13      ILE   6 -13.289   0.442  -5.267
   62    H    THR   7           HN       THR   7 -15.214   3.522  -6.776
   63    HA   THR   7           HA       THR   7 -16.512   5.860  -5.544
   64    HB   THR   7           HB       THR   7 -15.746   6.582  -8.172
   65    HG1  THR   7           HG1      THR   7 -14.097   4.801  -7.525
   66   HG21  THR   7          HG21      THR   7 -14.597   7.447  -5.516
   67   HG22  THR   7          HG22      THR   7 -16.073   8.079  -6.242
   68   HG23  THR   7          HG23      THR   7 -14.522   8.347  -7.032
   69    H    GLY   8           HN       GLY   8 -18.374   6.643  -6.621
   70    HA2  GLY   8           HA1      GLY   8 -20.169   6.561  -8.100
   71    HA3  GLY   8           HA2      GLY   8 -19.383   5.237  -8.949
   72    H    MET   9           HN       MET   9 -18.999   3.553  -6.718
   73    HA   MET   9           HA       MET   9 -21.638   2.395  -6.563
   74    HB2  MET   9           HB2      MET   9 -19.070   1.422  -5.314
   75    HB3  MET   9           HB3      MET   9 -20.546   0.498  -5.557
   76    HG2  MET   9           HG2      MET   9 -20.254   0.435  -7.875
   77    HG3  MET   9           HG3      MET   9 -19.028   1.700  -7.843
   78    HE1  MET   9           HE1      MET   9 -15.795  -0.042  -7.524
   79    HE2  MET   9           HE2      MET   9 -16.767   0.944  -8.618
   80    HE3  MET   9           HE3      MET   9 -16.609   1.403  -6.922
   81    H    THR  10           HN       THR  10 -22.409   1.523  -4.447
   82    HA   THR  10           HA       THR  10 -22.369   3.613  -2.458
   83    HB   THR  10           HB       THR  10 -23.767   1.190  -1.686
   84    HG1  THR  10           HG1      THR  10 -25.350   1.410  -3.430
   85   HG21  THR  10          HG21      THR  10 -24.047   3.995  -1.511
   86   HG22  THR  10          HG22      THR  10 -25.047   2.757  -0.752
   87   HG23  THR  10          HG23      THR  10 -25.478   3.388  -2.342
   88    H    CYS  11           HN       CYS  11 -22.127   0.071  -2.105
   89    HA   CYS  11           HA       CYS  11 -19.729  -0.071  -0.702
   90    HB2  CYS  11           HB2      CYS  11 -20.622  -0.303   1.617
   91    HB3  CYS  11           HB3      CYS  11 -20.673   1.336   0.986
   92    HG   CYS  11           HG       CYS  11 -23.081   1.612   1.860
   93    H    ASP  12           HN       ASP  12 -19.623  -2.061   0.687
   94    HA   ASP  12           HA       ASP  12 -19.828  -4.268   1.013
   95    HB2  ASP  12           HB2      ASP  12 -21.893  -3.549   2.135
   96    HB3  ASP  12           HB3      ASP  12 -22.776  -3.732   0.623
   97    H    SER  13           HN       SER  13 -22.647  -4.524  -1.031
   98    HA   SER  13           HA       SER  13 -21.695  -6.691  -2.462
   99    HB2  SER  13           HB2      SER  13 -23.509  -5.191  -4.096
  100    HB3  SER  13           HB3      SER  13 -23.825  -6.654  -3.158
  101    HG   SER  13           HG       SER  13 -25.049  -5.363  -2.029
  102    H    CYS  14           HN       CYS  14 -21.385  -3.271  -3.059
  103    HA   CYS  14           HA       CYS  14 -20.303  -3.404  -5.655
  104    HB2  CYS  14           HB2      CYS  14 -19.639  -1.294  -3.612
  105    HB3  CYS  14           HB3      CYS  14 -19.747  -1.120  -5.355
  106    HG   CYS  14           HG       CYS  14 -22.660  -1.882  -5.025
  107    H    ALA  15           HN       ALA  15 -18.817  -3.339  -2.440
  108    HA   ALA  15           HA       ALA  15 -16.136  -3.306  -3.427
  109    HB1  ALA  15           HB1      ALA  15 -15.648  -4.082  -1.015
  110    HB2  ALA  15           HB2      ALA  15 -16.353  -2.484  -1.256
  111    HB3  ALA  15           HB3      ALA  15 -17.372  -3.830  -0.744
  112    H    ALA  16           HN       ALA  16 -18.498  -5.745  -2.803
  113    HA   ALA  16           HA       ALA  16 -16.719  -7.958  -2.547
  114    HB1  ALA  16           HB1      ALA  16 -19.119  -7.854  -1.755
  115    HB2  ALA  16           HB2      ALA  16 -19.588  -8.103  -3.436
  116    HB3  ALA  16           HB3      ALA  16 -18.643  -9.330  -2.594
  117    H    HIS  17           HN       HIS  17 -18.632  -6.636  -5.228
  118    HA   HIS  17           HA       HIS  17 -17.794  -8.610  -7.090
  119    HB2  HIS  17           HB2      HIS  17 -19.327  -6.069  -7.189
  120    HB3  HIS  17           HB3      HIS  17 -18.632  -6.652  -8.692
  121    HD1  HIS  17           HD1      HIS  17 -19.148  -9.620  -8.607
  122    HD2  HIS  17           HD2      HIS  17 -21.911  -6.811  -7.247
  123    HE1  HIS  17           HE1      HIS  17 -21.383 -10.778  -8.653
  124    HE2  HIS  17           HE2      HIS  17 -23.013  -9.106  -7.701
  125    H    VAL  18           HN       VAL  18 -16.631  -5.418  -6.170
  126    HA   VAL  18           HA       VAL  18 -14.699  -5.147  -8.212
  127    HB   VAL  18           HB       VAL  18 -14.853  -3.992  -5.427
  128   HG11  VAL  18          HG11      VAL  18 -12.925  -2.853  -7.366
  129   HG12  VAL  18          HG12      VAL  18 -12.851  -2.931  -5.607
  130   HG13  VAL  18          HG13      VAL  18 -12.460  -4.356  -6.570
  131   HG21  VAL  18          HG21      VAL  18 -16.088  -3.341  -7.833
  132   HG22  VAL  18          HG22      VAL  18 -16.016  -2.353  -6.375
  133   HG23  VAL  18          HG23      VAL  18 -14.806  -2.146  -7.640
  134    H    LYS  19           HN       LYS  19 -14.515  -6.467  -4.915
  135    HA   LYS  19           HA       LYS  19 -11.836  -7.269  -4.982
  136    HB2  LYS  19           HB2      LYS  19 -13.103  -7.250  -2.908
  137    HB3  LYS  19           HB3      LYS  19 -14.184  -8.493  -3.519
  138    HG2  LYS  19           HG2      LYS  19 -12.337 -10.089  -3.561
  139    HG3  LYS  19           HG3      LYS  19 -11.244  -8.839  -2.963
  140    HD2  LYS  19           HD2      LYS  19 -11.775  -9.486  -0.903
  141    HD3  LYS  19           HD3      LYS  19 -13.387  -8.829  -1.185
  142    HE2  LYS  19           HE2      LYS  19 -13.734 -11.041  -0.475
  143    HE3  LYS  19           HE3      LYS  19 -13.963 -11.071  -2.224
  144    HZ1  LYS  19           HZ1      LYS  19 -11.991 -12.186  -2.552
  145    HZ2  LYS  19           HZ2      LYS  19 -12.517 -12.872  -1.093
  146    HZ3  LYS  19           HZ3      LYS  19 -11.314 -11.678  -1.083
  147    H    GLU  20           HN       GLU  20 -14.776  -8.935  -6.002
  148    HA   GLU  20           HA       GLU  20 -13.584 -11.373  -6.713
  149    HB2  GLU  20           HB2      GLU  20 -15.920 -11.406  -6.530
  150    HB3  GLU  20           HB3      GLU  20 -16.109  -9.963  -7.515
  151    HG2  GLU  20           HG2      GLU  20 -15.372 -11.291  -9.484
  152    HG3  GLU  20           HG3      GLU  20 -15.382 -12.724  -8.457
  153    H    ALA  21           HN       ALA  21 -14.197  -8.443  -8.593
  154    HA   ALA  21           HA       ALA  21 -13.270  -9.438 -11.067
  155    HB1  ALA  21           HB1      ALA  21 -12.741  -6.703 -11.065
  156    HB2  ALA  21           HB2      ALA  21 -14.203  -7.498 -11.644
  157    HB3  ALA  21           HB3      ALA  21 -14.122  -6.897  -9.986
  158    H    LEU  22           HN       LEU  22 -11.706  -7.939  -8.328
  159    HA   LEU  22           HA       LEU  22  -9.148  -7.594  -9.504
  160    HB2  LEU  22           HB2      LEU  22 -10.160  -7.725  -6.683
  161    HB3  LEU  22           HB3      LEU  22  -8.437  -7.701  -7.002
  162    HG   LEU  22           HG       LEU  22 -10.262  -5.575  -8.095
  163   HD11  LEU  22          HD11      LEU  22  -9.038  -4.375  -6.001
  164   HD12  LEU  22          HD12      LEU  22 -10.681  -5.017  -5.958
  165   HD13  LEU  22          HD13      LEU  22  -9.341  -5.979  -5.334
  166   HD21  LEU  22          HD21      LEU  22  -7.930  -5.926  -8.989
  167   HD22  LEU  22          HD22      LEU  22  -8.275  -4.316  -8.355
  168   HD23  LEU  22          HD23      LEU  22  -7.340  -5.461  -7.393
  169    H    GLU  23           HN       GLU  23 -10.591 -10.134  -7.504
  170    HA   GLU  23           HA       GLU  23  -8.213 -11.714  -7.431
  171    HB2  GLU  23           HB2      GLU  23 -11.071 -12.213  -6.643
  172    HB3  GLU  23           HB3      GLU  23  -9.865 -13.494  -6.578
  173    HG2  GLU  23           HG2      GLU  23  -8.509 -12.141  -5.062
  174    HG3  GLU  23           HG3      GLU  23  -9.721 -10.863  -5.122
  175    H    LYS  24           HN       LYS  24 -10.670 -11.297  -9.745
  176    HA   LYS  24           HA       LYS  24 -10.427 -13.831 -11.041
  177    HB2  LYS  24           HB2      LYS  24 -11.655 -11.193 -11.664
  178    HB3  LYS  24           HB3      LYS  24 -11.277 -12.237 -13.026
  179    HG2  LYS  24           HG2      LYS  24 -12.740 -13.443 -10.750
  180    HG3  LYS  24           HG3      LYS  24 -13.615 -12.309 -11.782
  181    HD2  LYS  24           HD2      LYS  24 -12.038 -14.234 -13.297
  182    HD3  LYS  24           HD3      LYS  24 -13.244 -15.002 -12.260
  183    HE2  LYS  24           HE2      LYS  24 -14.963 -14.243 -13.494
  184    HE3  LYS  24           HE3      LYS  24 -14.220 -12.663 -13.732
  185    HZ1  LYS  24           HZ1      LYS  24 -14.425 -13.823 -15.823
  186    HZ2  LYS  24           HZ2      LYS  24 -13.558 -15.148 -15.216
  187    HZ3  LYS  24           HZ3      LYS  24 -12.784 -13.655 -15.426
  188    H    VAL  25           HN       VAL  25  -8.622 -10.922 -10.938
  189    HA   VAL  25           HA       VAL  25  -6.978 -11.574 -13.238
  190    HB   VAL  25           HB       VAL  25  -6.744  -9.417 -11.131
  191   HG11  VAL  25          HG11      VAL  25  -4.644  -9.068 -11.783
  192   HG12  VAL  25          HG12      VAL  25  -4.756 -10.402 -12.931
  193   HG13  VAL  25          HG13      VAL  25  -5.218  -8.772 -13.423
  194   HG21  VAL  25          HG21      VAL  25  -8.612  -9.385 -12.901
  195   HG22  VAL  25          HG22      VAL  25  -7.644  -7.930 -12.665
  196   HG23  VAL  25          HG23      VAL  25  -7.322  -8.991 -14.036
  197    HA   PRO  26           HA       PRO  26  -4.618 -14.395 -10.694
  198    HB2  PRO  26           HB2      PRO  26  -2.637 -14.867 -12.527
  199    HB3  PRO  26           HB3      PRO  26  -4.217 -15.658 -12.552
  200    HG2  PRO  26           HG2      PRO  26  -3.249 -13.314 -14.130
  201    HG3  PRO  26           HG3      PRO  26  -4.228 -14.693 -14.659
  202    HD2  PRO  26           HD2      PRO  26  -5.321 -12.291 -14.129
  203    HD3  PRO  26           HD3      PRO  26  -6.176 -13.808 -13.777
  204    H    GLY  27           HN       GLY  27  -3.422 -11.461 -12.095
  205    HA2  GLY  27           HA1      GLY  27  -0.849 -11.474 -10.867
  206    HA3  GLY  27           HA2      GLY  27  -1.669 -10.071 -11.538
  207    H    VAL  28           HN       VAL  28  -4.018 -10.827  -9.718
  208    HA   VAL  28           HA       VAL  28  -3.068  -9.321  -7.417
  209    HB   VAL  28           HB       VAL  28  -5.852 -10.237  -8.160
  210   HG11  VAL  28          HG11      VAL  28  -6.496  -8.458  -6.440
  211   HG12  VAL  28          HG12      VAL  28  -5.872  -9.989  -5.824
  212   HG13  VAL  28          HG13      VAL  28  -4.826  -8.569  -5.881
  213   HG21  VAL  28          HG21      VAL  28  -5.537  -8.609  -9.704
  214   HG22  VAL  28          HG22      VAL  28  -5.968  -7.574  -8.342
  215   HG23  VAL  28          HG23      VAL  28  -4.273  -7.810  -8.768
  216    H    GLN  29           HN       GLN  29  -2.196 -10.452  -5.816
  217    HA   GLN  29           HA       GLN  29  -2.740 -13.264  -5.498
  218    HB2  GLN  29           HB2      GLN  29  -1.056 -11.438  -3.777
  219    HB3  GLN  29           HB3      GLN  29  -1.035 -13.196  -3.769
  220    HG2  GLN  29           HG2      GLN  29  -0.233 -13.169  -6.096
  221    HG3  GLN  29           HG3      GLN  29  -0.190 -11.407  -6.035
  222   HE21  GLN  29          HE21      GLN  29   1.671 -14.048  -5.869
  223   HE22  GLN  29          HE22      GLN  29   2.957 -13.456  -4.867
  224    H    SER  30           HN       SER  30  -3.477 -10.264  -3.794
  225    HA   SER  30           HA       SER  30  -5.668 -11.605  -2.446
  226    HB2  SER  30           HB2      SER  30  -4.425 -10.067  -0.404
  227    HB3  SER  30           HB3      SER  30  -4.677 -11.812  -0.443
  228    HG   SER  30           HG       SER  30  -2.637 -11.388  -1.997
  229    H    ALA  31           HN       ALA  31  -7.362 -10.278  -2.212
  230    HA   ALA  31           HA       ALA  31  -6.915  -7.405  -2.667
  231    HB1  ALA  31           HB1      ALA  31  -8.119  -8.349  -4.525
  232    HB2  ALA  31           HB2      ALA  31  -9.276  -9.118  -3.439
  233    HB3  ALA  31           HB3      ALA  31  -9.229  -7.361  -3.576
  234    H    LEU  32           HN       LEU  32  -6.774  -6.744  -0.559
  235    HA   LEU  32           HA       LEU  32  -8.719  -7.636   1.393
  236    HB2  LEU  32           HB2      LEU  32  -6.390  -5.722   1.526
  237    HB3  LEU  32           HB3      LEU  32  -7.474  -5.992   2.876
  238    HG   LEU  32           HG       LEU  32  -6.656  -8.546   2.091
  239   HD11  LEU  32          HD11      LEU  32  -4.672  -8.347   1.124
  240   HD12  LEU  32          HD12      LEU  32  -4.677  -6.598   1.351
  241   HD13  LEU  32          HD13      LEU  32  -4.066  -7.651   2.627
  242   HD21  LEU  32          HD21      LEU  32  -6.994  -8.213   4.340
  243   HD22  LEU  32          HD22      LEU  32  -5.231  -8.226   4.256
  244   HD23  LEU  32          HD23      LEU  32  -6.097  -6.693   4.359
  245    H    VAL  33           HN       VAL  33 -10.480  -6.772   0.007
  246    HA   VAL  33           HA       VAL  33 -10.783  -3.941  -0.213
  247    HB   VAL  33           HB       VAL  33 -11.847  -5.754  -1.702
  248   HG11  VAL  33          HG11      VAL  33 -12.937  -7.077   0.001
  249   HG12  VAL  33          HG12      VAL  33 -13.887  -5.682   0.514
  250   HG13  VAL  33          HG13      VAL  33 -14.145  -6.385  -1.082
  251   HG21  VAL  33          HG21      VAL  33 -12.411  -3.121  -1.268
  252   HG22  VAL  33          HG22      VAL  33 -13.061  -4.102  -2.581
  253   HG23  VAL  33          HG23      VAL  33 -13.997  -3.877  -1.105
  254    H    SER  34           HN       SER  34 -12.067  -2.583   0.944
  255    HA   SER  34           HA       SER  34 -13.168  -3.631   3.468
  256    HB2  SER  34           HB2      SER  34 -12.161  -0.830   3.377
  257    HB3  SER  34           HB3      SER  34 -12.144  -1.990   4.707
  258    HG   SER  34           HG       SER  34 -10.596  -2.940   2.771
  259    H    TYR  35           HN       TYR  35 -15.273  -3.709   2.751
  260    HA   TYR  35           HA       TYR  35 -16.501  -1.789   1.182
  261    HB2  TYR  35           HB2      TYR  35 -18.497  -2.934   1.519
  262    HB3  TYR  35           HB3      TYR  35 -17.250  -4.147   1.581
  263    HD1  TYR  35           HD1      TYR  35 -19.818  -2.366   3.494
  264    HD2  TYR  35           HD2      TYR  35 -16.802  -5.364   3.627
  265    HE1  TYR  35           HE1      TYR  35 -20.753  -3.205   5.609
  266    HE2  TYR  35           HE2      TYR  35 -17.727  -6.211   5.741
  267    HH   TYR  35           HH       TYR  35 -20.363  -6.001   6.823
  268    HA   PRO  36           HA       PRO  36 -18.266   0.310   5.137
  269    HB2  PRO  36           HB2      PRO  36 -16.296  -0.035   7.252
  270    HB3  PRO  36           HB3      PRO  36 -18.021  -0.403   7.273
  271    HG2  PRO  36           HG2      PRO  36 -16.096  -2.317   7.326
  272    HG3  PRO  36           HG3      PRO  36 -17.699  -2.573   6.612
  273    HD2  PRO  36           HD2      PRO  36 -15.094  -1.965   5.262
  274    HD3  PRO  36           HD3      PRO  36 -16.375  -3.102   4.785
  275    H    LYS  37           HN       LYS  37 -15.029   0.223   4.075
  276    HA   LYS  37           HA       LYS  37 -14.518   2.956   5.005
  277    HB2  LYS  37           HB2      LYS  37 -12.804   0.621   4.340
  278    HB3  LYS  37           HB3      LYS  37 -12.159   2.216   3.991
  279    HG2  LYS  37           HG2      LYS  37 -11.521   2.372   6.105
  280    HG3  LYS  37           HG3      LYS  37 -13.217   2.343   6.590
  281    HD2  LYS  37           HD2      LYS  37 -12.980   0.317   7.474
  282    HD3  LYS  37           HD3      LYS  37 -12.330  -0.312   5.960
  283    HE2  LYS  37           HE2      LYS  37 -10.414   1.340   7.382
  284    HE3  LYS  37           HE3      LYS  37 -10.962  -0.026   8.348
  285    HZ1  LYS  37           HZ1      LYS  37  -9.066  -0.701   7.108
  286    HZ2  LYS  37           HZ2      LYS  37  -9.726  -0.124   5.653
  287    HZ3  LYS  37           HZ3      LYS  37 -10.417  -1.468   6.425
  288    H    GLY  38           HN       GLY  38 -14.955   0.966   2.188
  289    HA2  GLY  38           HA1      GLY  38 -15.443   1.654   0.021
  290    HA3  GLY  38           HA2      GLY  38 -15.100   3.313   0.498
  291    H    THR  39           HN       THR  39 -12.838   0.779   1.188
  292    HA   THR  39           HA       THR  39 -11.109   1.727  -1.003
  293    HB   THR  39           HB       THR  39  -9.460   0.968   1.178
  294    HG1  THR  39           HG1      THR  39 -11.426   2.919   1.883
  295   HG21  THR  39          HG21      THR  39  -8.369   2.603   0.121
  296   HG22  THR  39          HG22      THR  39  -9.405   3.750   0.973
  297   HG23  THR  39          HG23      THR  39  -9.851   3.182  -0.637
  298    H    ALA  40           HN       ALA  40  -9.340   0.200  -1.520
  299    HA   ALA  40           HA       ALA  40  -9.808  -2.561  -0.637
  300    HB1  ALA  40           HB1      ALA  40 -10.608  -1.611  -3.135
  301    HB2  ALA  40           HB2      ALA  40  -9.114  -2.498  -3.437
  302    HB3  ALA  40           HB3      ALA  40 -10.467  -3.294  -2.631
  303    H    GLN  41           HN       GLN  41  -7.951  -3.228   0.216
  304    HA   GLN  41           HA       GLN  41  -5.434  -2.053  -0.648
  305    HB2  GLN  41           HB2      GLN  41  -6.399  -3.076   1.774
  306    HB3  GLN  41           HB3      GLN  41  -5.179  -4.226   1.247
  307    HG2  GLN  41           HG2      GLN  41  -4.496  -1.348   1.117
  308    HG3  GLN  41           HG3      GLN  41  -4.592  -2.100   2.708
  309   HE21  GLN  41          HE21      GLN  41  -3.023  -3.457   3.366
  310   HE22  GLN  41          HE22      GLN  41  -1.605  -3.817   2.437
  311    H    LEU  42           HN       LEU  42  -4.592  -2.868  -2.463
  312    HA   LEU  42           HA       LEU  42  -5.102  -5.671  -3.113
  313    HB2  LEU  42           HB2      LEU  42  -3.663  -4.441  -5.203
  314    HB3  LEU  42           HB3      LEU  42  -5.348  -4.923  -5.184
  315    HG   LEU  42           HG       LEU  42  -5.174  -2.432  -3.837
  316   HD11  LEU  42          HD11      LEU  42  -2.979  -2.489  -5.313
  317   HD12  LEU  42          HD12      LEU  42  -4.122  -2.051  -6.584
  318   HD13  LEU  42          HD13      LEU  42  -3.958  -1.029  -5.155
  319   HD21  LEU  42          HD21      LEU  42  -6.430  -3.580  -6.264
  320   HD22  LEU  42          HD22      LEU  42  -7.167  -2.774  -4.879
  321   HD23  LEU  42          HD23      LEU  42  -6.372  -1.822  -6.132
  322    H    ALA  43           HN       ALA  43  -3.636  -7.194  -2.950
  323    HA   ALA  43           HA       ALA  43  -0.791  -6.433  -2.819
  324    HB1  ALA  43           HB1      ALA  43  -1.069  -9.120  -2.046
  325    HB2  ALA  43           HB2      ALA  43  -0.708  -7.738  -1.011
  326    HB3  ALA  43           HB3      ALA  43  -2.379  -8.248  -1.246
  327    H    ILE  44           HN       ILE  44  -0.121  -6.509  -4.890
  328    HA   ILE  44           HA       ILE  44  -0.967  -8.812  -6.519
  329    HB   ILE  44           HB       ILE  44  -0.798  -7.434  -8.503
  330   HG12  ILE  44          HG12      ILE  44   0.934  -5.862  -7.199
  331   HG13  ILE  44          HG13      ILE  44   0.038  -5.310  -8.607
  332   HG21  ILE  44          HG21      ILE  44  -2.970  -7.412  -7.769
  333   HG22  ILE  44          HG22      ILE  44  -2.578  -6.535  -6.291
  334   HG23  ILE  44          HG23      ILE  44  -2.612  -5.686  -7.837
  335   HD11  ILE  44          HD11      ILE  44  -0.966  -4.872  -5.816
  336   HD12  ILE  44          HD12      ILE  44   0.151  -3.758  -6.604
  337   HD13  ILE  44          HD13      ILE  44  -1.441  -4.049  -7.301
  338    H    VAL  45           HN       VAL  45   0.552  -9.373  -8.278
  339    HA   VAL  45           HA       VAL  45   3.221  -9.644  -7.284
  340    HB   VAL  45           HB       VAL  45   2.279 -10.214 -10.098
  341   HG11  VAL  45          HG11      VAL  45   4.297 -11.066 -10.449
  342   HG12  VAL  45          HG12      VAL  45   4.792 -10.400  -8.892
  343   HG13  VAL  45          HG13      VAL  45   4.190 -12.055  -8.991
  344   HG21  VAL  45          HG21      VAL  45   2.205 -12.085  -7.735
  345   HG22  VAL  45          HG22      VAL  45   0.796 -11.304  -8.455
  346   HG23  VAL  45          HG23      VAL  45   1.738 -12.462  -9.394
  347    HA   PRO  46           HA       PRO  46   4.766  -5.686  -8.735
  348    HB2  PRO  46           HB2      PRO  46   7.308  -7.249  -8.705
  349    HB3  PRO  46           HB3      PRO  46   6.952  -5.665  -8.002
  350    HG2  PRO  46           HG2      PRO  46   7.132  -7.825  -6.455
  351    HG3  PRO  46           HG3      PRO  46   5.910  -6.581  -6.143
  352    HD2  PRO  46           HD2      PRO  46   5.595  -9.283  -7.363
  353    HD3  PRO  46           HD3      PRO  46   4.489  -8.384  -6.305
  354    H    GLY  47           HN       GLY  47   4.432  -5.181 -10.810
  355    HA2  GLY  47           HA1      GLY  47   5.577  -5.331 -13.058
  356    HA3  GLY  47           HA2      GLY  47   5.372  -7.072 -12.879
  357    H    THR  48           HN       THR  48   2.765  -6.721 -11.546
  358    HA   THR  48           HA       THR  48   1.078  -6.510 -13.856
  359    HB   THR  48           HB       THR  48  -0.005  -6.473 -11.063
  360    HG1  THR  48           HG1      THR  48   1.537  -8.066 -10.869
  361   HG21  THR  48          HG21      THR  48  -1.075  -6.832 -13.627
  362   HG22  THR  48          HG22      THR  48  -1.897  -7.063 -12.084
  363   HG23  THR  48          HG23      THR  48  -1.106  -8.427 -12.875
  364    H    SER  49           HN       SER  49   0.018  -4.779 -14.589
  365    HA   SER  49           HA       SER  49   0.665  -2.234 -13.483
  366    HB2  SER  49           HB2      SER  49  -1.444  -2.553 -15.577
  367    HB3  SER  49           HB3      SER  49  -0.172  -1.339 -15.445
  368    HG   SER  49           HG       SER  49   0.092  -4.052 -16.245
  369    HA   PRO  50           HA       PRO  50  -2.908  -2.187 -10.785
  370    HB2  PRO  50           HB2      PRO  50  -2.019   0.492 -10.033
  371    HB3  PRO  50           HB3      PRO  50  -2.109  -0.966  -9.043
  372    HG2  PRO  50           HG2      PRO  50   0.243   0.135  -9.816
  373    HG3  PRO  50           HG3      PRO  50   0.037  -1.607  -9.553
  374    HD2  PRO  50           HD2      PRO  50   0.094  -0.071 -12.125
  375    HD3  PRO  50           HD3      PRO  50   0.809  -1.651 -11.735
  376    H    ASP  51           HN       ASP  51  -2.015   0.133 -13.168
  377    HA   ASP  51           HA       ASP  51  -4.347   1.766 -13.074
  378    HB2  ASP  51           HB2      ASP  51  -2.450   2.709 -14.138
  379    HB3  ASP  51           HB3      ASP  51  -2.176   1.277 -15.117
  380    H    ALA  52           HN       ALA  52  -3.562  -1.328 -14.248
  381    HA   ALA  52           HA       ALA  52  -5.607  -1.484 -16.243
  382    HB1  ALA  52           HB1      ALA  52  -4.545  -3.969 -15.029
  383    HB2  ALA  52           HB2      ALA  52  -4.800  -3.560 -16.726
  384    HB3  ALA  52           HB3      ALA  52  -3.396  -2.926 -15.866
  385    H    LEU  53           HN       LEU  53  -5.316  -2.145 -12.849
  386    HA   LEU  53           HA       LEU  53  -7.788  -3.554 -12.577
  387    HB2  LEU  53           HB2      LEU  53  -6.426  -2.010 -10.385
  388    HB3  LEU  53           HB3      LEU  53  -7.423  -3.443 -10.244
  389    HG   LEU  53           HG       LEU  53  -4.719  -3.468 -11.576
  390   HD11  LEU  53          HD11      LEU  53  -5.382  -3.284  -8.759
  391   HD12  LEU  53          HD12      LEU  53  -4.468  -4.744  -9.135
  392   HD13  LEU  53          HD13      LEU  53  -3.816  -3.161  -9.563
  393   HD21  LEU  53          HD21      LEU  53  -6.107  -5.776 -10.280
  394   HD22  LEU  53          HD22      LEU  53  -6.533  -5.288 -11.920
  395   HD23  LEU  53          HD23      LEU  53  -4.879  -5.776 -11.546
  396    H    THR  54           HN       THR  54  -6.693  -0.233 -12.073
  397    HA   THR  54           HA       THR  54  -9.103   0.889 -11.226
  398    HB   THR  54           HB       THR  54  -7.619   2.670 -12.989
  399    HG1  THR  54           HG1      THR  54  -6.150   1.392 -10.903
  400   HG21  THR  54          HG21      THR  54  -7.548   2.864 -10.016
  401   HG22  THR  54          HG22      THR  54  -9.106   3.035 -10.824
  402   HG23  THR  54          HG23      THR  54  -7.782   4.129 -11.221
  403    H    ALA  55           HN       ALA  55  -7.759   0.580 -14.505
  404    HA   ALA  55           HA       ALA  55  -9.991   1.688 -15.836
  405    HB1  ALA  55           HB1      ALA  55  -8.064   1.683 -17.119
  406    HB2  ALA  55           HB2      ALA  55  -7.663   0.019 -16.697
  407    HB3  ALA  55           HB3      ALA  55  -8.982   0.351 -17.821
  408    H    ALA  56           HN       ALA  56  -9.211  -1.585 -14.806
  409    HA   ALA  56           HA       ALA  56 -11.256  -2.913 -16.216
  410    HB1  ALA  56           HB1      ALA  56 -10.420  -4.729 -15.240
  411    HB2  ALA  56           HB2      ALA  56  -9.254  -3.667 -14.449
  412    HB3  ALA  56           HB3      ALA  56 -10.753  -4.101 -13.627
  413    H    VAL  57           HN       VAL  57 -11.208  -1.482 -12.954
  414    HA   VAL  57           HA       VAL  57 -13.918  -2.182 -12.404
  415    HB   VAL  57           HB       VAL  57 -12.238  -0.065 -11.083
  416   HG11  VAL  57          HG11      VAL  57 -14.006   0.427  -9.834
  417   HG12  VAL  57          HG12      VAL  57 -14.979  -0.676 -10.808
  418   HG13  VAL  57          HG13      VAL  57 -14.163  -1.265  -9.359
  419   HG21  VAL  57          HG21      VAL  57 -11.457  -2.543 -11.109
  420   HG22  VAL  57          HG22      VAL  57 -11.452  -1.643  -9.591
  421   HG23  VAL  57          HG23      VAL  57 -12.760  -2.774  -9.941
  422    H    ALA  58           HN       ALA  58 -12.328   0.784 -13.562
  423    HA   ALA  58           HA       ALA  58 -14.675   2.354 -13.692
  424    HB1  ALA  58           HB1      ALA  58 -13.407   3.887 -15.012
  425    HB2  ALA  58           HB2      ALA  58 -12.324   3.212 -13.792
  426    HB3  ALA  58           HB3      ALA  58 -12.249   2.634 -15.457
  427    H    GLY  59           HN       GLY  59 -13.373  -0.098 -15.752
  428    HA2  GLY  59           HA1      GLY  59 -15.187   0.552 -17.942
  429    HA3  GLY  59           HA2      GLY  59 -13.985  -0.731 -17.925
  430    H    LEU  60           HN       LEU  60 -15.486  -0.981 -15.056
  431    HA   LEU  60           HA       LEU  60 -17.140  -3.180 -15.961
  432    HB2  LEU  60           HB2      LEU  60 -15.812  -2.401 -13.506
  433    HB3  LEU  60           HB3      LEU  60 -17.449  -2.946 -13.218
  434    HG   LEU  60           HG       LEU  60 -15.535  -4.601 -14.831
  435   HD11  LEU  60          HD11      LEU  60 -14.786  -3.849 -12.407
  436   HD12  LEU  60          HD12      LEU  60 -15.898  -5.133 -11.934
  437   HD13  LEU  60          HD13      LEU  60 -14.533  -5.494 -12.990
  438   HD21  LEU  60          HD21      LEU  60 -16.968  -6.410 -14.167
  439   HD22  LEU  60          HD22      LEU  60 -17.873  -5.354 -13.081
  440   HD23  LEU  60          HD23      LEU  60 -17.970  -5.116 -14.825
  441    H    GLY  61           HN       GLY  61 -17.637  -0.069 -15.905
  442    HA2  GLY  61           HA1      GLY  61 -19.640   1.133 -15.989
  443    HA3  GLY  61           HA2      GLY  61 -20.476  -0.258 -15.308
  444    H    TYR  62           HN       TYR  62 -17.682   0.383 -13.631
  445    HA   TYR  62           HA       TYR  62 -19.110   1.918 -11.574
  446    HB2  TYR  62           HB2      TYR  62 -16.905  -0.136 -11.290
  447    HB3  TYR  62           HB3      TYR  62 -17.547   0.827  -9.969
  448    HD1  TYR  62           HD2      TYR  62 -20.444   0.731 -10.508
  449    HD2  TYR  62           HD1      TYR  62 -17.500  -2.330 -10.779
  450    HE1  TYR  62           HE2      TYR  62 -22.173  -0.962 -10.085
  451    HE2  TYR  62           HE1      TYR  62 -19.227  -4.032 -10.358
  452    HH   TYR  62           HH       TYR  62 -21.779  -3.764  -9.001
  453    H    LYS  63           HN       LYS  63 -16.954   2.679  -9.999
  454    HA   LYS  63           HA       LYS  63 -15.092   3.975 -11.860
  455    HB2  LYS  63           HB2      LYS  63 -17.094   5.276 -10.253
  456    HB3  LYS  63           HB3      LYS  63 -15.490   5.768  -9.726
  457    HG2  LYS  63           HG2      LYS  63 -15.930   5.764 -12.634
  458    HG3  LYS  63           HG3      LYS  63 -16.852   6.953 -11.712
  459    HD2  LYS  63           HD2      LYS  63 -14.149   6.892 -10.764
  460    HD3  LYS  63           HD3      LYS  63 -14.155   7.101 -12.517
  461    HE2  LYS  63           HE2      LYS  63 -15.980   8.725 -10.795
  462    HE3  LYS  63           HE3      LYS  63 -14.286   9.183 -10.965
  463    HZ1  LYS  63           HZ1      LYS  63 -16.051   8.722 -13.306
  464    HZ2  LYS  63           HZ2      LYS  63 -14.544   9.497 -13.268
  465    HZ3  LYS  63           HZ3      LYS  63 -15.894  10.240 -12.564
  466    H    ALA  64           HN       ALA  64 -13.060   3.567 -11.313
  467    HA   ALA  64           HA       ALA  64 -12.511   2.943  -8.489
  468    HB1  ALA  64           HB1      ALA  64 -10.733   2.147 -10.765
  469    HB2  ALA  64           HB2      ALA  64 -10.822   1.471  -9.139
  470    HB3  ALA  64           HB3      ALA  64 -12.120   1.168 -10.293
  471    H    THR  65           HN       THR  65 -11.243   4.269  -7.392
  472    HA   THR  65           HA       THR  65  -9.312   5.924  -8.882
  473    HB   THR  65           HB       THR  65  -9.488   7.163  -6.452
  474    HG1  THR  65           HG1      THR  65 -12.139   6.335  -7.159
  475   HG21  THR  65          HG21      THR  65  -9.609   8.725  -8.057
  476   HG22  THR  65          HG22      THR  65 -11.358   8.535  -7.919
  477   HG23  THR  65          HG23      THR  65 -10.470   7.651  -9.160
  478    H    LEU  66           HN       LEU  66  -7.665   6.641  -6.725
  479    HA   LEU  66           HA       LEU  66  -6.996   4.202  -5.320
  480    HB2  LEU  66           HB2      LEU  66  -4.903   3.776  -6.293
  481    HB3  LEU  66           HB3      LEU  66  -6.009   3.983  -7.638
  482    HG   LEU  66           HG       LEU  66  -4.739   6.492  -6.945
  483   HD11  LEU  66          HD11      LEU  66  -2.855   5.301  -6.184
  484   HD12  LEU  66          HD12      LEU  66  -2.982   4.116  -7.486
  485   HD13  LEU  66          HD13      LEU  66  -2.485   5.769  -7.846
  486   HD21  LEU  66          HD21      LEU  66  -5.902   5.494  -9.113
  487   HD22  LEU  66          HD22      LEU  66  -4.668   6.749  -9.207
  488   HD23  LEU  66          HD23      LEU  66  -4.238   5.062  -9.496
  489    H    ALA  67           HN       ALA  67  -5.906   4.546  -3.486
  490    HA   ALA  67           HA       ALA  67  -4.799   7.255  -3.066
  491    HB1  ALA  67           HB1      ALA  67  -5.993   5.516  -0.915
  492    HB2  ALA  67           HB2      ALA  67  -5.524   7.212  -0.800
  493    HB3  ALA  67           HB3      ALA  67  -6.910   6.745  -1.788
  494    H    ASP  68           HN       ASP  68  -2.704   7.309  -2.541
  495    HA   ASP  68           HA       ASP  68  -1.439   4.822  -1.727
  496    HB2  ASP  68           HB2      ASP  68  -0.607   5.850  -3.835
  497    HB3  ASP  68           HB3      ASP  68  -0.099   7.256  -2.902
  498    H    ALA  69           HN       ALA  69   0.050   4.806  -0.026
  499    HA   ALA  69           HA       ALA  69   0.989   5.362   1.958
  500    HB1  ALA  69           HB1      ALA  69   2.070   7.237   1.173
  501    HB2  ALA  69           HB2      ALA  69   0.567   8.082   0.805
  502    HB3  ALA  69           HB3      ALA  69   1.094   7.911   2.479
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1   2.427  -3.712   0.647
    2    H2   MET   1           H2       MET   1   1.114  -2.895   1.342
    3    H3   MET   1           H3       MET   1   2.125  -2.097   0.237
    4    HA   MET   1           HA       MET   1   1.446  -3.916  -1.392
    5    HB2  MET   1           HB2      MET   1  -0.383  -5.204  -0.934
    6    HB3  MET   1           HB3      MET   1   0.163  -4.966   0.719
    7    HG2  MET   1           HG2      MET   1  -1.493  -2.789   0.179
    8    HG3  MET   1           HG3      MET   1  -2.307  -4.181  -0.533
    9    HE1  MET   1           HE1      MET   1  -2.388  -6.721   2.035
   10    HE2  MET   1           HE2      MET   1  -3.935  -5.936   1.723
   11    HE3  MET   1           HE3      MET   1  -2.779  -6.161   0.411
   12    H    THR   2           HN       THR   2  -0.153  -3.273  -2.975
   13    HA   THR   2           HA       THR   2  -0.273  -0.478  -3.285
   14    HB   THR   2           HB       THR   2  -2.162  -1.511  -5.022
   15    HG1  THR   2           HG1      THR   2  -1.727  -3.634  -4.347
   16   HG21  THR   2          HG21      THR   2   0.079  -1.762  -6.476
   17   HG22  THR   2          HG22      THR   2   0.720  -0.830  -5.124
   18   HG23  THR   2          HG23      THR   2  -0.626  -0.197  -6.071
   19    H    HIS   3           HN       HIS   3  -1.975   0.970  -3.185
   20    HA   HIS   3           HA       HIS   3  -4.420  -0.004  -1.841
   21    HB2  HIS   3           HB2      HIS   3  -3.035   2.666  -1.735
   22    HB3  HIS   3           HB3      HIS   3  -4.714   2.481  -1.268
   23    HD1  HIS   3           HD1      HIS   3  -4.400   3.017   1.182
   24    HD2  HIS   3           HD2      HIS   3  -1.954  -0.076  -0.143
   25    HE1  HIS   3           HE1      HIS   3  -3.372   2.027   3.254
   26    HE2  HIS   3           HE2      HIS   3  -1.696   0.350   2.394
   27    H    LEU   4           HN       LEU   4  -6.416   0.778  -2.579
   28    HA   LEU   4           HA       LEU   4  -6.441   2.410  -5.001
   29    HB2  LEU   4           HB2      LEU   4  -6.663  -0.337  -5.185
   30    HB3  LEU   4           HB3      LEU   4  -8.336   0.187  -5.152
   31    HG   LEU   4           HG       LEU   4  -7.495   1.876  -7.007
   32   HD11  LEU   4          HD11      LEU   4  -5.725  -0.437  -7.668
   33   HD12  LEU   4          HD12      LEU   4  -5.684   1.218  -8.272
   34   HD13  LEU   4          HD13      LEU   4  -5.127   0.862  -6.638
   35   HD21  LEU   4          HD21      LEU   4  -8.072  -1.046  -7.496
   36   HD22  LEU   4          HD22      LEU   4  -9.262   0.243  -7.313
   37   HD23  LEU   4          HD23      LEU   4  -8.180   0.234  -8.706
   38    H    LYS   5           HN       LYS   5  -8.596   3.286  -5.454
   39    HA   LYS   5           HA       LYS   5 -10.179   3.445  -2.969
   40    HB2  LYS   5           HB2      LYS   5  -8.877   5.496  -4.257
   41    HB3  LYS   5           HB3      LYS   5 -10.520   5.645  -4.868
   42    HG2  LYS   5           HG2      LYS   5 -10.124   5.315  -1.940
   43    HG3  LYS   5           HG3      LYS   5  -9.760   6.878  -2.678
   44    HD2  LYS   5           HD2      LYS   5 -12.090   6.599  -3.792
   45    HD3  LYS   5           HD3      LYS   5 -12.367   5.420  -2.508
   46    HE2  LYS   5           HE2      LYS   5 -12.374   7.000  -0.868
   47    HE3  LYS   5           HE3      LYS   5 -11.272   8.067  -1.738
   48    HZ1  LYS   5           HZ1      LYS   5 -13.571   8.913  -1.564
   49    HZ2  LYS   5           HZ2      LYS   5 -14.096   7.616  -2.515
   50    HZ3  LYS   5           HZ3      LYS   5 -13.032   8.763  -3.169
   51    H    ILE   6           HN       ILE   6 -12.385   3.360  -3.073
   52    HA   ILE   6           HA       ILE   6 -13.482   2.350  -5.614
   53    HB   ILE   6           HB       ILE   6 -14.203   1.803  -2.737
   54   HG12  ILE   6          HG12      ILE   6 -12.454   0.397  -3.579
   55   HG13  ILE   6          HG13      ILE   6 -13.924  -0.567  -3.489
   56   HG21  ILE   6          HG21      ILE   6 -16.339   2.008  -3.599
   57   HG22  ILE   6          HG22      ILE   6 -15.875   1.376  -5.179
   58   HG23  ILE   6          HG23      ILE   6 -16.005   0.288  -3.796
   59   HD11  ILE   6          HD11      ILE   6 -13.637   0.672  -6.079
   60   HD12  ILE   6          HD12      ILE   6 -12.229  -0.305  -5.661
   61   HD13  ILE   6          HD13      ILE   6 -13.837  -1.028  -5.654
   62    H    THR   7           HN       THR   7 -15.103   3.456  -6.583
   63    HA   THR   7           HA       THR   7 -16.725   5.312  -5.009
   64    HB   THR   7           HB       THR   7 -16.307   6.584  -7.492
   65    HG1  THR   7           HG1      THR   7 -14.300   5.190  -7.351
   66   HG21  THR   7          HG21      THR   7 -14.799   7.912  -5.516
   67   HG22  THR   7          HG22      THR   7 -16.155   7.151  -4.684
   68   HG23  THR   7          HG23      THR   7 -16.451   8.258  -6.024
   69    H    GLY   8           HN       GLY   8 -18.706   5.963  -6.144
   70    HA2  GLY   8           HA1      GLY   8 -20.293   5.770  -7.872
   71    HA3  GLY   8           HA2      GLY   8 -19.370   4.440  -8.552
   72    H    MET   9           HN       MET   9 -19.160   2.848  -6.234
   73    HA   MET   9           HA       MET   9 -21.796   1.653  -6.362
   74    HB2  MET   9           HB2      MET   9 -19.287   0.660  -5.015
   75    HB3  MET   9           HB3      MET   9 -20.773  -0.250  -5.233
   76    HG2  MET   9           HG2      MET   9 -20.484  -0.424  -7.520
   77    HG3  MET   9           HG3      MET   9 -19.319   0.897  -7.572
   78    HE1  MET   9           HE1      MET   9 -17.176   0.957  -6.846
   79    HE2  MET   9           HE2      MET   9 -16.088  -0.380  -6.465
   80    HE3  MET   9           HE3      MET   9 -16.582  -0.093  -8.134
   81    H    THR  10           HN       THR  10 -22.656   0.626  -4.308
   82    HA   THR  10           HA       THR  10 -22.915   2.687  -2.316
   83    HB   THR  10           HB       THR  10 -24.216   0.202  -1.635
   84    HG1  THR  10           HG1      THR  10 -25.507   0.025  -3.495
   85   HG21  THR  10          HG21      THR  10 -24.838   2.505  -0.909
   86   HG22  THR  10          HG22      THR  10 -26.179   1.599  -1.609
   87   HG23  THR  10          HG23      THR  10 -25.358   2.838  -2.561
   88    H    CYS  11           HN       CYS  11 -22.452  -0.847  -1.883
   89    HA   CYS  11           HA       CYS  11 -20.119  -0.603  -0.313
   90    HB2  CYS  11           HB2      CYS  11 -21.024  -0.961   1.905
   91    HB3  CYS  11           HB3      CYS  11 -21.664   0.529   1.228
   92    HG   CYS  11           HG       CYS  11 -24.173  -0.082   1.376
   93    H    ASP  12           HN       ASP  12 -19.427  -2.554   0.626
   94    HA   ASP  12           HA       ASP  12 -19.147  -4.763   0.937
   95    HB2  ASP  12           HB2      ASP  12 -21.280  -4.155   2.296
   96    HB3  ASP  12           HB3      ASP  12 -22.113  -5.130   1.089
   97    H    SER  13           HN       SER  13 -22.284  -5.368  -0.525
   98    HA   SER  13           HA       SER  13 -21.422  -7.501  -2.081
   99    HB2  SER  13           HB2      SER  13 -23.665  -5.992  -3.226
  100    HB3  SER  13           HB3      SER  13 -23.613  -7.650  -2.622
  101    HG   SER  13           HG       SER  13 -23.793  -6.832  -0.502
  102    H    CYS  14           HN       CYS  14 -21.495  -4.081  -2.752
  103    HA   CYS  14           HA       CYS  14 -20.854  -4.173  -5.496
  104    HB2  CYS  14           HB2      CYS  14 -20.107  -2.055  -3.476
  105    HB3  CYS  14           HB3      CYS  14 -20.233  -1.840  -5.217
  106    HG   CYS  14           HG       CYS  14 -23.125  -2.915  -4.560
  107    H    ALA  15           HN       ALA  15 -18.860  -4.018  -2.569
  108    HA   ALA  15           HA       ALA  15 -16.378  -3.860  -3.980
  109    HB1  ALA  15           HB1      ALA  15 -15.603  -4.701  -1.567
  110    HB2  ALA  15           HB2      ALA  15 -16.071  -3.031  -1.889
  111    HB3  ALA  15           HB3      ALA  15 -17.225  -4.144  -1.155
  112    H    ALA  16           HN       ALA  16 -18.501  -6.399  -3.070
  113    HA   ALA  16           HA       ALA  16 -16.628  -8.534  -3.008
  114    HB1  ALA  16           HB1      ALA  16 -19.304  -9.291  -3.866
  115    HB2  ALA  16           HB2      ALA  16 -18.397  -9.771  -2.433
  116    HB3  ALA  16           HB3      ALA  16 -19.310  -8.263  -2.433
  117    H    HIS  17           HN       HIS  17 -18.734  -7.194  -5.516
  118    HA   HIS  17           HA       HIS  17 -18.057  -9.011  -7.557
  119    HB2  HIS  17           HB2      HIS  17 -19.890  -7.054  -7.378
  120    HB3  HIS  17           HB3      HIS  17 -18.662  -6.195  -8.302
  121    HD1  HIS  17           HD1      HIS  17 -20.272  -6.140 -10.352
  122    HD2  HIS  17           HD2      HIS  17 -19.164  -9.954  -9.119
  123    HE1  HIS  17           HE1      HIS  17 -20.939  -7.680 -12.224
  124    HE2  HIS  17           HE2      HIS  17 -20.378  -9.995 -11.404
  125    H    VAL  18           HN       VAL  18 -16.712  -5.891  -6.624
  126    HA   VAL  18           HA       VAL  18 -14.760  -5.701  -8.640
  127    HB   VAL  18           HB       VAL  18 -14.725  -4.576  -5.832
  128   HG11  VAL  18          HG11      VAL  18 -12.504  -4.758  -7.177
  129   HG12  VAL  18          HG12      VAL  18 -13.176  -3.422  -8.112
  130   HG13  VAL  18          HG13      VAL  18 -12.921  -3.244  -6.377
  131   HG21  VAL  18          HG21      VAL  18 -15.928  -2.813  -6.565
  132   HG22  VAL  18          HG22      VAL  18 -15.228  -2.866  -8.182
  133   HG23  VAL  18          HG23      VAL  18 -16.513  -3.990  -7.741
  134    H    LYS  19           HN       LYS  19 -14.601  -6.993  -5.329
  135    HA   LYS  19           HA       LYS  19 -11.881  -7.668  -5.345
  136    HB2  LYS  19           HB2      LYS  19 -13.190  -7.616  -3.286
  137    HB3  LYS  19           HB3      LYS  19 -14.171  -8.960  -3.850
  138    HG2  LYS  19           HG2      LYS  19 -11.843 -10.178  -3.985
  139    HG3  LYS  19           HG3      LYS  19 -11.388  -8.947  -2.806
  140    HD2  LYS  19           HD2      LYS  19 -12.356 -10.141  -1.200
  141    HD3  LYS  19           HD3      LYS  19 -13.906  -9.985  -2.029
  142    HE2  LYS  19           HE2      LYS  19 -13.747 -12.252  -2.011
  143    HE3  LYS  19           HE3      LYS  19 -12.880 -11.929  -3.510
  144    HZ1  LYS  19           HZ1      LYS  19 -11.095 -11.807  -1.319
  145    HZ2  LYS  19           HZ2      LYS  19 -11.062 -12.842  -2.662
  146    HZ3  LYS  19           HZ3      LYS  19 -11.941 -13.275  -1.277
  147    H    GLU  20           HN       GLU  20 -14.733  -9.543  -6.253
  148    HA   GLU  20           HA       GLU  20 -13.344 -11.924  -6.837
  149    HB2  GLU  20           HB2      GLU  20 -15.776 -11.812  -6.427
  150    HB3  GLU  20           HB3      GLU  20 -15.979 -10.934  -7.936
  151    HG2  GLU  20           HG2      GLU  20 -14.634 -13.211  -8.699
  152    HG3  GLU  20           HG3      GLU  20 -15.738 -13.778  -7.445
  153    H    ALA  21           HN       ALA  21 -14.232  -9.146  -8.813
  154    HA   ALA  21           HA       ALA  21 -13.410 -10.272 -11.288
  155    HB1  ALA  21           HB1      ALA  21 -14.380  -8.431 -12.054
  156    HB2  ALA  21           HB2      ALA  21 -14.539  -7.825 -10.406
  157    HB3  ALA  21           HB3      ALA  21 -13.097  -7.448 -11.350
  158    H    LEU  22           HN       LEU  22 -11.830  -8.447  -8.768
  159    HA   LEU  22           HA       LEU  22  -9.387  -8.030 -10.151
  160    HB2  LEU  22           HB2      LEU  22 -10.180  -7.941  -7.254
  161    HB3  LEU  22           HB3      LEU  22  -8.512  -7.730  -7.747
  162    HG   LEU  22           HG       LEU  22 -10.848  -5.963  -8.466
  163   HD11  LEU  22          HD11      LEU  22  -8.899  -4.403  -7.381
  164   HD12  LEU  22          HD12      LEU  22 -10.275  -5.059  -6.497
  165   HD13  LEU  22          HD13      LEU  22  -8.721  -5.892  -6.456
  166   HD21  LEU  22          HD21      LEU  22  -7.977  -5.784  -9.371
  167   HD22  LEU  22          HD22      LEU  22  -9.360  -6.192 -10.385
  168   HD23  LEU  22          HD23      LEU  22  -9.233  -4.584  -9.674
  169    H    GLU  23           HN       GLU  23 -10.444 -10.420  -7.746
  170    HA   GLU  23           HA       GLU  23  -7.878 -11.698  -7.736
  171    HB2  GLU  23           HB2      GLU  23 -10.522 -12.319  -6.451
  172    HB3  GLU  23           HB3      GLU  23  -9.165 -13.438  -6.350
  173    HG2  GLU  23           HG2      GLU  23  -7.801 -11.558  -5.423
  174    HG3  GLU  23           HG3      GLU  23  -9.283 -10.608  -5.348
  175    H    LYS  24           HN       LYS  24 -10.592 -11.892  -9.765
  176    HA   LYS  24           HA       LYS  24 -10.138 -14.561 -10.695
  177    HB2  LYS  24           HB2      LYS  24 -11.926 -14.196 -12.023
  178    HB3  LYS  24           HB3      LYS  24 -12.150 -12.765 -11.035
  179    HG2  LYS  24           HG2      LYS  24 -11.642 -11.370 -12.713
  180    HG3  LYS  24           HG3      LYS  24 -10.360 -12.412 -13.331
  181    HD2  LYS  24           HD2      LYS  24 -12.215 -13.939 -14.167
  182    HD3  LYS  24           HD3      LYS  24 -13.319 -12.604 -13.824
  183    HE2  LYS  24           HE2      LYS  24 -12.613 -11.396 -15.587
  184    HE3  LYS  24           HE3      LYS  24 -10.928 -11.870 -15.364
  185    HZ1  LYS  24           HZ1      LYS  24 -11.495 -14.037 -16.353
  186    HZ2  LYS  24           HZ2      LYS  24 -11.743 -12.746 -17.421
  187    HZ3  LYS  24           HZ3      LYS  24 -13.068 -13.479 -16.656
  188    H    VAL  25           HN       VAL  25  -8.674 -11.509 -11.156
  189    HA   VAL  25           HA       VAL  25  -7.219 -12.267 -13.546
  190    HB   VAL  25           HB       VAL  25  -7.067  -9.845 -11.738
  191   HG11  VAL  25          HG11      VAL  25  -4.857 -10.230 -12.648
  192   HG12  VAL  25          HG12      VAL  25  -5.524 -10.416 -14.270
  193   HG13  VAL  25          HG13      VAL  25  -5.596  -8.850 -13.461
  194   HG21  VAL  25          HG21      VAL  25  -7.783  -8.854 -14.096
  195   HG22  VAL  25          HG22      VAL  25  -8.431 -10.483 -14.294
  196   HG23  VAL  25          HG23      VAL  25  -8.961  -9.480 -12.943
  197    HA   PRO  26           HA       PRO  26  -4.242 -14.492 -11.122
  198    HB2  PRO  26           HB2      PRO  26  -2.369 -14.842 -13.069
  199    HB3  PRO  26           HB3      PRO  26  -3.866 -15.776 -12.977
  200    HG2  PRO  26           HG2      PRO  26  -3.220 -13.392 -14.669
  201    HG3  PRO  26           HG3      PRO  26  -4.075 -14.883 -15.110
  202    HD2  PRO  26           HD2      PRO  26  -5.379 -12.588 -14.561
  203    HD3  PRO  26           HD3      PRO  26  -6.058 -14.178 -14.163
  204    H    GLY  27           HN       GLY  27  -3.925 -11.338 -11.994
  205    HA2  GLY  27           HA1      GLY  27  -1.119 -11.106 -11.201
  206    HA3  GLY  27           HA2      GLY  27  -2.125  -9.808 -11.826
  207    H    VAL  28           HN       VAL  28  -4.217 -10.990  -9.822
  208    HA   VAL  28           HA       VAL  28  -3.353  -9.260  -7.627
  209    HB   VAL  28           HB       VAL  28  -6.045 -10.478  -8.269
  210   HG11  VAL  28          HG11      VAL  28  -6.965  -9.468  -6.368
  211   HG12  VAL  28          HG12      VAL  28  -5.464 -10.183  -5.780
  212   HG13  VAL  28          HG13      VAL  28  -5.546  -8.452  -6.107
  213   HG21  VAL  28          HG21      VAL  28  -4.812  -8.279  -9.349
  214   HG22  VAL  28          HG22      VAL  28  -6.551  -8.567  -9.314
  215   HG23  VAL  28          HG23      VAL  28  -5.797  -7.577  -8.065
  216    H    GLN  29           HN       GLN  29  -2.545 -10.078  -5.835
  217    HA   GLN  29           HA       GLN  29  -2.555 -12.943  -5.414
  218    HB2  GLN  29           HB2      GLN  29  -0.578 -11.326  -5.034
  219    HB3  GLN  29           HB3      GLN  29  -1.397 -10.889  -3.542
  220    HG2  GLN  29           HG2      GLN  29  -1.232 -13.134  -2.724
  221    HG3  GLN  29           HG3      GLN  29  -0.585 -13.693  -4.268
  222   HE21  GLN  29          HE21      GLN  29   0.171 -12.645  -1.207
  223   HE22  GLN  29          HE22      GLN  29   1.852 -12.285  -1.446
  224    H    SER  30           HN       SER  30  -3.626 -10.041  -3.683
  225    HA   SER  30           HA       SER  30  -5.841 -11.489  -2.523
  226    HB2  SER  30           HB2      SER  30  -4.836 -10.288  -0.242
  227    HB3  SER  30           HB3      SER  30  -4.736 -12.008  -0.618
  228    HG   SER  30           HG       SER  30  -2.728 -10.482  -0.194
  229    H    ALA  31           HN       ALA  31  -7.501 -10.155  -2.792
  230    HA   ALA  31           HA       ALA  31  -6.995  -7.255  -2.738
  231    HB1  ALA  31           HB1      ALA  31  -9.582  -7.705  -3.700
  232    HB2  ALA  31           HB2      ALA  31  -8.156  -7.249  -4.633
  233    HB3  ALA  31           HB3      ALA  31  -8.578  -8.951  -4.438
  234    H    LEU  32           HN       LEU  32  -7.230  -6.651  -0.631
  235    HA   LEU  32           HA       LEU  32  -9.610  -7.588   0.807
  236    HB2  LEU  32           HB2      LEU  32  -7.027  -6.338   1.700
  237    HB3  LEU  32           HB3      LEU  32  -8.424  -6.396   2.759
  238    HG   LEU  32           HG       LEU  32  -8.111  -9.013   1.806
  239   HD11  LEU  32          HD11      LEU  32  -5.778  -9.496   2.525
  240   HD12  LEU  32          HD12      LEU  32  -5.897  -8.561   1.034
  241   HD13  LEU  32          HD13      LEU  32  -5.479  -7.758   2.546
  242   HD21  LEU  32          HD21      LEU  32  -8.907  -8.721   3.966
  243   HD22  LEU  32          HD22      LEU  32  -7.268  -9.314   4.235
  244   HD23  LEU  32          HD23      LEU  32  -7.620  -7.595   4.394
  245    H    VAL  33           HN       VAL  33 -11.002  -6.254  -0.462
  246    HA   VAL  33           HA       VAL  33 -10.739  -3.399  -0.394
  247    HB   VAL  33           HB       VAL  33 -13.282  -4.856  -1.052
  248   HG11  VAL  33          HG11      VAL  33 -12.456  -2.172  -1.143
  249   HG12  VAL  33          HG12      VAL  33 -12.559  -2.719  -2.816
  250   HG13  VAL  33          HG13      VAL  33 -13.960  -2.862  -1.755
  251   HG21  VAL  33          HG21      VAL  33 -11.358  -4.320  -3.239
  252   HG22  VAL  33          HG22      VAL  33 -11.017  -5.696  -2.191
  253   HG23  VAL  33          HG23      VAL  33 -12.545  -5.612  -3.063
  254    H    SER  34           HN       SER  34 -11.272  -2.136   1.244
  255    HA   SER  34           HA       SER  34 -12.873  -3.157   3.436
  256    HB2  SER  34           HB2      SER  34 -11.773  -0.368   3.311
  257    HB3  SER  34           HB3      SER  34 -11.977  -1.427   4.712
  258    HG   SER  34           HG       SER  34 -10.297  -2.769   3.712
  259    H    TYR  35           HN       TYR  35 -14.963  -3.200   2.899
  260    HA   TYR  35           HA       TYR  35 -16.199  -1.476   1.098
  261    HB2  TYR  35           HB2      TYR  35 -17.910  -2.894   1.225
  262    HB3  TYR  35           HB3      TYR  35 -16.800  -3.872   2.152
  263    HD1  TYR  35           HD1      TYR  35 -19.597  -1.453   2.460
  264    HD2  TYR  35           HD2      TYR  35 -17.320  -4.496   4.375
  265    HE1  TYR  35           HE1      TYR  35 -21.176  -1.448   4.343
  266    HE2  TYR  35           HE2      TYR  35 -18.901  -4.502   6.254
  267    HH   TYR  35           HH       TYR  35 -20.798  -2.219   7.050
  268    HA   PRO  36           HA       PRO  36 -18.121   0.920   4.834
  269    HB2  PRO  36           HB2      PRO  36 -16.608   1.131   7.072
  270    HB3  PRO  36           HB3      PRO  36 -17.823  -0.135   6.854
  271    HG2  PRO  36           HG2      PRO  36 -14.855  -0.270   6.451
  272    HG3  PRO  36           HG3      PRO  36 -15.926  -1.425   7.271
  273    HD2  PRO  36           HD2      PRO  36 -15.067  -1.817   4.750
  274    HD3  PRO  36           HD3      PRO  36 -16.684  -2.324   5.279
  275    H    LYS  37           HN       LYS  37 -14.786   0.855   3.932
  276    HA   LYS  37           HA       LYS  37 -14.422   3.684   4.600
  277    HB2  LYS  37           HB2      LYS  37 -12.716   1.386   4.609
  278    HB3  LYS  37           HB3      LYS  37 -12.062   2.568   3.483
  279    HG2  LYS  37           HG2      LYS  37 -12.890   3.387   6.236
  280    HG3  LYS  37           HG3      LYS  37 -11.319   2.636   5.948
  281    HD2  LYS  37           HD2      LYS  37 -12.224   4.967   4.307
  282    HD3  LYS  37           HD3      LYS  37 -11.509   5.217   5.901
  283    HE2  LYS  37           HE2      LYS  37 -10.056   3.397   4.095
  284    HE3  LYS  37           HE3      LYS  37 -10.090   5.092   3.616
  285    HZ1  LYS  37           HZ1      LYS  37  -8.190   4.823   4.940
  286    HZ2  LYS  37           HZ2      LYS  37  -9.012   3.923   6.120
  287    HZ3  LYS  37           HZ3      LYS  37  -9.319   5.584   5.952
  288    H    GLY  38           HN       GLY  38 -15.104   1.639   1.967
  289    HA2  GLY  38           HA1      GLY  38 -15.359   2.069  -0.283
  290    HA3  GLY  38           HA2      GLY  38 -15.137   3.776   0.086
  291    H    THR  39           HN       THR  39 -12.844   1.242   0.866
  292    HA   THR  39           HA       THR  39 -11.037   2.213  -1.238
  293    HB   THR  39           HB       THR  39  -9.536   1.627   1.148
  294    HG1  THR  39           HG1      THR  39 -11.742   3.378   1.390
  295   HG21  THR  39          HG21      THR  39  -9.796   4.386   0.059
  296   HG22  THR  39          HG22      THR  39  -9.150   3.135  -1.004
  297   HG23  THR  39          HG23      THR  39  -8.351   3.488   0.528
  298    H    ALA  40           HN       ALA  40  -9.208   0.735  -1.613
  299    HA   ALA  40           HA       ALA  40  -9.827  -2.028  -0.804
  300    HB1  ALA  40           HB1      ALA  40  -8.908  -1.142  -3.537
  301    HB2  ALA  40           HB2      ALA  40  -9.230  -2.799  -3.026
  302    HB3  ALA  40           HB3      ALA  40 -10.549  -1.634  -3.118
  303    H    GLN  41           HN       GLN  41  -8.181  -3.046   0.123
  304    HA   GLN  41           HA       GLN  41  -5.456  -2.028  -0.352
  305    HB2  GLN  41           HB2      GLN  41  -5.710  -3.884   1.881
  306    HB3  GLN  41           HB3      GLN  41  -4.989  -2.284   1.839
  307    HG2  GLN  41           HG2      GLN  41  -7.956  -2.541   1.896
  308    HG3  GLN  41           HG3      GLN  41  -7.032  -2.792   3.375
  309   HE21  GLN  41          HE21      GLN  41  -8.809  -0.796   3.344
  310   HE22  GLN  41          HE22      GLN  41  -8.005   0.737   3.271
  311    H    LEU  42           HN       LEU  42  -4.923  -3.217  -2.155
  312    HA   LEU  42           HA       LEU  42  -5.218  -6.132  -1.904
  313    HB2  LEU  42           HB2      LEU  42  -5.964  -6.340  -4.064
  314    HB3  LEU  42           HB3      LEU  42  -6.714  -4.835  -3.576
  315    HG   LEU  42           HG       LEU  42  -4.086  -4.596  -4.912
  316   HD11  LEU  42          HD11      LEU  42  -5.635  -6.418  -6.050
  317   HD12  LEU  42          HD12      LEU  42  -6.415  -4.979  -6.704
  318   HD13  LEU  42          HD13      LEU  42  -4.699  -5.262  -6.996
  319   HD21  LEU  42          HD21      LEU  42  -5.168  -2.576  -4.350
  320   HD22  LEU  42          HD22      LEU  42  -5.406  -2.772  -6.086
  321   HD23  LEU  42          HD23      LEU  42  -6.719  -3.141  -4.968
  322    H    ALA  43           HN       ALA  43  -3.534  -7.378  -2.363
  323    HA   ALA  43           HA       ALA  43  -1.015  -6.064  -3.075
  324    HB1  ALA  43           HB1      ALA  43  -0.633  -8.816  -2.518
  325    HB2  ALA  43           HB2      ALA  43  -0.138  -7.424  -1.553
  326    HB3  ALA  43           HB3      ALA  43  -1.716  -8.166  -1.289
  327    H    ILE  44           HN       ILE  44  -0.220  -6.265  -5.073
  328    HA   ILE  44           HA       ILE  44  -1.418  -8.310  -6.822
  329    HB   ILE  44           HB       ILE  44  -0.362  -6.693  -8.640
  330   HG12  ILE  44          HG12      ILE  44  -1.292  -4.502  -6.924
  331   HG13  ILE  44          HG13      ILE  44   0.207  -5.243  -6.373
  332   HG21  ILE  44          HG21      ILE  44  -2.958  -6.998  -7.424
  333   HG22  ILE  44          HG22      ILE  44  -2.739  -5.362  -8.046
  334   HG23  ILE  44          HG23      ILE  44  -2.531  -6.748  -9.118
  335   HD11  ILE  44          HD11      ILE  44  -0.025  -3.267  -8.254
  336   HD12  ILE  44          HD12      ILE  44   1.386  -4.293  -7.999
  337   HD13  ILE  44          HD13      ILE  44   0.196  -4.718  -9.230
  338    H    VAL  45           HN       VAL  45  -0.066  -9.320  -8.390
  339    HA   VAL  45           HA       VAL  45   2.557  -9.948  -7.404
  340    HB   VAL  45           HB       VAL  45   1.274 -10.699 -10.042
  341   HG11  VAL  45          HG11      VAL  45   3.884 -10.914  -9.495
  342   HG12  VAL  45          HG12      VAL  45   3.318 -12.412  -8.756
  343   HG13  VAL  45          HG13      VAL  45   3.008 -12.099 -10.464
  344   HG21  VAL  45          HG21      VAL  45   0.287 -11.382  -7.645
  345   HG22  VAL  45          HG22      VAL  45   0.224 -12.443  -9.055
  346   HG23  VAL  45          HG23      VAL  45   1.487 -12.659  -7.842
  347    HA   PRO  46           HA       PRO  46   4.796  -6.531  -9.173
  348    HB2  PRO  46           HB2      PRO  46   6.826  -8.713  -9.452
  349    HB3  PRO  46           HB3      PRO  46   7.024  -7.070  -8.831
  350    HG2  PRO  46           HG2      PRO  46   6.847  -9.120  -7.155
  351    HG3  PRO  46           HG3      PRO  46   6.042  -7.583  -6.788
  352    HD2  PRO  46           HD2      PRO  46   4.874 -10.164  -7.697
  353    HD3  PRO  46           HD3      PRO  46   4.175  -8.912  -6.651
  354    H    GLY  47           HN       GLY  47   4.366  -5.859 -11.148
  355    HA2  GLY  47           HA1      GLY  47   5.186  -6.155 -13.528
  356    HA3  GLY  47           HA2      GLY  47   4.516  -7.777 -13.383
  357    H    THR  48           HN       THR  48   2.241  -7.130 -11.889
  358    HA   THR  48           HA       THR  48   0.480  -6.135 -13.909
  359    HB   THR  48           HB       THR  48  -0.474  -6.339 -11.105
  360    HG1  THR  48           HG1      THR  48   0.807  -8.119 -11.010
  361   HG21  THR  48          HG21      THR  48  -1.607  -7.833 -13.421
  362   HG22  THR  48          HG22      THR  48  -1.775  -6.078 -13.388
  363   HG23  THR  48          HG23      THR  48  -2.429  -7.051 -12.072
  364    H    SER  49           HN       SER  49  -0.291  -4.137 -14.189
  365    HA   SER  49           HA       SER  49   0.780  -2.086 -12.437
  366    HB2  SER  49           HB2      SER  49  -0.764  -1.448 -14.917
  367    HB3  SER  49           HB3      SER  49   0.613  -0.602 -14.213
  368    HG   SER  49           HG       SER  49   1.088  -3.206 -15.044
  369    HA   PRO  50           HA       PRO  50  -3.110  -1.694 -10.377
  370    HB2  PRO  50           HB2      PRO  50  -2.726   0.767  -9.249
  371    HB3  PRO  50           HB3      PRO  50  -2.021  -0.725  -8.620
  372    HG2  PRO  50           HG2      PRO  50  -0.778   1.384 -10.334
  373    HG3  PRO  50           HG3      PRO  50  -0.081   0.498  -8.966
  374    HD2  PRO  50           HD2      PRO  50   0.478  -0.127 -11.540
  375    HD3  PRO  50           HD3      PRO  50   0.418  -1.350 -10.253
  376    H    ASP  51           HN       ASP  51  -2.061   0.383 -12.854
  377    HA   ASP  51           HA       ASP  51  -4.342   2.075 -13.002
  378    HB2  ASP  51           HB2      ASP  51  -2.772   3.021 -14.338
  379    HB3  ASP  51           HB3      ASP  51  -1.951   1.496 -14.615
  380    H    ALA  52           HN       ALA  52  -3.545  -1.124 -13.915
  381    HA   ALA  52           HA       ALA  52  -5.598  -1.450 -15.873
  382    HB1  ALA  52           HB1      ALA  52  -3.581  -3.192 -14.600
  383    HB2  ALA  52           HB2      ALA  52  -5.031  -3.987 -15.216
  384    HB3  ALA  52           HB3      ALA  52  -4.024  -3.026 -16.299
  385    H    LEU  53           HN       LEU  53  -5.244  -2.053 -12.457
  386    HA   LEU  53           HA       LEU  53  -7.705  -3.411 -12.077
  387    HB2  LEU  53           HB2      LEU  53  -6.432  -1.698  -9.971
  388    HB3  LEU  53           HB3      LEU  53  -7.302  -3.206  -9.785
  389    HG   LEU  53           HG       LEU  53  -4.627  -3.091 -11.156
  390   HD11  LEU  53          HD11      LEU  53  -4.688  -4.024  -8.379
  391   HD12  LEU  53          HD12      LEU  53  -3.489  -3.047  -9.225
  392   HD13  LEU  53          HD13      LEU  53  -4.945  -2.291  -8.579
  393   HD21  LEU  53          HD21      LEU  53  -4.816  -5.489  -9.920
  394   HD22  LEU  53          HD22      LEU  53  -6.513  -5.177 -10.284
  395   HD23  LEU  53          HD23      LEU  53  -5.321  -5.192 -11.584
  396    H    THR  54           HN       THR  54  -6.671  -0.053 -11.762
  397    HA   THR  54           HA       THR  54  -9.089   1.096 -11.004
  398    HB   THR  54           HB       THR  54  -7.016   2.356 -12.816
  399    HG1  THR  54           HG1      THR  54  -5.914   1.642 -11.020
  400   HG21  THR  54          HG21      THR  54  -9.268   3.511 -12.378
  401   HG22  THR  54          HG22      THR  54  -7.801   4.440 -12.068
  402   HG23  THR  54          HG23      THR  54  -8.691   3.721 -10.725
  403    H    ALA  55           HN       ALA  55  -7.754   0.562 -14.257
  404    HA   ALA  55           HA       ALA  55  -9.999   1.612 -15.632
  405    HB1  ALA  55           HB1      ALA  55  -9.007   0.133 -17.543
  406    HB2  ALA  55           HB2      ALA  55  -8.113   1.538 -16.963
  407    HB3  ALA  55           HB3      ALA  55  -7.663  -0.079 -16.421
  408    H    ALA  56           HN       ALA  56  -9.206  -1.587 -14.418
  409    HA   ALA  56           HA       ALA  56 -11.274  -2.994 -15.716
  410    HB1  ALA  56           HB1      ALA  56 -10.801  -4.107 -13.128
  411    HB2  ALA  56           HB2      ALA  56 -10.294  -4.711 -14.705
  412    HB3  ALA  56           HB3      ALA  56  -9.267  -3.582 -13.822
  413    H    VAL  57           HN       VAL  57 -11.155  -1.442 -12.510
  414    HA   VAL  57           HA       VAL  57 -13.831  -2.077 -11.836
  415    HB   VAL  57           HB       VAL  57 -12.153   0.195 -10.799
  416   HG11  VAL  57          HG11      VAL  57 -13.923  -0.827  -8.844
  417   HG12  VAL  57          HG12      VAL  57 -13.920   0.774  -9.586
  418   HG13  VAL  57          HG13      VAL  57 -14.862  -0.531 -10.308
  419   HG21  VAL  57          HG21      VAL  57 -11.583  -1.311  -8.953
  420   HG22  VAL  57          HG22      VAL  57 -12.477  -2.609  -9.743
  421   HG23  VAL  57          HG23      VAL  57 -11.031  -1.946 -10.503
  422    H    ALA  58           HN       ALA  58 -12.337   0.811 -13.288
  423    HA   ALA  58           HA       ALA  58 -14.707   2.331 -13.435
  424    HB1  ALA  58           HB1      ALA  58 -13.092   3.798 -13.898
  425    HB2  ALA  58           HB2      ALA  58 -11.988   2.532 -14.439
  426    HB3  ALA  58           HB3      ALA  58 -13.179   3.199 -15.554
  427    H    GLY  59           HN       GLY  59 -13.306  -0.074 -15.552
  428    HA2  GLY  59           HA1      GLY  59 -15.128   0.437 -17.723
  429    HA3  GLY  59           HA2      GLY  59 -13.993  -0.899 -17.603
  430    H    LEU  60           HN       LEU  60 -15.277  -1.357 -14.822
  431    HA   LEU  60           HA       LEU  60 -17.213  -3.271 -15.780
  432    HB2  LEU  60           HB2      LEU  60 -15.598  -2.903 -13.426
  433    HB3  LEU  60           HB3      LEU  60 -17.257  -3.255 -12.985
  434    HG   LEU  60           HG       LEU  60 -15.717  -4.974 -14.918
  435   HD11  LEU  60          HD11      LEU  60 -15.977  -6.204 -12.375
  436   HD12  LEU  60          HD12      LEU  60 -14.505  -5.816 -13.267
  437   HD13  LEU  60          HD13      LEU  60 -15.199  -4.636 -12.154
  438   HD21  LEU  60          HD21      LEU  60 -18.135  -5.218 -14.952
  439   HD22  LEU  60          HD22      LEU  60 -17.377  -6.648 -14.252
  440   HD23  LEU  60          HD23      LEU  60 -18.149  -5.457 -13.205
  441    H    GLY  61           HN       GLY  61 -17.543  -0.195 -15.534
  442    HA2  GLY  61           HA1      GLY  61 -19.607   0.945 -15.641
  443    HA3  GLY  61           HA2      GLY  61 -20.345  -0.349 -14.710
  444    H    TYR  62           HN       TYR  62 -17.609   0.160 -13.117
  445    HA   TYR  62           HA       TYR  62 -18.922   1.944 -11.203
  446    HB2  TYR  62           HB2      TYR  62 -16.416   0.336 -10.732
  447    HB3  TYR  62           HB3      TYR  62 -17.512   1.010  -9.538
  448    HD1  TYR  62           HD2      TYR  62 -20.127   0.097 -10.340
  449    HD2  TYR  62           HD1      TYR  62 -16.405  -1.950 -10.522
  450    HE1  TYR  62           HE2      TYR  62 -21.308  -2.053 -10.190
  451    HE2  TYR  62           HE1      TYR  62 -17.574  -4.106 -10.371
  452    HH   TYR  62           HH       TYR  62 -20.725  -4.416  -9.382
  453    H    LYS  63           HN       LYS  63 -16.822   2.933  -9.804
  454    HA   LYS  63           HA       LYS  63 -15.088   4.274 -11.762
  455    HB2  LYS  63           HB2      LYS  63 -16.676   5.554  -9.530
  456    HB3  LYS  63           HB3      LYS  63 -15.297   6.343 -10.282
  457    HG2  LYS  63           HG2      LYS  63 -16.717   7.192 -11.754
  458    HG3  LYS  63           HG3      LYS  63 -16.889   5.565 -12.419
  459    HD2  LYS  63           HD2      LYS  63 -18.874   5.179 -11.313
  460    HD3  LYS  63           HD3      LYS  63 -18.516   6.351 -10.043
  461    HE2  LYS  63           HE2      LYS  63 -19.298   8.107 -11.253
  462    HE3  LYS  63           HE3      LYS  63 -18.797   7.404 -12.792
  463    HZ1  LYS  63           HZ1      LYS  63 -21.114   6.468 -11.187
  464    HZ2  LYS  63           HZ2      LYS  63 -20.669   5.929 -12.735
  465    HZ3  LYS  63           HZ3      LYS  63 -21.227   7.514 -12.515
  466    H    ALA  64           HN       ALA  64 -13.045   3.762 -11.263
  467    HA   ALA  64           HA       ALA  64 -12.413   3.216  -8.446
  468    HB1  ALA  64           HB1      ALA  64 -11.924   1.617 -10.513
  469    HB2  ALA  64           HB2      ALA  64 -10.453   2.590 -10.579
  470    HB3  ALA  64           HB3      ALA  64 -10.857   1.702  -9.110
  471    H    THR  65           HN       THR  65 -10.677   4.158  -7.442
  472    HA   THR  65           HA       THR  65  -9.122   6.158  -8.921
  473    HB   THR  65           HB       THR  65  -9.379   7.113  -6.261
  474    HG1  THR  65           HG1      THR  65 -11.783   6.196  -7.403
  475   HG21  THR  65          HG21      THR  65 -10.839   8.342  -8.560
  476   HG22  THR  65          HG22      THR  65  -9.078   8.254  -8.596
  477   HG23  THR  65          HG23      THR  65  -9.891   9.118  -7.289
  478    H    LEU  66           HN       LEU  66  -7.453   6.935  -6.804
  479    HA   LEU  66           HA       LEU  66  -6.524   4.528  -5.509
  480    HB2  LEU  66           HB2      LEU  66  -4.265   4.643  -6.484
  481    HB3  LEU  66           HB3      LEU  66  -5.501   4.230  -7.657
  482    HG   LEU  66           HG       LEU  66  -5.089   7.079  -7.648
  483   HD11  LEU  66          HD11      LEU  66  -2.648   5.341  -7.833
  484   HD12  LEU  66          HD12      LEU  66  -2.749   6.892  -8.668
  485   HD13  LEU  66          HD13      LEU  66  -2.881   6.826  -6.910
  486   HD21  LEU  66          HD21      LEU  66  -4.429   6.487 -10.053
  487   HD22  LEU  66          HD22      LEU  66  -4.843   4.830  -9.618
  488   HD23  LEU  66          HD23      LEU  66  -6.067   6.097  -9.530
  489    H    ALA  67           HN       ALA  67  -5.581   4.942  -3.654
  490    HA   ALA  67           HA       ALA  67  -4.386   7.589  -3.196
  491    HB1  ALA  67           HB1      ALA  67  -5.511   6.359  -0.800
  492    HB2  ALA  67           HB2      ALA  67  -5.655   8.013  -1.392
  493    HB3  ALA  67           HB3      ALA  67  -6.732   6.760  -2.009
  494    H    ASP  68           HN       ASP  68  -2.274   7.192  -3.029
  495    HA   ASP  68           HA       ASP  68  -1.206   4.633  -2.704
  496    HB2  ASP  68           HB2      ASP  68  -0.163   6.672  -3.834
  497    HB3  ASP  68           HB3      ASP  68   0.341   7.167  -2.223
  498    H    ALA  69           HN       ALA  69  -1.993   7.056  -0.359
  499    HA   ALA  69           HA       ALA  69  -0.808   5.367   1.737
  500    HB1  ALA  69           HB1      ALA  69   0.027   7.912   1.117
  501    HB2  ALA  69           HB2      ALA  69  -1.079   8.172   2.464
  502    HB3  ALA  69           HB3      ALA  69   0.294   7.082   2.648
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1   2.574  -1.023  -0.874
    2    H2   MET   1           H2       MET   1   2.241  -0.628   0.743
    3    H3   MET   1           H3       MET   1   1.708   0.386  -0.510
    4    HA   MET   1           HA       MET   1   0.824  -2.349  -0.707
    5    HB2  MET   1           HB2      MET   1   0.724  -1.815   1.772
    6    HB3  MET   1           HB3      MET   1  -0.433  -0.552   1.369
    7    HG2  MET   1           HG2      MET   1  -1.323  -2.822   2.134
    8    HG3  MET   1           HG3      MET   1  -2.058  -2.067   0.721
    9    HE1  MET   1           HE1      MET   1  -1.395  -5.939   1.381
   10    HE2  MET   1           HE2      MET   1  -2.593  -4.656   1.558
   11    HE3  MET   1           HE3      MET   1  -2.543  -5.621   0.081
   12    H    THR   2           HN       THR   2  -0.552  -2.343  -2.340
   13    HA   THR   2           HA       THR   2  -1.435   0.166  -3.447
   14    HB   THR   2           HB       THR   2  -2.359  -2.466  -4.510
   15    HG1  THR   2           HG1      THR   2   0.303  -1.441  -4.745
   16   HG21  THR   2          HG21      THR   2  -1.166  -0.146  -6.002
   17   HG22  THR   2          HG22      THR   2  -2.856  -0.144  -5.499
   18   HG23  THR   2          HG23      THR   2  -2.262  -1.392  -6.596
   19    H    HIS   3           HN       HIS   3  -3.283   1.124  -2.943
   20    HA   HIS   3           HA       HIS   3  -5.554  -0.561  -2.138
   21    HB2  HIS   3           HB2      HIS   3  -5.120   2.343  -1.436
   22    HB3  HIS   3           HB3      HIS   3  -6.417   1.311  -0.870
   23    HD1  HIS   3           HD1      HIS   3  -3.307   2.656   0.234
   24    HD2  HIS   3           HD2      HIS   3  -5.231  -1.013   0.668
   25    HE1  HIS   3           HE1      HIS   3  -2.218   1.546   2.205
   26    HE2  HIS   3           HE2      HIS   3  -3.503  -0.595   2.552
   27    H    LEU   4           HN       LEU   4  -7.362  -0.385  -3.314
   28    HA   LEU   4           HA       LEU   4  -7.387   1.642  -5.450
   29    HB2  LEU   4           HB2      LEU   4  -7.996  -1.163  -5.448
   30    HB3  LEU   4           HB3      LEU   4  -9.408  -0.256  -5.935
   31    HG   LEU   4           HG       LEU   4  -7.827   0.931  -7.593
   32   HD11  LEU   4          HD11      LEU   4  -6.129  -1.290  -6.583
   33   HD12  LEU   4          HD12      LEU   4  -6.054  -0.888  -8.299
   34   HD13  LEU   4          HD13      LEU   4  -5.681   0.340  -7.089
   35   HD21  LEU   4          HD21      LEU   4  -9.629  -0.857  -8.012
   36   HD22  LEU   4          HD22      LEU   4  -8.417  -0.579  -9.262
   37   HD23  LEU   4          HD23      LEU   4  -8.275  -1.972  -8.189
   38    H    LYS   5           HN       LYS   5  -9.109   2.967  -5.652
   39    HA   LYS   5           HA       LYS   5 -10.820   3.056  -3.271
   40    HB2  LYS   5           HB2      LYS   5  -9.393   5.041  -4.681
   41    HB3  LYS   5           HB3      LYS   5 -11.098   5.400  -4.882
   42    HG2  LYS   5           HG2      LYS   5  -9.685   4.994  -2.253
   43    HG3  LYS   5           HG3      LYS   5 -10.137   6.549  -2.951
   44    HD2  LYS   5           HD2      LYS   5 -12.155   4.392  -2.381
   45    HD3  LYS   5           HD3      LYS   5 -11.683   5.585  -1.169
   46    HE2  LYS   5           HE2      LYS   5 -12.253   6.987  -3.555
   47    HE3  LYS   5           HE3      LYS   5 -13.561   5.832  -3.309
   48    HZ1  LYS   5           HZ1      LYS   5 -13.333   6.818  -0.854
   49    HZ2  LYS   5           HZ2      LYS   5 -14.349   7.500  -2.036
   50    HZ3  LYS   5           HZ3      LYS   5 -12.824   8.171  -1.747
   51    H    ILE   6           HN       ILE   6 -12.854   2.665  -3.364
   52    HA   ILE   6           HA       ILE   6 -14.111   2.084  -5.907
   53    HB   ILE   6           HB       ILE   6 -14.720   1.512  -3.050
   54   HG12  ILE   6          HG12      ILE   6 -15.533  -0.643  -4.233
   55   HG13  ILE   6          HG13      ILE   6 -14.778   0.039  -5.670
   56   HG21  ILE   6          HG21      ILE   6 -16.745   2.702  -3.726
   57   HG22  ILE   6          HG22      ILE   6 -16.914   1.626  -5.112
   58   HG23  ILE   6          HG23      ILE   6 -17.056   0.983  -3.477
   59   HD11  ILE   6          HD11      ILE   6 -12.636   0.035  -4.622
   60   HD12  ILE   6          HD12      ILE   6 -13.340  -0.430  -3.073
   61   HD13  ILE   6          HD13      ILE   6 -13.357  -1.562  -4.425
   62    H    THR   7           HN       THR   7 -15.272   3.540  -7.008
   63    HA   THR   7           HA       THR   7 -16.350   5.851  -5.526
   64    HB   THR   7           HB       THR   7 -15.823   6.341  -8.359
   65    HG1  THR   7           HG1      THR   7 -13.911   5.080  -6.929
   66   HG21  THR   7          HG21      THR   7 -15.317   8.448  -7.626
   67   HG22  THR   7          HG22      THR   7 -14.537   7.871  -6.154
   68   HG23  THR   7          HG23      THR   7 -16.296   7.905  -6.263
   69    H    GLY   8           HN       GLY   8 -18.364   6.624  -6.175
   70    HA2  GLY   8           HA1      GLY   8 -20.431   6.515  -7.272
   71    HA3  GLY   8           HA2      GLY   8 -19.852   5.130  -8.192
   72    H    MET   9           HN       MET   9 -19.075   3.370  -6.387
   73    HA   MET   9           HA       MET   9 -21.497   2.623  -4.987
   74    HB2  MET   9           HB2      MET   9 -18.916   1.087  -4.955
   75    HB3  MET   9           HB3      MET   9 -20.556   0.497  -4.745
   76    HG2  MET   9           HG2      MET   9 -21.047   0.680  -6.988
   77    HG3  MET   9           HG3      MET   9 -19.696   1.765  -7.300
   78    HE1  MET   9           HE1      MET   9 -16.627  -0.372  -6.916
   79    HE2  MET   9           HE2      MET   9 -17.161   0.517  -8.341
   80    HE3  MET   9           HE3      MET   9 -17.399   1.203  -6.734
   81    H    THR  10           HN       THR  10 -21.447   2.032  -2.653
   82    HA   THR  10           HA       THR  10 -19.246   3.260  -1.155
   83    HB   THR  10           HB       THR  10 -21.819   3.848   0.022
   84    HG1  THR  10           HG1      THR  10 -22.796   4.751  -1.599
   85   HG21  THR  10          HG21      THR  10 -20.861   6.093   0.216
   86   HG22  THR  10          HG22      THR  10 -19.538   5.623  -0.851
   87   HG23  THR  10          HG23      THR  10 -19.705   4.866   0.734
   88    H    CYS  11           HN       CYS  11 -20.219   0.426  -1.518
   89    HA   CYS  11           HA       CYS  11 -20.451  -0.244   1.295
   90    HB2  CYS  11           HB2      CYS  11 -22.516  -1.545   0.980
   91    HB3  CYS  11           HB3      CYS  11 -22.760   0.182   0.739
   92    HG   CYS  11           HG       CYS  11 -24.291  -1.375  -1.092
   93    H    ASP  12           HN       ASP  12 -20.267  -2.465   1.763
   94    HA   ASP  12           HA       ASP  12 -18.418  -3.980   0.408
   95    HB2  ASP  12           HB2      ASP  12 -18.668  -4.917   2.440
   96    HB3  ASP  12           HB3      ASP  12 -20.348  -4.415   2.570
   97    H    SER  13           HN       SER  13 -21.927  -3.982  -0.007
   98    HA   SER  13           HA       SER  13 -22.187  -6.303  -1.534
   99    HB2  SER  13           HB2      SER  13 -23.997  -4.142  -2.335
  100    HB3  SER  13           HB3      SER  13 -24.362  -5.704  -1.596
  101    HG   SER  13           HG       SER  13 -23.874  -4.833   0.425
  102    H    CYS  14           HN       CYS  14 -21.076  -3.141  -2.372
  103    HA   CYS  14           HA       CYS  14 -21.022  -3.753  -5.223
  104    HB2  CYS  14           HB2      CYS  14 -20.449  -1.283  -3.590
  105    HB3  CYS  14           HB3      CYS  14 -20.138  -1.351  -5.320
  106    HG   CYS  14           HG       CYS  14 -22.777  -0.307  -3.971
  107    H    ALA  15           HN       ALA  15 -18.910  -3.097  -2.498
  108    HA   ALA  15           HA       ALA  15 -16.439  -3.040  -3.809
  109    HB1  ALA  15           HB1      ALA  15 -16.879  -2.306  -1.479
  110    HB2  ALA  15           HB2      ALA  15 -16.983  -4.002  -1.007
  111    HB3  ALA  15           HB3      ALA  15 -15.468  -3.354  -1.636
  112    H    ALA  16           HN       ALA  16 -18.454  -5.704  -2.823
  113    HA   ALA  16           HA       ALA  16 -16.543  -7.763  -2.858
  114    HB1  ALA  16           HB1      ALA  16 -19.125  -8.659  -3.792
  115    HB2  ALA  16           HB2      ALA  16 -18.289  -9.014  -2.280
  116    HB3  ALA  16           HB3      ALA  16 -19.286  -7.565  -2.417
  117    H    HIS  17           HN       HIS  17 -18.553  -6.390  -5.424
  118    HA   HIS  17           HA       HIS  17 -17.793  -8.248  -7.416
  119    HB2  HIS  17           HB2      HIS  17 -19.637  -6.227  -7.272
  120    HB3  HIS  17           HB3      HIS  17 -18.441  -5.549  -8.374
  121    HD1  HIS  17           HD1      HIS  17 -20.465  -5.786 -10.162
  122    HD2  HIS  17           HD2      HIS  17 -18.763  -9.331  -8.786
  123    HE1  HIS  17           HE1      HIS  17 -21.146  -7.560 -11.810
  124    HE2  HIS  17           HE2      HIS  17 -20.049  -9.682 -11.006
  125    H    VAL  18           HN       VAL  18 -16.497  -5.133  -6.411
  126    HA   VAL  18           HA       VAL  18 -14.534  -4.880  -8.422
  127    HB   VAL  18           HB       VAL  18 -14.433  -3.841  -5.585
  128   HG11  VAL  18          HG11      VAL  18 -12.566  -2.739  -6.112
  129   HG12  VAL  18          HG12      VAL  18 -12.456  -3.810  -7.508
  130   HG13  VAL  18          HG13      VAL  18 -13.214  -2.226  -7.669
  131   HG21  VAL  18          HG21      VAL  18 -16.469  -3.100  -6.602
  132   HG22  VAL  18          HG22      VAL  18 -15.335  -1.749  -6.589
  133   HG23  VAL  18          HG23      VAL  18 -15.622  -2.645  -8.081
  134    H    LYS  19           HN       LYS  19 -14.466  -6.269  -5.167
  135    HA   LYS  19           HA       LYS  19 -11.790  -7.087  -5.144
  136    HB2  LYS  19           HB2      LYS  19 -13.270  -7.048  -3.156
  137    HB3  LYS  19           HB3      LYS  19 -14.160  -8.416  -3.809
  138    HG2  LYS  19           HG2      LYS  19 -12.066  -9.746  -3.720
  139    HG3  LYS  19           HG3      LYS  19 -11.287  -8.380  -2.917
  140    HD2  LYS  19           HD2      LYS  19 -12.173  -8.946  -0.951
  141    HD3  LYS  19           HD3      LYS  19 -13.794  -9.030  -1.644
  142    HE2  LYS  19           HE2      LYS  19 -13.551 -11.201  -0.995
  143    HE3  LYS  19           HE3      LYS  19 -12.870 -11.308  -2.618
  144    HZ1  LYS  19           HZ1      LYS  19 -11.008 -12.053  -1.716
  145    HZ2  LYS  19           HZ2      LYS  19 -11.622 -11.839  -0.146
  146    HZ3  LYS  19           HZ3      LYS  19 -10.802 -10.573  -0.916
  147    H    GLU  20           HN       GLU  20 -14.703  -8.689  -6.331
  148    HA   GLU  20           HA       GLU  20 -13.511 -11.139  -7.023
  149    HB2  GLU  20           HB2      GLU  20 -16.058  -9.905  -7.267
  150    HB3  GLU  20           HB3      GLU  20 -15.610 -10.512  -8.856
  151    HG2  GLU  20           HG2      GLU  20 -15.513 -12.712  -8.122
  152    HG3  GLU  20           HG3      GLU  20 -15.400 -12.241  -6.425
  153    H    ALA  21           HN       ALA  21 -13.997  -8.164  -8.857
  154    HA   ALA  21           HA       ALA  21 -13.029  -9.104 -11.327
  155    HB1  ALA  21           HB1      ALA  21 -14.043  -6.714 -10.377
  156    HB2  ALA  21           HB2      ALA  21 -12.381  -6.318 -10.817
  157    HB3  ALA  21           HB3      ALA  21 -13.465  -7.025 -12.015
  158    H    LEU  22           HN       LEU  22 -11.455  -7.721  -8.517
  159    HA   LEU  22           HA       LEU  22  -8.844  -7.587  -9.624
  160    HB2  LEU  22           HB2      LEU  22  -9.960  -7.521  -6.847
  161    HB3  LEU  22           HB3      LEU  22  -8.231  -7.664  -7.091
  162    HG   LEU  22           HG       LEU  22  -9.637  -5.469  -8.525
  163   HD11  LEU  22          HD11      LEU  22  -8.776  -4.531  -5.970
  164   HD12  LEU  22          HD12      LEU  22 -10.365  -4.407  -6.723
  165   HD13  LEU  22          HD13      LEU  22  -9.959  -5.821  -5.749
  166   HD21  LEU  22          HD21      LEU  22  -6.977  -5.701  -7.122
  167   HD22  LEU  22          HD22      LEU  22  -7.257  -5.843  -8.857
  168   HD23  LEU  22          HD23      LEU  22  -7.538  -4.304  -8.042
  169    H    GLU  23           HN       GLU  23 -10.524  -9.969  -7.611
  170    HA   GLU  23           HA       GLU  23  -8.285 -11.712  -7.386
  171    HB2  GLU  23           HB2      GLU  23 -11.140 -11.771  -6.626
  172    HB3  GLU  23           HB3      GLU  23 -10.364 -13.334  -6.832
  173    HG2  GLU  23           HG2      GLU  23  -8.598 -12.616  -5.257
  174    HG3  GLU  23           HG3      GLU  23  -9.499 -11.125  -4.988
  175    H    LYS  24           HN       LYS  24 -10.516 -11.157  -9.897
  176    HA   LYS  24           HA       LYS  24 -10.340 -13.722 -11.147
  177    HB2  LYS  24           HB2      LYS  24 -12.128 -12.079 -11.675
  178    HB3  LYS  24           HB3      LYS  24 -10.919 -11.016 -12.383
  179    HG2  LYS  24           HG2      LYS  24 -10.397 -12.841 -14.016
  180    HG3  LYS  24           HG3      LYS  24 -11.790 -13.718 -13.380
  181    HD2  LYS  24           HD2      LYS  24 -13.030 -12.610 -14.866
  182    HD3  LYS  24           HD3      LYS  24 -12.755 -11.164 -13.893
  183    HE2  LYS  24           HE2      LYS  24 -12.203 -10.745 -16.225
  184    HE3  LYS  24           HE3      LYS  24 -10.757 -10.658 -15.223
  185    HZ1  LYS  24           HZ1      LYS  24 -10.010 -12.723 -16.011
  186    HZ2  LYS  24           HZ2      LYS  24 -10.558 -11.908 -17.390
  187    HZ3  LYS  24           HZ3      LYS  24 -11.516 -13.121 -16.689
  188    H    VAL  25           HN       VAL  25  -8.380 -10.908 -10.968
  189    HA   VAL  25           HA       VAL  25  -6.651 -11.658 -13.167
  190    HB   VAL  25           HB       VAL  25  -6.514  -9.428 -11.132
  191   HG11  VAL  25          HG11      VAL  25  -4.541  -8.675 -11.982
  192   HG12  VAL  25          HG12      VAL  25  -4.305 -10.404 -12.247
  193   HG13  VAL  25          HG13      VAL  25  -4.832  -9.371 -13.576
  194   HG21  VAL  25          HG21      VAL  25  -8.314  -9.243 -12.794
  195   HG22  VAL  25          HG22      VAL  25  -7.095  -7.984 -12.998
  196   HG23  VAL  25          HG23      VAL  25  -7.121  -9.372 -14.086
  197    HA   PRO  26           HA       PRO  26  -4.321 -14.337 -10.451
  198    HB2  PRO  26           HB2      PRO  26  -2.400 -15.018 -12.243
  199    HB3  PRO  26           HB3      PRO  26  -4.030 -15.700 -12.272
  200    HG2  PRO  26           HG2      PRO  26  -2.877 -13.480 -13.915
  201    HG3  PRO  26           HG3      PRO  26  -3.919 -14.823 -14.421
  202    HD2  PRO  26           HD2      PRO  26  -4.869 -12.329 -13.979
  203    HD3  PRO  26           HD3      PRO  26  -5.834 -13.785 -13.662
  204    H    GLY  27           HN       GLY  27  -3.325 -11.366 -11.729
  205    HA2  GLY  27           HA1      GLY  27  -0.629 -11.416 -10.694
  206    HA3  GLY  27           HA2      GLY  27  -1.472 -10.020 -11.348
  207    H    VAL  28           HN       VAL  28  -3.693 -11.007  -9.339
  208    HA   VAL  28           HA       VAL  28  -2.752  -9.339  -7.144
  209    HB   VAL  28           HB       VAL  28  -5.469 -10.571  -7.641
  210   HG11  VAL  28          HG11      VAL  28  -5.335 -10.210  -5.324
  211   HG12  VAL  28          HG12      VAL  28  -4.447  -8.699  -5.522
  212   HG13  VAL  28          HG13      VAL  28  -6.157  -8.780  -5.947
  213   HG21  VAL  28          HG21      VAL  28  -4.198  -8.075  -8.540
  214   HG22  VAL  28          HG22      VAL  28  -5.533  -8.990  -9.241
  215   HG23  VAL  28          HG23      VAL  28  -5.826  -7.901  -7.885
  216    H    GLN  29           HN       GLN  29  -1.810 -10.246  -5.452
  217    HA   GLN  29           HA       GLN  29  -1.822 -13.103  -5.104
  218    HB2  GLN  29           HB2      GLN  29  -0.034 -11.094  -4.531
  219    HB3  GLN  29           HB3      GLN  29  -0.668 -11.499  -2.942
  220    HG2  GLN  29           HG2      GLN  29   0.946 -13.041  -2.954
  221    HG3  GLN  29           HG3      GLN  29  -0.191 -13.965  -3.930
  222   HE21  GLN  29          HE21      GLN  29   2.388 -11.559  -4.229
  223   HE22  GLN  29          HE22      GLN  29   3.048 -12.202  -5.700
  224    H    SER  30           HN       SER  30  -3.107 -10.295  -3.391
  225    HA   SER  30           HA       SER  30  -5.144 -11.959  -2.178
  226    HB2  SER  30           HB2      SER  30  -3.975 -10.235  -0.127
  227    HB3  SER  30           HB3      SER  30  -4.438 -11.932  -0.033
  228    HG   SER  30           HG       SER  30  -2.424 -12.368  -1.181
  229    H    ALA  31           HN       ALA  31  -7.021 -10.855  -2.033
  230    HA   ALA  31           HA       ALA  31  -6.897  -7.920  -2.248
  231    HB1  ALA  31           HB1      ALA  31  -8.105  -7.911  -4.121
  232    HB2  ALA  31           HB2      ALA  31  -7.827  -9.651  -4.214
  233    HB3  ALA  31           HB3      ALA  31  -9.288  -9.031  -3.444
  234    H    LEU  32           HN       LEU  32  -7.493  -7.266  -0.273
  235    HA   LEU  32           HA       LEU  32  -9.931  -8.450   0.890
  236    HB2  LEU  32           HB2      LEU  32  -7.955  -6.877   2.496
  237    HB3  LEU  32           HB3      LEU  32  -9.098  -8.092   3.036
  238    HG   LEU  32           HG       LEU  32  -7.074  -9.158   1.219
  239   HD11  LEU  32          HD11      LEU  32  -5.157  -8.829   2.436
  240   HD12  LEU  32          HD12      LEU  32  -5.945  -7.264   2.636
  241   HD13  LEU  32          HD13      LEU  32  -6.031  -8.467   3.924
  242   HD21  LEU  32          HD21      LEU  32  -8.011  -9.872   3.993
  243   HD22  LEU  32          HD22      LEU  32  -8.573 -10.575   2.477
  244   HD23  LEU  32          HD23      LEU  32  -6.914 -10.844   3.011
  245    H    VAL  33           HN       VAL  33 -11.607  -7.146   0.449
  246    HA   VAL  33           HA       VAL  33 -11.110  -4.308   0.054
  247    HB   VAL  33           HB       VAL  33 -12.599  -5.794  -1.457
  248   HG11  VAL  33          HG11      VAL  33 -14.076  -6.793   0.089
  249   HG12  VAL  33          HG12      VAL  33 -14.473  -5.240   0.825
  250   HG13  VAL  33          HG13      VAL  33 -15.030  -5.609  -0.807
  251   HG21  VAL  33          HG21      VAL  33 -14.209  -3.753  -1.695
  252   HG22  VAL  33          HG22      VAL  33 -13.110  -3.013  -0.531
  253   HG23  VAL  33          HG23      VAL  33 -12.495  -3.596  -2.078
  254    H    SER  34           HN       SER  34 -12.208  -2.655   1.148
  255    HA   SER  34           HA       SER  34 -13.248  -3.459   3.784
  256    HB2  SER  34           HB2      SER  34 -12.097  -0.750   3.526
  257    HB3  SER  34           HB3      SER  34 -11.914  -1.939   4.817
  258    HG   SER  34           HG       SER  34 -10.610  -3.073   3.025
  259    H    TYR  35           HN       TYR  35 -15.380  -3.316   3.545
  260    HA   TYR  35           HA       TYR  35 -16.866  -1.557   2.001
  261    HB2  TYR  35           HB2      TYR  35 -18.242  -3.172   2.750
  262    HB3  TYR  35           HB3      TYR  35 -17.378  -3.354   4.264
  263    HD1  TYR  35           HD1      TYR  35 -19.549  -0.812   2.602
  264    HD2  TYR  35           HD2      TYR  35 -18.606  -2.902   6.186
  265    HE1  TYR  35           HE1      TYR  35 -21.383   0.344   3.751
  266    HE2  TYR  35           HE2      TYR  35 -20.444  -1.751   7.345
  267    HH   TYR  35           HH       TYR  35 -22.843  -0.011   5.690
  268    HA   PRO  36           HA       PRO  36 -17.410   1.400   5.774
  269    HB2  PRO  36           HB2      PRO  36 -15.568   1.355   7.760
  270    HB3  PRO  36           HB3      PRO  36 -17.022   0.351   7.778
  271    HG2  PRO  36           HG2      PRO  36 -14.232  -0.378   6.966
  272    HG3  PRO  36           HG3      PRO  36 -15.369  -1.280   7.988
  273    HD2  PRO  36           HD2      PRO  36 -14.987  -1.885   5.389
  274    HD3  PRO  36           HD3      PRO  36 -16.569  -2.062   6.176
  275    H    LYS  37           HN       LYS  37 -14.423   0.679   4.274
  276    HA   LYS  37           HA       LYS  37 -13.480   3.436   4.632
  277    HB2  LYS  37           HB2      LYS  37 -12.105   1.121   4.970
  278    HB3  LYS  37           HB3      LYS  37 -11.722   1.482   3.293
  279    HG2  LYS  37           HG2      LYS  37 -10.002   2.489   4.483
  280    HG3  LYS  37           HG3      LYS  37 -11.108   3.823   4.143
  281    HD2  LYS  37           HD2      LYS  37 -11.962   3.797   6.349
  282    HD3  LYS  37           HD3      LYS  37 -11.189   2.251   6.708
  283    HE2  LYS  37           HE2      LYS  37  -9.729   3.682   7.734
  284    HE3  LYS  37           HE3      LYS  37  -8.999   3.592   6.132
  285    HZ1  LYS  37           HZ1      LYS  37  -9.712   5.869   7.435
  286    HZ2  LYS  37           HZ2      LYS  37 -10.986   5.654   6.333
  287    HZ3  LYS  37           HZ3      LYS  37  -9.383   5.739   5.777
  288    H    GLY  38           HN       GLY  38 -14.930   1.326   2.401
  289    HA2  GLY  38           HA1      GLY  38 -15.505   1.557   0.189
  290    HA3  GLY  38           HA2      GLY  38 -15.093   3.259   0.350
  291    H    THR  39           HN       THR  39 -12.767   0.779   1.052
  292    HA   THR  39           HA       THR  39 -11.382   1.364  -1.474
  293    HB   THR  39           HB       THR  39  -9.472   0.968   0.639
  294    HG1  THR  39           HG1      THR  39 -11.497   2.908   1.073
  295   HG21  THR  39          HG21      THR  39 -10.018   2.837  -1.558
  296   HG22  THR  39          HG22      THR  39  -8.493   2.132  -1.017
  297   HG23  THR  39          HG23      THR  39  -9.155   3.543  -0.191
  298    H    ALA  40           HN       ALA  40  -9.738  -0.223  -2.022
  299    HA   ALA  40           HA       ALA  40 -10.271  -2.863  -0.826
  300    HB1  ALA  40           HB1      ALA  40  -9.076  -3.285  -3.307
  301    HB2  ALA  40           HB2      ALA  40 -10.779  -3.508  -2.899
  302    HB3  ALA  40           HB3      ALA  40 -10.226  -1.975  -3.573
  303    H    GLN  41           HN       GLN  41  -8.647  -3.760   0.219
  304    HA   GLN  41           HA       GLN  41  -5.946  -2.694  -0.064
  305    HB2  GLN  41           HB2      GLN  41  -6.727  -2.935   2.200
  306    HB3  GLN  41           HB3      GLN  41  -7.244  -4.588   1.906
  307    HG2  GLN  41           HG2      GLN  41  -5.284  -5.339   2.579
  308    HG3  GLN  41           HG3      GLN  41  -4.471  -4.399   1.328
  309   HE21  GLN  41          HE21      GLN  41  -5.235  -4.648   4.658
  310   HE22  GLN  41          HE22      GLN  41  -4.357  -3.258   5.190
  311    H    LEU  42           HN       LEU  42  -4.983  -3.548  -1.847
  312    HA   LEU  42           HA       LEU  42  -5.185  -6.460  -2.189
  313    HB2  LEU  42           HB2      LEU  42  -4.911  -5.980  -4.659
  314    HB3  LEU  42           HB3      LEU  42  -6.459  -5.586  -3.942
  315    HG   LEU  42           HG       LEU  42  -4.741  -3.286  -3.831
  316   HD11  LEU  42          HD11      LEU  42  -5.109  -4.520  -6.558
  317   HD12  LEU  42          HD12      LEU  42  -4.548  -2.877  -6.245
  318   HD13  LEU  42          HD13      LEU  42  -3.578  -4.255  -5.725
  319   HD21  LEU  42          HD21      LEU  42  -7.323  -3.936  -5.235
  320   HD22  LEU  42          HD22      LEU  42  -7.116  -3.113  -3.688
  321   HD23  LEU  42          HD23      LEU  42  -6.606  -2.326  -5.183
  322    H    ALA  43           HN       ALA  43  -3.377  -7.538  -2.278
  323    HA   ALA  43           HA       ALA  43  -0.848  -6.091  -2.666
  324    HB1  ALA  43           HB1      ALA  43   0.125  -7.541  -1.240
  325    HB2  ALA  43           HB2      ALA  43  -1.525  -7.908  -0.739
  326    HB3  ALA  43           HB3      ALA  43  -0.715  -8.929  -1.929
  327    H    ILE  44           HN       ILE  44  -0.117  -6.119  -4.690
  328    HA   ILE  44           HA       ILE  44  -0.842  -8.417  -6.396
  329    HB   ILE  44           HB       ILE  44  -0.471  -6.809  -8.322
  330   HG12  ILE  44          HG12      ILE  44  -1.155  -4.486  -6.685
  331   HG13  ILE  44          HG13      ILE  44   0.447  -5.123  -6.323
  332   HG21  ILE  44          HG21      ILE  44  -2.702  -6.118  -8.319
  333   HG22  ILE  44          HG22      ILE  44  -2.688  -7.558  -7.301
  334   HG23  ILE  44          HG23      ILE  44  -2.743  -5.958  -6.562
  335   HD11  ILE  44          HD11      ILE  44   0.700  -5.097  -8.928
  336   HD12  ILE  44          HD12      ILE  44  -0.587  -3.895  -8.821
  337   HD13  ILE  44          HD13      ILE  44   0.939  -3.633  -7.976
  338    H    VAL  45           HN       VAL  45   0.695  -8.717  -8.261
  339    HA   VAL  45           HA       VAL  45   3.419  -8.818  -7.268
  340    HB   VAL  45           HB       VAL  45   2.355  -9.681  -9.968
  341   HG11  VAL  45          HG11      VAL  45   4.822  -9.375  -9.750
  342   HG12  VAL  45          HG12      VAL  45   4.814 -10.622  -8.503
  343   HG13  VAL  45          HG13      VAL  45   4.327 -11.019 -10.151
  344   HG21  VAL  45          HG21      VAL  45   1.106 -10.973  -8.491
  345   HG22  VAL  45          HG22      VAL  45   2.493 -11.999  -8.853
  346   HG23  VAL  45          HG23      VAL  45   2.429 -11.107  -7.333
  347    HA   PRO  46           HA       PRO  46   4.660  -4.994  -9.247
  348    HB2  PRO  46           HB2      PRO  46   7.349  -6.222  -9.284
  349    HB3  PRO  46           HB3      PRO  46   6.807  -4.716  -8.534
  350    HG2  PRO  46           HG2      PRO  46   7.390  -6.861  -7.049
  351    HG3  PRO  46           HG3      PRO  46   6.047  -5.784  -6.625
  352    HD2  PRO  46           HD2      PRO  46   5.975  -8.462  -7.969
  353    HD3  PRO  46           HD3      PRO  46   4.909  -7.805  -6.709
  354    H    GLY  47           HN       GLY  47   3.436  -6.112 -11.093
  355    HA2  GLY  47           HA1      GLY  47   4.999  -5.909 -13.468
  356    HA3  GLY  47           HA2      GLY  47   4.582  -7.586 -13.118
  357    H    THR  48           HN       THR  48   2.079  -7.076 -11.892
  358    HA   THR  48           HA       THR  48   0.379  -6.609 -14.144
  359    HB   THR  48           HB       THR  48  -0.800  -6.518 -11.438
  360    HG1  THR  48           HG1      THR  48   0.458  -8.898 -12.407
  361   HG21  THR  48          HG21      THR  48  -2.358  -8.103 -12.413
  362   HG22  THR  48          HG22      THR  48  -1.330  -8.276 -13.835
  363   HG23  THR  48          HG23      THR  48  -2.129  -6.738 -13.506
  364    H    SER  49           HN       SER  49  -0.512  -4.764 -14.777
  365    HA   SER  49           HA       SER  49   0.299  -2.339 -13.531
  366    HB2  SER  49           HB2      SER  49  -1.638  -1.725 -15.443
  367    HB3  SER  49           HB3      SER  49   0.107  -1.774 -15.703
  368    HG   SER  49           HG       SER  49  -0.195  -3.453 -16.920
  369    HA   PRO  50           HA       PRO  50  -3.346  -2.404 -10.906
  370    HB2  PRO  50           HB2      PRO  50  -2.616  -0.346  -9.287
  371    HB3  PRO  50           HB3      PRO  50  -1.983  -1.986  -9.104
  372    HG2  PRO  50           HG2      PRO  50  -0.724   0.401 -10.380
  373    HG3  PRO  50           HG3      PRO  50   0.016  -0.857  -9.374
  374    HD2  PRO  50           HD2      PRO  50   0.196  -0.782 -12.104
  375    HD3  PRO  50           HD3      PRO  50   0.303  -2.273 -11.149
  376    H    ASP  51           HN       ASP  51  -2.094   0.237 -12.763
  377    HA   ASP  51           HA       ASP  51  -4.385   1.930 -12.445
  378    HB2  ASP  51           HB2      ASP  51  -2.138   2.757 -13.174
  379    HB3  ASP  51           HB3      ASP  51  -2.336   1.869 -14.679
  380    H    ALA  52           HN       ALA  52  -3.533  -0.856 -14.225
  381    HA   ALA  52           HA       ALA  52  -5.508  -0.542 -16.288
  382    HB1  ALA  52           HB1      ALA  52  -3.646  -1.823 -16.948
  383    HB2  ALA  52           HB2      ALA  52  -3.714  -2.818 -15.494
  384    HB3  ALA  52           HB3      ALA  52  -4.952  -2.989 -16.739
  385    H    LEU  53           HN       LEU  53  -5.203  -2.202 -13.225
  386    HA   LEU  53           HA       LEU  53  -7.671  -3.592 -13.327
  387    HB2  LEU  53           HB2      LEU  53  -6.345  -2.585 -10.816
  388    HB3  LEU  53           HB3      LEU  53  -7.388  -3.980 -10.998
  389    HG   LEU  53           HG       LEU  53  -4.688  -3.820 -12.315
  390   HD11  LEU  53          HD11      LEU  53  -3.990  -5.328 -10.389
  391   HD12  LEU  53          HD12      LEU  53  -4.142  -3.605 -10.046
  392   HD13  LEU  53          HD13      LEU  53  -5.414  -4.720  -9.544
  393   HD21  LEU  53          HD21      LEU  53  -4.988  -6.356 -12.077
  394   HD22  LEU  53          HD22      LEU  53  -6.688  -5.991 -11.780
  395   HD23  LEU  53          HD23      LEU  53  -5.939  -5.522 -13.306
  396    H    THR  54           HN       THR  54  -6.668  -0.469 -12.057
  397    HA   THR  54           HA       THR  54  -9.089   0.457 -11.055
  398    HB   THR  54           HB       THR  54  -6.963   2.082 -12.474
  399    HG1  THR  54           HG1      THR  54  -5.907   1.064 -10.835
  400   HG21  THR  54          HG21      THR  54  -9.071   3.288 -12.054
  401   HG22  THR  54          HG22      THR  54  -7.731   3.928 -11.103
  402   HG23  THR  54          HG23      THR  54  -8.937   2.891 -10.341
  403    H    ALA  55           HN       ALA  55  -7.726   0.804 -14.325
  404    HA   ALA  55           HA       ALA  55  -9.979   2.123 -15.413
  405    HB1  ALA  55           HB1      ALA  55  -7.784   2.223 -16.471
  406    HB2  ALA  55           HB2      ALA  55  -7.862   0.496 -16.819
  407    HB3  ALA  55           HB3      ALA  55  -8.996   1.604 -17.592
  408    H    ALA  56           HN       ALA  56  -9.128  -1.265 -15.058
  409    HA   ALA  56           HA       ALA  56 -11.148  -2.350 -16.699
  410    HB1  ALA  56           HB1      ALA  56 -10.219  -3.774 -14.244
  411    HB2  ALA  56           HB2      ALA  56 -10.561  -4.412 -15.852
  412    HB3  ALA  56           HB3      ALA  56  -9.092  -3.479 -15.568
  413    H    VAL  57           HN       VAL  57 -11.101  -1.568 -13.228
  414    HA   VAL  57           HA       VAL  57 -13.757  -2.464 -12.762
  415    HB   VAL  57           HB       VAL  57 -12.120  -0.510 -11.161
  416   HG11  VAL  57          HG11      VAL  57 -14.801  -0.916 -10.936
  417   HG12  VAL  57          HG12      VAL  57 -14.161  -2.111  -9.807
  418   HG13  VAL  57          HG13      VAL  57 -13.746  -0.407  -9.616
  419   HG21  VAL  57          HG21      VAL  57 -12.499  -3.168 -10.062
  420   HG22  VAL  57          HG22      VAL  57 -11.646  -3.191 -11.605
  421   HG23  VAL  57          HG23      VAL  57 -11.019  -2.231 -10.265
  422    H    ALA  58           HN       ALA  58 -12.349   0.738 -13.444
  423    HA   ALA  58           HA       ALA  58 -14.786   2.165 -13.369
  424    HB1  ALA  58           HB1      ALA  58 -12.850   3.472 -13.289
  425    HB2  ALA  58           HB2      ALA  58 -12.142   2.676 -14.694
  426    HB3  ALA  58           HB3      ALA  58 -13.503   3.780 -14.898
  427    H    GLY  59           HN       GLY  59 -13.432   0.041 -15.709
  428    HA2  GLY  59           HA1      GLY  59 -15.287   0.905 -17.791
  429    HA3  GLY  59           HA2      GLY  59 -14.041  -0.326 -17.949
  430    H    LEU  60           HN       LEU  60 -15.646  -0.863 -15.107
  431    HA   LEU  60           HA       LEU  60 -17.210  -3.002 -16.319
  432    HB2  LEU  60           HB2      LEU  60 -15.800  -2.626 -13.826
  433    HB3  LEU  60           HB3      LEU  60 -17.430  -3.208 -13.557
  434    HG   LEU  60           HG       LEU  60 -15.790  -4.614 -15.597
  435   HD11  LEU  60          HD11      LEU  60 -14.114  -5.020 -14.192
  436   HD12  LEU  60          HD12      LEU  60 -14.973  -4.279 -12.841
  437   HD13  LEU  60          HD13      LEU  60 -15.259  -5.971 -13.247
  438   HD21  LEU  60          HD21      LEU  60 -18.066  -5.313 -15.241
  439   HD22  LEU  60          HD22      LEU  60 -16.978  -6.557 -14.624
  440   HD23  LEU  60          HD23      LEU  60 -17.789  -5.459 -13.505
  441    H    GLY  61           HN       GLY  61 -17.799   0.034 -15.841
  442    HA2  GLY  61           HA1      GLY  61 -19.967   0.996 -15.950
  443    HA3  GLY  61           HA2      GLY  61 -20.608  -0.415 -15.121
  444    H    TYR  62           HN       TYR  62 -17.971   0.174 -13.424
  445    HA   TYR  62           HA       TYR  62 -19.339   1.963 -11.545
  446    HB2  TYR  62           HB2      TYR  62 -16.978   0.185 -10.923
  447    HB3  TYR  62           HB3      TYR  62 -18.089   0.947  -9.797
  448    HD1  TYR  62           HD2      TYR  62 -20.666   0.233 -10.316
  449    HD2  TYR  62           HD1      TYR  62 -17.202  -2.093 -11.149
  450    HE1  TYR  62           HE2      TYR  62 -22.035  -1.805 -10.285
  451    HE2  TYR  62           HE1      TYR  62 -18.563  -4.140 -11.122
  452    HH   TYR  62           HH       TYR  62 -20.607  -4.987 -10.400
  453    H    LYS  63           HN       LYS  63 -17.363   2.962 -10.051
  454    HA   LYS  63           HA       LYS  63 -15.419   4.068 -11.955
  455    HB2  LYS  63           HB2      LYS  63 -17.371   5.531 -10.707
  456    HB3  LYS  63           HB3      LYS  63 -16.025   5.715  -9.593
  457    HG2  LYS  63           HG2      LYS  63 -15.631   6.183 -12.516
  458    HG3  LYS  63           HG3      LYS  63 -16.346   7.431 -11.492
  459    HD2  LYS  63           HD2      LYS  63 -14.394   7.397 -10.047
  460    HD3  LYS  63           HD3      LYS  63 -13.682   6.095 -11.005
  461    HE2  LYS  63           HE2      LYS  63 -12.740   7.623 -12.312
  462    HE3  LYS  63           HE3      LYS  63 -14.348   8.151 -12.809
  463    HZ1  LYS  63           HZ1      LYS  63 -12.971   9.958 -11.910
  464    HZ2  LYS  63           HZ2      LYS  63 -12.909   9.159 -10.414
  465    HZ3  LYS  63           HZ3      LYS  63 -14.394   9.721 -11.014
  466    H    ALA  64           HN       ALA  64 -13.367   3.637 -11.434
  467    HA   ALA  64           HA       ALA  64 -12.797   3.013  -8.617
  468    HB1  ALA  64           HB1      ALA  64 -11.192   1.900 -10.886
  469    HB2  ALA  64           HB2      ALA  64 -11.324   1.321  -9.224
  470    HB3  ALA  64           HB3      ALA  64 -12.675   1.115 -10.340
  471    H    THR  65           HN       THR  65 -11.004   3.839  -7.703
  472    HA   THR  65           HA       THR  65  -9.134   5.362  -9.385
  473    HB   THR  65           HB       THR  65  -9.326   6.355  -6.637
  474    HG1  THR  65           HG1      THR  65 -11.633   5.975  -8.024
  475   HG21  THR  65          HG21      THR  65  -9.791   7.999  -9.086
  476   HG22  THR  65          HG22      THR  65  -8.196   7.296  -8.819
  477   HG23  THR  65          HG23      THR  65  -8.889   8.392  -7.623
  478    H    LEU  66           HN       LEU  66  -7.293   5.932  -7.294
  479    HA   LEU  66           HA       LEU  66  -6.723   3.411  -6.000
  480    HB2  LEU  66           HB2      LEU  66  -5.262   2.618  -7.474
  481    HB3  LEU  66           HB3      LEU  66  -5.659   3.938  -8.552
  482    HG   LEU  66           HG       LEU  66  -3.807   4.976  -6.699
  483   HD11  LEU  66          HD11      LEU  66  -2.692   3.162  -6.007
  484   HD12  LEU  66          HD12      LEU  66  -3.369   2.138  -7.272
  485   HD13  LEU  66          HD13      LEU  66  -1.989   3.178  -7.623
  486   HD21  LEU  66          HD21      LEU  66  -2.354   4.662  -8.921
  487   HD22  LEU  66          HD22      LEU  66  -3.964   4.383  -9.591
  488   HD23  LEU  66          HD23      LEU  66  -3.604   5.895  -8.757
  489    H    ALA  67           HN       ALA  67  -5.595   3.642  -4.205
  490    HA   ALA  67           HA       ALA  67  -4.388   6.275  -3.655
  491    HB1  ALA  67           HB1      ALA  67  -5.984   6.465  -2.089
  492    HB2  ALA  67           HB2      ALA  67  -6.392   4.750  -2.161
  493    HB3  ALA  67           HB3      ALA  67  -5.028   5.294  -1.183
  494    H    ASP  68           HN       ASP  68  -2.301   5.743  -4.056
  495    HA   ASP  68           HA       ASP  68  -1.071   3.343  -3.244
  496    HB2  ASP  68           HB2      ASP  68  -0.119   4.595  -5.059
  497    HB3  ASP  68           HB3      ASP  68   0.069   6.019  -4.043
  498    H    ALA  69           HN       ALA  69  -0.160   2.772  -1.364
  499    HA   ALA  69           HA       ALA  69   0.428   2.774   0.823
  500    HB1  ALA  69           HB1      ALA  69   2.207   4.178   0.645
  501    HB2  ALA  69           HB2      ALA  69   1.251   5.485  -0.052
  502    HB3  ALA  69           HB3      ALA  69   1.187   5.174   1.682
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1   3.222  -2.131  -2.787
    2    H2   MET   1           H2       MET   1   3.029  -0.552  -3.373
    3    H3   MET   1           H3       MET   1   2.041  -1.799  -3.958
    4    HA   MET   1           HA       MET   1   1.045  -2.076  -1.792
    5    HB2  MET   1           HB2      MET   1   3.218  -1.089  -0.713
    6    HB3  MET   1           HB3      MET   1   2.389   0.452  -0.903
    7    HG2  MET   1           HG2      MET   1   0.476  -1.165   0.245
    8    HG3  MET   1           HG3      MET   1   1.970  -1.665   1.036
    9    HE1  MET   1           HE1      MET   1   0.743  -1.166   3.022
   10    HE2  MET   1           HE2      MET   1   2.074  -0.225   3.695
   11    HE3  MET   1           HE3      MET   1   0.434   0.421   3.726
   12    H    THR   2           HN       THR   2  -0.398  -1.584  -3.593
   13    HA   THR   2           HA       THR   2  -1.121   1.249  -3.838
   14    HB   THR   2           HB       THR   2  -2.379  -0.849  -5.544
   15    HG1  THR   2           HG1      THR   2   0.325   0.052  -5.758
   16   HG21  THR   2          HG21      THR   2  -3.138   1.195  -6.228
   17   HG22  THR   2          HG22      THR   2  -1.676   1.107  -7.211
   18   HG23  THR   2          HG23      THR   2  -1.671   2.032  -5.710
   19    H    HIS   3           HN       HIS   3  -2.940   2.019  -2.973
   20    HA   HIS   3           HA       HIS   3  -5.047   0.114  -2.218
   21    HB2  HIS   3           HB2      HIS   3  -5.080   2.902  -1.158
   22    HB3  HIS   3           HB3      HIS   3  -5.666   1.422  -0.429
   23    HD1  HIS   3           HD1      HIS   3  -4.376   0.735   1.545
   24    HD2  HIS   3           HD2      HIS   3  -2.051   2.878  -1.149
   25    HE1  HIS   3           HE1      HIS   3  -2.116   0.958   2.626
   26    HE2  HIS   3           HE2      HIS   3  -0.853   2.522   1.107
   27    H    LEU   4           HN       LEU   4  -6.815   0.211  -3.402
   28    HA   LEU   4           HA       LEU   4  -7.115   2.404  -5.309
   29    HB2  LEU   4           HB2      LEU   4  -7.799  -0.437  -5.264
   30    HB3  LEU   4           HB3      LEU   4  -9.107   0.571  -5.844
   31    HG   LEU   4           HG       LEU   4  -7.185   1.592  -7.357
   32   HD11  LEU   4          HD11      LEU   4  -5.275   0.475  -7.397
   33   HD12  LEU   4          HD12      LEU   4  -5.874  -0.571  -6.110
   34   HD13  LEU   4          HD13      LEU   4  -6.130  -1.014  -7.797
   35   HD21  LEU   4          HD21      LEU   4  -8.377   0.655  -8.994
   36   HD22  LEU   4          HD22      LEU   4  -7.973  -0.977  -8.461
   37   HD23  LEU   4          HD23      LEU   4  -9.322  -0.116  -7.719
   38    H    LYS   5           HN       LYS   5  -9.123   3.470  -5.558
   39    HA   LYS   5           HA       LYS   5 -10.774   3.412  -3.121
   40    HB2  LYS   5           HB2      LYS   5  -9.547   5.556  -3.866
   41    HB3  LYS   5           HB3      LYS   5 -10.777   5.660  -5.117
   42    HG2  LYS   5           HG2      LYS   5 -11.712   6.962  -3.491
   43    HG3  LYS   5           HG3      LYS   5 -12.415   5.395  -3.088
   44    HD2  LYS   5           HD2      LYS   5 -10.370   5.120  -1.543
   45    HD3  LYS   5           HD3      LYS   5 -10.179   6.862  -1.734
   46    HE2  LYS   5           HE2      LYS   5 -12.915   6.107  -1.119
   47    HE3  LYS   5           HE3      LYS   5 -11.778   5.582   0.121
   48    HZ1  LYS   5           HZ1      LYS   5 -12.240   7.679   0.831
   49    HZ2  LYS   5           HZ2      LYS   5 -12.478   8.296  -0.735
   50    HZ3  LYS   5           HZ3      LYS   5 -10.904   8.013  -0.160
   51    H    ILE   6           HN       ILE   6 -12.814   2.788  -3.253
   52    HA   ILE   6           HA       ILE   6 -13.893   2.192  -5.917
   53    HB   ILE   6           HB       ILE   6 -14.883   1.269  -3.212
   54   HG12  ILE   6          HG12      ILE   6 -12.745   0.250  -3.621
   55   HG13  ILE   6          HG13      ILE   6 -13.981  -0.960  -3.956
   56   HG21  ILE   6          HG21      ILE   6 -15.744   0.624  -6.017
   57   HG22  ILE   6          HG22      ILE   6 -16.123  -0.419  -4.647
   58   HG23  ILE   6          HG23      ILE   6 -16.722   1.241  -4.686
   59   HD11  ILE   6          HD11      ILE   6 -11.879  -0.197  -5.601
   60   HD12  ILE   6          HD12      ILE   6 -13.253  -1.215  -6.031
   61   HD13  ILE   6          HD13      ILE   6 -13.313   0.522  -6.336
   62    H    THR   7           HN       THR   7 -15.333   3.565  -6.764
   63    HA   THR   7           HA       THR   7 -16.932   5.205  -4.927
   64    HB   THR   7           HB       THR   7 -16.400   6.801  -7.192
   65    HG1  THR   7           HG1      THR   7 -14.499   5.212  -7.234
   66   HG21  THR   7          HG21      THR   7 -16.012   6.861  -4.290
   67   HG22  THR   7          HG22      THR   7 -16.570   8.128  -5.379
   68   HG23  THR   7          HG23      THR   7 -14.843   7.837  -5.178
   69    H    GLY   8           HN       GLY   8 -18.873   6.054  -5.824
   70    HA2  GLY   8           HA1      GLY   8 -20.526   6.246  -7.502
   71    HA3  GLY   8           HA2      GLY   8 -19.718   4.985  -8.421
   72    H    MET   9           HN       MET   9 -19.489   3.005  -6.495
   73    HA   MET   9           HA       MET   9 -22.240   2.098  -6.447
   74    HB2  MET   9           HB2      MET   9 -19.659   0.652  -5.834
   75    HB3  MET   9           HB3      MET   9 -21.248  -0.081  -5.728
   76    HG2  MET   9           HG2      MET   9 -21.092   1.124  -8.253
   77    HG3  MET   9           HG3      MET   9 -19.581   0.249  -8.007
   78    HE1  MET   9           HE1      MET   9 -23.529  -1.400  -9.226
   79    HE2  MET   9           HE2      MET   9 -23.201   0.258  -8.721
   80    HE3  MET   9           HE3      MET   9 -22.368  -0.416 -10.119
   81    H    THR  10           HN       THR  10 -22.464   0.438  -4.408
   82    HA   THR  10           HA       THR  10 -22.697   2.315  -2.179
   83    HB   THR  10           HB       THR  10 -24.087  -0.220  -1.921
   84    HG1  THR  10           HG1      THR  10 -25.445   1.248  -3.776
   85   HG21  THR  10          HG21      THR  10 -25.868   1.959  -2.076
   86   HG22  THR  10          HG22      THR  10 -24.417   2.549  -1.265
   87   HG23  THR  10          HG23      THR  10 -25.275   1.148  -0.625
   88    H    CYS  11           HN       CYS  11 -20.162   1.096  -2.464
   89    HA   CYS  11           HA       CYS  11 -18.596  -0.242  -1.471
   90    HB2  CYS  11           HB2      CYS  11 -18.771  -0.302   1.053
   91    HB3  CYS  11           HB3      CYS  11 -18.623   1.265   0.290
   92    HG   CYS  11           HG       CYS  11 -21.806   0.508   0.712
   93    H    ASP  12           HN       ASP  12 -19.690  -1.672   1.157
   94    HA   ASP  12           HA       ASP  12 -19.553  -4.236   0.694
   95    HB2  ASP  12           HB2      ASP  12 -20.336  -4.077   2.792
   96    HB3  ASP  12           HB3      ASP  12 -21.322  -2.676   2.413
   97    H    SER  13           HN       SER  13 -20.407  -5.895  -0.343
   98    HA   SER  13           HA       SER  13 -21.668  -7.135  -1.772
   99    HB2  SER  13           HB2      SER  13 -23.579  -4.797  -2.004
  100    HB3  SER  13           HB3      SER  13 -23.859  -6.446  -2.562
  101    HG   SER  13           HG       SER  13 -23.277  -5.875   0.152
  102    H    CYS  14           HN       CYS  14 -21.709  -3.725  -2.833
  103    HA   CYS  14           HA       CYS  14 -21.091  -4.283  -5.536
  104    HB2  CYS  14           HB2      CYS  14 -20.503  -1.780  -3.931
  105    HB3  CYS  14           HB3      CYS  14 -20.557  -1.888  -5.688
  106    HG   CYS  14           HG       CYS  14 -23.295  -2.439  -5.805
  107    H    ALA  15           HN       ALA  15 -19.130  -3.516  -2.710
  108    HA   ALA  15           HA       ALA  15 -16.620  -3.495  -4.000
  109    HB1  ALA  15           HB1      ALA  15 -16.471  -2.516  -1.948
  110    HB2  ALA  15           HB2      ALA  15 -17.571  -3.671  -1.194
  111    HB3  ALA  15           HB3      ALA  15 -15.903  -4.133  -1.531
  112    H    ALA  16           HN       ALA  16 -18.673  -6.070  -2.901
  113    HA   ALA  16           HA       ALA  16 -16.703  -8.101  -2.706
  114    HB1  ALA  16           HB1      ALA  16 -19.652  -7.983  -2.758
  115    HB2  ALA  16           HB2      ALA  16 -18.924  -9.509  -3.263
  116    HB3  ALA  16           HB3      ALA  16 -18.567  -8.846  -1.667
  117    H    HIS  17           HN       HIS  17 -18.927  -7.124  -5.292
  118    HA   HIS  17           HA       HIS  17 -18.115  -8.983  -7.227
  119    HB2  HIS  17           HB2      HIS  17 -19.960  -6.937  -7.122
  120    HB3  HIS  17           HB3      HIS  17 -18.789  -6.326  -8.286
  121    HD1  HIS  17           HD1      HIS  17 -20.105  -9.876  -7.835
  122    HD2  HIS  17           HD2      HIS  17 -19.937  -6.845 -10.682
  123    HE1  HIS  17           HE1      HIS  17 -21.104 -10.853  -9.929
  124    HE2  HIS  17           HE2      HIS  17 -21.160  -8.944 -11.578
  125    H    VAL  18           HN       VAL  18 -16.933  -5.743  -6.464
  126    HA   VAL  18           HA       VAL  18 -14.972  -5.554  -8.468
  127    HB   VAL  18           HB       VAL  18 -15.053  -4.299  -5.716
  128   HG11  VAL  18          HG11      VAL  18 -13.352  -3.492  -8.070
  129   HG12  VAL  18          HG12      VAL  18 -13.383  -2.743  -6.474
  130   HG13  VAL  18          HG13      VAL  18 -12.765  -4.384  -6.666
  131   HG21  VAL  18          HG21      VAL  18 -15.468  -2.568  -8.005
  132   HG22  VAL  18          HG22      VAL  18 -16.669  -3.858  -7.921
  133   HG23  VAL  18          HG23      VAL  18 -16.444  -2.770  -6.550
  134    H    LYS  19           HN       LYS  19 -14.805  -6.730  -5.123
  135    HA   LYS  19           HA       LYS  19 -12.087  -7.306  -5.000
  136    HB2  LYS  19           HB2      LYS  19 -13.646  -7.368  -3.073
  137    HB3  LYS  19           HB3      LYS  19 -14.339  -8.855  -3.706
  138    HG2  LYS  19           HG2      LYS  19 -11.660  -9.437  -3.598
  139    HG3  LYS  19           HG3      LYS  19 -11.908  -8.427  -2.169
  140    HD2  LYS  19           HD2      LYS  19 -13.340  -9.932  -1.190
  141    HD3  LYS  19           HD3      LYS  19 -13.873 -10.592  -2.738
  142    HE2  LYS  19           HE2      LYS  19 -11.045 -11.043  -2.262
  143    HE3  LYS  19           HE3      LYS  19 -12.051 -11.740  -0.992
  144    HZ1  LYS  19           HZ1      LYS  19 -11.557 -12.752  -3.539
  145    HZ2  LYS  19           HZ2      LYS  19 -13.197 -12.306  -3.507
  146    HZ3  LYS  19           HZ3      LYS  19 -12.584 -13.387  -2.350
  147    H    GLU  20           HN       GLU  20 -14.767  -9.406  -6.017
  148    HA   GLU  20           HA       GLU  20 -13.123 -11.627  -6.610
  149    HB2  GLU  20           HB2      GLU  20 -15.902 -11.009  -6.711
  150    HB3  GLU  20           HB3      GLU  20 -15.437 -11.681  -8.268
  151    HG2  GLU  20           HG2      GLU  20 -16.047 -13.547  -7.050
  152    HG3  GLU  20           HG3      GLU  20 -14.291 -13.526  -6.889
  153    H    ALA  21           HN       ALA  21 -14.252  -8.915  -8.531
  154    HA   ALA  21           HA       ALA  21 -13.373  -9.854 -11.045
  155    HB1  ALA  21           HB1      ALA  21 -13.323  -6.938 -10.509
  156    HB2  ALA  21           HB2      ALA  21 -14.013  -7.828 -11.866
  157    HB3  ALA  21           HB3      ALA  21 -14.866  -7.771 -10.323
  158    H    LEU  22           HN       LEU  22 -11.819  -8.086  -8.448
  159    HA   LEU  22           HA       LEU  22  -9.406  -7.489  -9.794
  160    HB2  LEU  22           HB2      LEU  22 -10.177  -7.730  -6.903
  161    HB3  LEU  22           HB3      LEU  22  -8.511  -7.450  -7.368
  162    HG   LEU  22           HG       LEU  22 -10.755  -5.641  -8.236
  163   HD11  LEU  22          HD11      LEU  22 -10.718  -5.671  -5.811
  164   HD12  LEU  22          HD12      LEU  22  -8.977  -5.392  -5.817
  165   HD13  LEU  22          HD13      LEU  22 -10.070  -4.145  -6.416
  166   HD21  LEU  22          HD21      LEU  22  -7.845  -4.980  -7.939
  167   HD22  LEU  22          HD22      LEU  22  -8.478  -5.714  -9.411
  168   HD23  LEU  22          HD23      LEU  22  -9.084  -4.147  -8.878
  169    H    GLU  23           HN       GLU  23 -10.409 -10.184  -7.719
  170    HA   GLU  23           HA       GLU  23  -7.875 -11.497  -7.905
  171    HB2  GLU  23           HB2      GLU  23 -10.507 -12.079  -6.675
  172    HB3  GLU  23           HB3      GLU  23  -9.499 -13.469  -7.068
  173    HG2  GLU  23           HG2      GLU  23  -7.729 -12.674  -5.699
  174    HG3  GLU  23           HG3      GLU  23  -8.520 -11.119  -5.472
  175    H    LYS  24           HN       LYS  24 -10.539 -11.256  -9.981
  176    HA   LYS  24           HA       LYS  24 -10.121 -13.721 -11.398
  177    HB2  LYS  24           HB2      LYS  24 -11.977 -11.556 -11.492
  178    HB3  LYS  24           HB3      LYS  24 -11.283 -11.750 -13.095
  179    HG2  LYS  24           HG2      LYS  24 -12.529 -13.533 -13.484
  180    HG3  LYS  24           HG3      LYS  24 -11.967 -14.312 -12.004
  181    HD2  LYS  24           HD2      LYS  24 -13.747 -12.271 -11.220
  182    HD3  LYS  24           HD3      LYS  24 -14.512 -13.128 -12.559
  183    HE2  LYS  24           HE2      LYS  24 -13.242 -14.895 -10.618
  184    HE3  LYS  24           HE3      LYS  24 -14.537 -13.912  -9.933
  185    HZ1  LYS  24           HZ1      LYS  24 -15.924 -14.684 -11.850
  186    HZ2  LYS  24           HZ2      LYS  24 -15.519 -15.882 -10.727
  187    HZ3  LYS  24           HZ3      LYS  24 -14.700 -15.800 -12.212
  188    H    VAL  25           HN       VAL  25  -8.582 -10.704 -11.250
  189    HA   VAL  25           HA       VAL  25  -7.288 -10.876 -13.838
  190    HB   VAL  25           HB       VAL  25  -6.814  -9.054 -11.478
  191   HG11  VAL  25          HG11      VAL  25  -4.842  -8.693 -12.497
  192   HG12  VAL  25          HG12      VAL  25  -5.384  -9.392 -14.023
  193   HG13  VAL  25          HG13      VAL  25  -5.801  -7.727 -13.618
  194   HG21  VAL  25          HG21      VAL  25  -7.996  -7.365 -12.731
  195   HG22  VAL  25          HG22      VAL  25  -8.187  -8.464 -14.098
  196   HG23  VAL  25          HG23      VAL  25  -9.017  -8.796 -12.577
  197    HA   PRO  26           HA       PRO  26  -4.092 -13.490 -12.061
  198    HB2  PRO  26           HB2      PRO  26  -2.725 -13.136 -14.629
  199    HB3  PRO  26           HB3      PRO  26  -3.352 -14.613 -13.896
  200    HG2  PRO  26           HG2      PRO  26  -4.489 -13.475 -16.072
  201    HG3  PRO  26           HG3      PRO  26  -5.423 -14.375 -14.863
  202    HD2  PRO  26           HD2      PRO  26  -5.137 -11.416 -15.221
  203    HD3  PRO  26           HD3      PRO  26  -6.576 -12.367 -14.794
  204    H    GLY  27           HN       GLY  27  -3.384 -11.928 -10.619
  205    HA2  GLY  27           HA1      GLY  27  -0.748 -11.175 -10.765
  206    HA3  GLY  27           HA2      GLY  27  -1.645  -9.784 -11.372
  207    H    VAL  28           HN       VAL  28  -3.922 -10.678  -9.609
  208    HA   VAL  28           HA       VAL  28  -3.091  -9.302  -7.201
  209    HB   VAL  28           HB       VAL  28  -5.765 -10.393  -8.100
  210   HG11  VAL  28          HG11      VAL  28  -6.048  -8.513  -5.989
  211   HG12  VAL  28          HG12      VAL  28  -6.511 -10.215  -6.016
  212   HG13  VAL  28          HG13      VAL  28  -4.902  -9.748  -5.466
  213   HG21  VAL  28          HG21      VAL  28  -6.318  -8.276  -8.763
  214   HG22  VAL  28          HG22      VAL  28  -5.198  -7.507  -7.637
  215   HG23  VAL  28          HG23      VAL  28  -4.589  -8.267  -9.106
  216    H    GLN  29           HN       GLN  29  -2.127 -10.432  -5.653
  217    HA   GLN  29           HA       GLN  29  -2.366 -13.279  -5.436
  218    HB2  GLN  29           HB2      GLN  29  -0.285 -12.095  -4.875
  219    HB3  GLN  29           HB3      GLN  29  -1.109 -11.257  -3.569
  220    HG2  GLN  29           HG2      GLN  29  -1.460 -14.074  -3.266
  221    HG3  GLN  29           HG3      GLN  29   0.252 -13.707  -3.476
  222   HE21  GLN  29          HE21      GLN  29   0.542 -11.313  -2.266
  223   HE22  GLN  29          HE22      GLN  29   0.154 -11.445  -0.580
  224    H    SER  30           HN       SER  30  -3.496 -10.504  -3.549
  225    HA   SER  30           HA       SER  30  -5.807 -12.021  -2.696
  226    HB2  SER  30           HB2      SER  30  -3.681 -11.103  -0.764
  227    HB3  SER  30           HB3      SER  30  -5.355 -11.328  -0.254
  228    HG   SER  30           HG       SER  30  -4.116 -13.389  -1.692
  229    H    ALA  31           HN       ALA  31  -7.519 -10.711  -2.789
  230    HA   ALA  31           HA       ALA  31  -7.038  -7.808  -2.710
  231    HB1  ALA  31           HB1      ALA  31  -8.875  -9.538  -4.233
  232    HB2  ALA  31           HB2      ALA  31  -9.555  -8.016  -3.658
  233    HB3  ALA  31           HB3      ALA  31  -8.118  -8.008  -4.681
  234    H    LEU  32           HN       LEU  32  -7.503  -6.872  -0.838
  235    HA   LEU  32           HA       LEU  32  -9.809  -7.879   0.700
  236    HB2  LEU  32           HB2      LEU  32  -7.167  -6.753   1.555
  237    HB3  LEU  32           HB3      LEU  32  -8.565  -6.560   2.594
  238    HG   LEU  32           HG       LEU  32  -7.820  -9.285   1.605
  239   HD11  LEU  32          HD11      LEU  32  -6.766  -8.463   4.232
  240   HD12  LEU  32          HD12      LEU  32  -6.094  -9.565   3.030
  241   HD13  LEU  32          HD13      LEU  32  -5.922  -7.821   2.824
  242   HD21  LEU  32          HD21      LEU  32  -9.279  -8.157   3.978
  243   HD22  LEU  32          HD22      LEU  32  -9.903  -9.209   2.709
  244   HD23  LEU  32          HD23      LEU  32  -8.758  -9.839   3.894
  245    H    VAL  33           HN       VAL  33 -11.351  -6.575  -0.271
  246    HA   VAL  33           HA       VAL  33 -10.902  -3.700  -0.399
  247    HB   VAL  33           HB       VAL  33 -13.445  -5.171  -1.088
  248   HG11  VAL  33          HG11      VAL  33 -12.363  -2.493  -1.958
  249   HG12  VAL  33          HG12      VAL  33 -13.883  -3.217  -2.486
  250   HG13  VAL  33          HG13      VAL  33 -13.665  -2.759  -0.798
  251   HG21  VAL  33          HG21      VAL  33 -11.803  -6.188  -2.457
  252   HG22  VAL  33          HG22      VAL  33 -12.604  -4.981  -3.463
  253   HG23  VAL  33          HG23      VAL  33 -11.014  -4.644  -2.780
  254    H    SER  34           HN       SER  34 -11.492  -2.338   1.114
  255    HA   SER  34           HA       SER  34 -13.068  -3.318   3.372
  256    HB2  SER  34           HB2      SER  34 -11.490  -0.744   3.192
  257    HB3  SER  34           HB3      SER  34 -12.065  -1.559   4.647
  258    HG   SER  34           HG       SER  34 -10.621  -3.256   4.213
  259    H    TYR  35           HN       TYR  35 -15.172  -3.038   3.030
  260    HA   TYR  35           HA       TYR  35 -16.308  -1.067   1.400
  261    HB2  TYR  35           HB2      TYR  35 -18.132  -2.297   1.644
  262    HB3  TYR  35           HB3      TYR  35 -17.198  -3.345   2.681
  263    HD1  TYR  35           HD1      TYR  35 -19.398  -0.338   2.775
  264    HD2  TYR  35           HD2      TYR  35 -17.916  -3.724   4.887
  265    HE1  TYR  35           HE1      TYR  35 -20.944   0.142   4.626
  266    HE2  TYR  35           HE2      TYR  35 -19.463  -3.255   6.737
  267    HH   TYR  35           HH       TYR  35 -20.669  -0.872   7.569
  268    HA   PRO  36           HA       PRO  36 -17.395   1.370   5.480
  269    HB2  PRO  36           HB2      PRO  36 -15.061   0.818   7.193
  270    HB3  PRO  36           HB3      PRO  36 -16.777   0.870   7.609
  271    HG2  PRO  36           HG2      PRO  36 -15.428  -1.441   7.509
  272    HG3  PRO  36           HG3      PRO  36 -17.127  -1.331   7.008
  273    HD2  PRO  36           HD2      PRO  36 -14.652  -1.426   5.319
  274    HD3  PRO  36           HD3      PRO  36 -16.214  -2.239   5.078
  275    H    LYS  37           HN       LYS  37 -14.209   0.882   4.194
  276    HA   LYS  37           HA       LYS  37 -13.527   3.696   4.703
  277    HB2  LYS  37           HB2      LYS  37 -11.990   1.216   4.600
  278    HB3  LYS  37           HB3      LYS  37 -11.264   2.504   3.647
  279    HG2  LYS  37           HG2      LYS  37 -10.281   2.780   5.718
  280    HG3  LYS  37           HG3      LYS  37 -11.607   3.945   5.764
  281    HD2  LYS  37           HD2      LYS  37 -12.615   1.459   6.680
  282    HD3  LYS  37           HD3      LYS  37 -11.090   1.757   7.517
  283    HE2  LYS  37           HE2      LYS  37 -12.151   4.183   7.761
  284    HE3  LYS  37           HE3      LYS  37 -13.649   3.262   7.619
  285    HZ1  LYS  37           HZ1      LYS  37 -11.492   2.694   9.583
  286    HZ2  LYS  37           HZ2      LYS  37 -12.995   1.917   9.486
  287    HZ3  LYS  37           HZ3      LYS  37 -12.914   3.550   9.934
  288    H    GLY  38           HN       GLY  38 -14.676   1.674   2.297
  289    HA2  GLY  38           HA1      GLY  38 -15.073   1.996   0.059
  290    HA3  GLY  38           HA2      GLY  38 -14.667   3.686   0.319
  291    H    THR  39           HN       THR  39 -12.349   1.254   1.132
  292    HA   THR  39           HA       THR  39 -10.798   1.966  -1.265
  293    HB   THR  39           HB       THR  39  -8.972   1.269   0.753
  294    HG1  THR  39           HG1      THR  39 -10.878   3.195   1.663
  295   HG21  THR  39          HG21      THR  39  -9.731   3.766  -0.703
  296   HG22  THR  39          HG22      THR  39  -8.236   2.831  -0.776
  297   HG23  THR  39          HG23      THR  39  -8.564   3.860   0.617
  298    H    ALA  40           HN       ALA  40  -9.384   0.378  -2.044
  299    HA   ALA  40           HA       ALA  40 -10.029  -2.353  -1.156
  300    HB1  ALA  40           HB1      ALA  40 -10.636  -2.749  -3.257
  301    HB2  ALA  40           HB2      ALA  40 -10.137  -1.130  -3.748
  302    HB3  ALA  40           HB3      ALA  40  -8.972  -2.452  -3.757
  303    H    GLN  41           HN       GLN  41  -8.413  -3.282  -0.135
  304    HA   GLN  41           HA       GLN  41  -5.666  -2.406  -0.659
  305    HB2  GLN  41           HB2      GLN  41  -7.112  -3.535   1.654
  306    HB3  GLN  41           HB3      GLN  41  -5.490  -4.168   1.417
  307    HG2  GLN  41           HG2      GLN  41  -5.316  -2.350   2.911
  308    HG3  GLN  41           HG3      GLN  41  -4.671  -1.807   1.365
  309   HE21  GLN  41          HE21      GLN  41  -7.973  -2.066   2.658
  310   HE22  GLN  41          HE22      GLN  41  -8.389  -0.414   2.376
  311    H    LEU  42           HN       LEU  42  -5.271  -3.532  -2.603
  312    HA   LEU  42           HA       LEU  42  -5.479  -6.443  -2.413
  313    HB2  LEU  42           HB2      LEU  42  -4.792  -6.205  -4.961
  314    HB3  LEU  42           HB3      LEU  42  -6.449  -6.115  -4.420
  315    HG   LEU  42           HG       LEU  42  -5.785  -4.469  -6.184
  316   HD11  LEU  42          HD11      LEU  42  -7.633  -4.230  -4.323
  317   HD12  LEU  42          HD12      LEU  42  -6.637  -2.850  -3.863
  318   HD13  LEU  42          HD13      LEU  42  -7.305  -2.951  -5.492
  319   HD21  LEU  42          HD21      LEU  42  -3.719  -3.622  -5.782
  320   HD22  LEU  42          HD22      LEU  42  -4.704  -2.346  -5.066
  321   HD23  LEU  42          HD23      LEU  42  -3.955  -3.565  -4.035
  322    H    ALA  43           HN       ALA  43  -3.788  -7.720  -2.352
  323    HA   ALA  43           HA       ALA  43  -1.119  -6.540  -2.474
  324    HB1  ALA  43           HB1      ALA  43  -0.335  -8.501  -1.425
  325    HB2  ALA  43           HB2      ALA  43  -1.877  -8.155  -0.642
  326    HB3  ALA  43           HB3      ALA  43  -1.775  -9.415  -1.872
  327    H    ILE  44           HN       ILE  44  -0.462  -6.299  -4.526
  328    HA   ILE  44           HA       ILE  44  -1.146  -8.394  -6.467
  329    HB   ILE  44           HB       ILE  44  -0.233  -6.569  -8.109
  330   HG12  ILE  44          HG12      ILE  44  -1.298  -4.690  -6.030
  331   HG13  ILE  44          HG13      ILE  44   0.398  -5.162  -5.975
  332   HG21  ILE  44          HG21      ILE  44  -2.906  -6.404  -6.729
  333   HG22  ILE  44          HG22      ILE  44  -2.513  -5.595  -8.246
  334   HG23  ILE  44          HG23      ILE  44  -2.498  -7.357  -8.156
  335   HD11  ILE  44          HD11      ILE  44   0.900  -4.074  -7.939
  336   HD12  ILE  44          HD12      ILE  44  -0.762  -4.138  -8.524
  337   HD13  ILE  44          HD13      ILE  44  -0.322  -3.011  -7.241
  338    H    VAL  45           HN       VAL  45   0.479  -8.885  -8.118
  339    HA   VAL  45           HA       VAL  45   3.098  -9.267  -6.928
  340    HB   VAL  45           HB       VAL  45   2.099 -10.110  -9.659
  341   HG11  VAL  45          HG11      VAL  45   3.985 -11.469  -9.849
  342   HG12  VAL  45          HG12      VAL  45   4.618  -9.962  -9.188
  343   HG13  VAL  45          HG13      VAL  45   4.362 -11.350  -8.131
  344   HG21  VAL  45          HG21      VAL  45   1.046 -11.845  -8.748
  345   HG22  VAL  45          HG22      VAL  45   2.428 -12.233  -7.723
  346   HG23  VAL  45          HG23      VAL  45   1.239 -11.045  -7.189
  347    HA   PRO  46           HA       PRO  46   4.805  -5.537  -8.720
  348    HB2  PRO  46           HB2      PRO  46   7.297  -7.161  -8.525
  349    HB3  PRO  46           HB3      PRO  46   6.974  -5.520  -7.954
  350    HG2  PRO  46           HG2      PRO  46   7.077  -7.544  -6.236
  351    HG3  PRO  46           HG3      PRO  46   5.873  -6.256  -6.046
  352    HD2  PRO  46           HD2      PRO  46   5.529  -9.038  -7.085
  353    HD3  PRO  46           HD3      PRO  46   4.432  -8.063  -6.085
  354    H    GLY  47           HN       GLY  47   4.535  -5.179 -10.804
  355    HA2  GLY  47           HA1      GLY  47   5.837  -5.619 -12.978
  356    HA3  GLY  47           HA2      GLY  47   5.307  -7.277 -12.722
  357    H    THR  48           HN       THR  48   2.752  -6.779 -11.732
  358    HA   THR  48           HA       THR  48   1.305  -6.213 -14.131
  359    HB   THR  48           HB       THR  48  -0.308  -6.197 -11.708
  360    HG1  THR  48           HG1      THR  48   1.295  -7.473 -10.791
  361   HG21  THR  48          HG21      THR  48  -0.247  -8.392 -13.740
  362   HG22  THR  48          HG22      THR  48  -0.853  -6.797 -14.185
  363   HG23  THR  48          HG23      THR  48  -1.623  -7.699 -12.880
  364    H    SER  49           HN       SER  49   0.196  -4.414 -14.710
  365    HA   SER  49           HA       SER  49   0.946  -1.976 -13.449
  366    HB2  SER  49           HB2      SER  49  -1.214  -1.610 -15.306
  367    HB3  SER  49           HB3      SER  49   0.482  -1.163 -15.488
  368    HG   SER  49           HG       SER  49   0.895  -3.005 -16.525
  369    HA   PRO  50           HA       PRO  50  -2.412  -2.090 -10.516
  370    HB2  PRO  50           HB2      PRO  50  -1.566   0.634  -9.820
  371    HB3  PRO  50           HB3      PRO  50  -1.577  -0.821  -8.820
  372    HG2  PRO  50           HG2      PRO  50   0.717   0.286  -9.699
  373    HG3  PRO  50           HG3      PRO  50   0.532  -1.467  -9.499
  374    HD2  PRO  50           HD2      PRO  50   0.414   0.180 -12.000
  375    HD3  PRO  50           HD3      PRO  50   1.179  -1.400 -11.724
  376    H    ASP  51           HN       ASP  51  -1.900   0.312 -12.938
  377    HA   ASP  51           HA       ASP  51  -4.359   1.716 -12.472
  378    HB2  ASP  51           HB2      ASP  51  -2.120   2.430 -13.777
  379    HB3  ASP  51           HB3      ASP  51  -3.064   1.844 -15.145
  380    H    ALA  52           HN       ALA  52  -3.481  -1.220 -13.851
  381    HA   ALA  52           HA       ALA  52  -5.519  -1.333 -15.862
  382    HB1  ALA  52           HB1      ALA  52  -4.004  -3.617 -14.612
  383    HB2  ALA  52           HB2      ALA  52  -4.901  -3.646 -16.129
  384    HB3  ALA  52           HB3      ALA  52  -3.435  -2.674 -15.988
  385    H    LEU  53           HN       LEU  53  -5.211  -2.079 -12.490
  386    HA   LEU  53           HA       LEU  53  -7.636  -3.571 -12.240
  387    HB2  LEU  53           HB2      LEU  53  -6.401  -1.970 -10.020
  388    HB3  LEU  53           HB3      LEU  53  -7.283  -3.480  -9.922
  389    HG   LEU  53           HG       LEU  53  -4.591  -3.315 -11.254
  390   HD11  LEU  53          HD11      LEU  53  -3.911  -4.370  -8.941
  391   HD12  LEU  53          HD12      LEU  53  -3.913  -2.623  -9.188
  392   HD13  LEU  53          HD13      LEU  53  -5.264  -3.398  -8.359
  393   HD21  LEU  53          HD21      LEU  53  -6.538  -5.366 -10.806
  394   HD22  LEU  53          HD22      LEU  53  -5.010  -5.450 -11.683
  395   HD23  LEU  53          HD23      LEU  53  -5.049  -5.761  -9.948
  396    H    THR  54           HN       THR  54  -6.682  -0.215 -11.659
  397    HA   THR  54           HA       THR  54  -9.130   0.850 -10.904
  398    HB   THR  54           HB       THR  54  -7.590   2.592 -12.683
  399    HG1  THR  54           HG1      THR  54  -5.683   2.516 -11.483
  400   HG21  THR  54          HG21      THR  54  -9.113   3.496 -11.046
  401   HG22  THR  54          HG22      THR  54  -7.470   3.956 -10.604
  402   HG23  THR  54          HG23      THR  54  -8.279   2.646  -9.745
  403    H    ALA  55           HN       ALA  55  -7.717   0.565 -14.155
  404    HA   ALA  55           HA       ALA  55  -9.968   1.583 -15.530
  405    HB1  ALA  55           HB1      ALA  55  -8.448  -0.322 -17.094
  406    HB2  ALA  55           HB2      ALA  55  -8.638   1.418 -17.311
  407    HB3  ALA  55           HB3      ALA  55  -7.397   0.794 -16.223
  408    H    ALA  56           HN       ALA  56  -9.110  -1.646 -14.435
  409    HA   ALA  56           HA       ALA  56 -11.092  -3.057 -15.857
  410    HB1  ALA  56           HB1      ALA  56 -10.692  -4.213 -13.259
  411    HB2  ALA  56           HB2      ALA  56 -10.182  -4.809 -14.838
  412    HB3  ALA  56           HB3      ALA  56  -9.147  -3.698 -13.939
  413    H    VAL  57           HN       VAL  57 -11.143  -1.660 -12.573
  414    HA   VAL  57           HA       VAL  57 -13.846  -2.360 -12.083
  415    HB   VAL  57           HB       VAL  57 -12.275  -0.137 -10.803
  416   HG11  VAL  57          HG11      VAL  57 -14.102  -1.413  -9.038
  417   HG12  VAL  57          HG12      VAL  57 -14.079   0.268  -9.574
  418   HG13  VAL  57          HG13      VAL  57 -14.970  -0.941 -10.499
  419   HG21  VAL  57          HG21      VAL  57 -12.610  -2.775  -9.490
  420   HG22  VAL  57          HG22      VAL  57 -11.431  -2.652 -10.797
  421   HG23  VAL  57          HG23      VAL  57 -11.285  -1.614  -9.378
  422    H    ALA  58           HN       ALA  58 -12.302   0.589 -13.305
  423    HA   ALA  58           HA       ALA  58 -14.661   2.134 -13.466
  424    HB1  ALA  58           HB1      ALA  58 -12.836   3.482 -13.610
  425    HB2  ALA  58           HB2      ALA  58 -11.920   2.324 -14.575
  426    HB3  ALA  58           HB3      ALA  58 -13.179   3.303 -15.330
  427    H    GLY  59           HN       GLY  59 -13.196  -0.184 -15.625
  428    HA2  GLY  59           HA1      GLY  59 -15.028   0.450 -17.788
  429    HA3  GLY  59           HA2      GLY  59 -13.779  -0.785 -17.803
  430    H    LEU  60           HN       LEU  60 -15.504  -1.075 -14.985
  431    HA   LEU  60           HA       LEU  60 -17.182  -3.184 -16.132
  432    HB2  LEU  60           HB2      LEU  60 -15.627  -2.916 -13.697
  433    HB3  LEU  60           HB3      LEU  60 -17.256  -3.479 -13.390
  434    HG   LEU  60           HG       LEU  60 -15.606  -4.811 -15.500
  435   HD11  LEU  60          HD11      LEU  60 -14.169  -4.716 -13.527
  436   HD12  LEU  60          HD12      LEU  60 -15.463  -5.411 -12.552
  437   HD13  LEU  60          HD13      LEU  60 -14.725  -6.359 -13.843
  438   HD21  LEU  60          HD21      LEU  60 -17.212  -6.468 -13.767
  439   HD22  LEU  60          HD22      LEU  60 -18.170  -5.168 -14.477
  440   HD23  LEU  60          HD23      LEU  60 -17.278  -6.276 -15.520
  441    H    GLY  61           HN       GLY  61 -17.605  -0.158 -15.723
  442    HA2  GLY  61           HA1      GLY  61 -19.738   0.870 -15.795
  443    HA3  GLY  61           HA2      GLY  61 -20.388  -0.478 -14.876
  444    H    TYR  62           HN       TYR  62 -17.763   0.047 -13.189
  445    HA   TYR  62           HA       TYR  62 -19.109   1.917 -11.377
  446    HB2  TYR  62           HB2      TYR  62 -16.664   0.476 -10.503
  447    HB3  TYR  62           HB3      TYR  62 -18.133   0.836  -9.611
  448    HD1  TYR  62           HD2      TYR  62 -20.269  -0.472 -10.914
  449    HD2  TYR  62           HD1      TYR  62 -16.233  -1.777 -10.582
  450    HE1  TYR  62           HE2      TYR  62 -21.004  -2.804 -11.181
  451    HE2  TYR  62           HE1      TYR  62 -16.959  -4.110 -10.846
  452    HH   TYR  62           HH       TYR  62 -19.889  -5.008 -12.022
  453    H    LYS  63           HN       LYS  63 -17.221   3.068  -9.939
  454    HA   LYS  63           HA       LYS  63 -15.316   4.200 -11.873
  455    HB2  LYS  63           HB2      LYS  63 -17.386   5.611 -10.775
  456    HB3  LYS  63           HB3      LYS  63 -16.091   5.949  -9.634
  457    HG2  LYS  63           HG2      LYS  63 -16.329   6.690 -12.510
  458    HG3  LYS  63           HG3      LYS  63 -15.855   7.675 -11.128
  459    HD2  LYS  63           HD2      LYS  63 -13.890   5.708 -11.279
  460    HD3  LYS  63           HD3      LYS  63 -14.215   6.136 -12.960
  461    HE2  LYS  63           HE2      LYS  63 -12.871   7.887 -12.663
  462    HE3  LYS  63           HE3      LYS  63 -14.135   8.575 -11.644
  463    HZ1  LYS  63           HZ1      LYS  63 -11.944   8.522 -10.570
  464    HZ2  LYS  63           HZ2      LYS  63 -11.944   6.826 -10.655
  465    HZ3  LYS  63           HZ3      LYS  63 -13.104   7.629  -9.715
  466    H    ALA  64           HN       ALA  64 -13.387   3.434 -11.328
  467    HA   ALA  64           HA       ALA  64 -12.752   3.143  -8.482
  468    HB1  ALA  64           HB1      ALA  64 -11.698   1.280  -9.061
  469    HB2  ALA  64           HB2      ALA  64 -12.228   1.525 -10.724
  470    HB3  ALA  64           HB3      ALA  64 -10.675   2.167 -10.191
  471    H    THR  65           HN       THR  65 -10.948   4.017  -7.602
  472    HA   THR  65           HA       THR  65  -9.199   5.699  -9.224
  473    HB   THR  65           HB       THR  65  -9.833   6.893  -6.612
  474    HG1  THR  65           HG1      THR  65 -11.940   6.780  -6.882
  475   HG21  THR  65          HG21      THR  65 -10.256   8.535  -8.964
  476   HG22  THR  65          HG22      THR  65  -8.717   7.677  -9.042
  477   HG23  THR  65          HG23      THR  65  -9.077   8.717  -7.664
  478    H    LEU  66           HN       LEU  66  -7.850   6.683  -6.793
  479    HA   LEU  66           HA       LEU  66  -7.055   4.302  -5.364
  480    HB2  LEU  66           HB2      LEU  66  -4.570   4.928  -5.990
  481    HB3  LEU  66           HB3      LEU  66  -5.513   3.829  -6.979
  482    HG   LEU  66           HG       LEU  66  -6.019   6.391  -8.013
  483   HD11  LEU  66          HD11      LEU  66  -3.060   5.971  -7.653
  484   HD12  LEU  66          HD12      LEU  66  -3.862   7.312  -8.470
  485   HD13  LEU  66          HD13      LEU  66  -4.022   7.122  -6.725
  486   HD21  LEU  66          HD21      LEU  66  -5.617   3.978  -9.010
  487   HD22  LEU  66          HD22      LEU  66  -5.370   5.430  -9.981
  488   HD23  LEU  66          HD23      LEU  66  -3.989   4.611  -9.253
  489    H    ALA  67           HN       ALA  67  -6.154   4.734  -3.418
  490    HA   ALA  67           HA       ALA  67  -5.225   7.408  -2.781
  491    HB1  ALA  67           HB1      ALA  67  -6.861   8.021  -1.244
  492    HB2  ALA  67           HB2      ALA  67  -7.799   7.344  -2.575
  493    HB3  ALA  67           HB3      ALA  67  -7.502   6.383  -1.126
  494    H    ASP  68           HN       ASP  68  -3.523   7.156  -1.505
  495    HA   ASP  68           HA       ASP  68  -3.002   4.638  -0.255
  496    HB2  ASP  68           HB2      ASP  68  -1.151   5.767  -1.295
  497    HB3  ASP  68           HB3      ASP  68  -1.443   7.221  -0.347
  498    H    ALA  69           HN       ALA  69  -4.073   7.794   0.707
  499    HA   ALA  69           HA       ALA  69  -4.244   6.860   3.493
  500    HB1  ALA  69           HB1      ALA  69  -4.026   9.424   3.983
  501    HB2  ALA  69           HB2      ALA  69  -2.588   8.437   3.719
  502    HB3  ALA  69           HB3      ALA  69  -3.220   9.444   2.415
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  -0.772  -3.273   0.024
    2    H2   MET   1           H2       MET   1   0.213  -4.629  -0.237
    3    H3   MET   1           H3       MET   1  -1.046  -4.271  -1.322
    4    HA   MET   1           HA       MET   1   1.598  -3.082  -1.054
    5    HB2  MET   1           HB2      MET   1   0.982  -4.598  -2.918
    6    HB3  MET   1           HB3      MET   1  -0.270  -3.465  -3.404
    7    HG2  MET   1           HG2      MET   1   1.174  -2.287  -4.589
    8    HG3  MET   1           HG3      MET   1   2.243  -2.104  -3.199
    9    HE1  MET   1           HE1      MET   1   4.798  -2.485  -4.700
   10    HE2  MET   1           HE2      MET   1   4.406  -3.171  -6.277
   11    HE3  MET   1           HE3      MET   1   3.441  -1.846  -5.627
   12    H    THR   2           HN       THR   2  -1.585  -2.105  -2.331
   13    HA   THR   2           HA       THR   2  -1.178   0.569  -1.251
   14    HB   THR   2           HB       THR   2  -2.139   0.425  -4.073
   15    HG1  THR   2           HG1      THR   2   0.360   0.911  -4.397
   16   HG21  THR   2          HG21      THR   2  -0.401   2.565  -3.718
   17   HG22  THR   2          HG22      THR   2  -1.249   2.428  -2.177
   18   HG23  THR   2          HG23      THR   2  -2.164   2.620  -3.672
   19    H    HIS   3           HN       HIS   3  -3.148   1.722  -0.972
   20    HA   HIS   3           HA       HIS   3  -5.530   0.048  -1.120
   21    HB2  HIS   3           HB2      HIS   3  -5.326   2.875  -0.107
   22    HB3  HIS   3           HB3      HIS   3  -6.679   1.787   0.102
   23    HD1  HIS   3           HD1      HIS   3  -5.757   2.911   2.622
   24    HD2  HIS   3           HD2      HIS   3  -3.913  -0.442   0.993
   25    HE1  HIS   3           HE1      HIS   3  -4.641   1.748   4.550
   26    HE2  HIS   3           HE2      HIS   3  -3.473  -0.243   3.540
   27    H    LEU   4           HN       LEU   4  -6.867   0.127  -2.709
   28    HA   LEU   4           HA       LEU   4  -6.723   2.285  -4.680
   29    HB2  LEU   4           HB2      LEU   4  -6.740  -0.383  -5.080
   30    HB3  LEU   4           HB3      LEU   4  -8.463  -0.080  -5.119
   31    HG   LEU   4           HG       LEU   4  -7.640   1.831  -6.827
   32   HD11  LEU   4          HD11      LEU   4  -5.962  -0.064  -8.091
   33   HD12  LEU   4          HD12      LEU   4  -5.562   1.565  -7.546
   34   HD13  LEU   4          HD13      LEU   4  -5.349   0.192  -6.457
   35   HD21  LEU   4          HD21      LEU   4  -8.004  -1.030  -7.691
   36   HD22  LEU   4          HD22      LEU   4  -9.331  -0.015  -7.127
   37   HD23  LEU   4          HD23      LEU   4  -8.429   0.437  -8.574
   38    H    LYS   5           HN       LYS   5  -8.703   3.309  -5.357
   39    HA   LYS   5           HA       LYS   5 -10.643   3.314  -3.143
   40    HB2  LYS   5           HB2      LYS   5  -9.254   5.414  -3.785
   41    HB3  LYS   5           HB3      LYS   5 -10.393   5.556  -5.117
   42    HG2  LYS   5           HG2      LYS   5 -12.039   5.181  -2.954
   43    HG3  LYS   5           HG3      LYS   5 -10.730   6.159  -2.288
   44    HD2  LYS   5           HD2      LYS   5 -11.249   7.967  -3.561
   45    HD3  LYS   5           HD3      LYS   5 -11.808   6.984  -4.917
   46    HE2  LYS   5           HE2      LYS   5 -13.894   7.406  -4.287
   47    HE3  LYS   5           HE3      LYS   5 -13.596   6.472  -2.823
   48    HZ1  LYS   5           HZ1      LYS   5 -12.546   9.109  -2.598
   49    HZ2  LYS   5           HZ2      LYS   5 -13.663   8.306  -1.604
   50    HZ3  LYS   5           HZ3      LYS   5 -14.199   9.144  -2.975
   51    H    ILE   6           HN       ILE   6 -12.652   2.716  -3.511
   52    HA   ILE   6           HA       ILE   6 -13.492   2.254  -6.268
   53    HB   ILE   6           HB       ILE   6 -15.062   1.606  -3.786
   54   HG12  ILE   6          HG12      ILE   6 -12.836   0.583  -3.567
   55   HG13  ILE   6          HG13      ILE   6 -14.083  -0.636  -3.806
   56   HG21  ILE   6          HG21      ILE   6 -15.256  -0.234  -6.010
   57   HG22  ILE   6          HG22      ILE   6 -16.527   0.655  -5.171
   58   HG23  ILE   6          HG23      ILE   6 -15.648   1.416  -6.498
   59   HD11  ILE   6          HD11      ILE   6 -12.183   0.393  -5.902
   60   HD12  ILE   6          HD12      ILE   6 -12.088  -1.164  -5.079
   61   HD13  ILE   6          HD13      ILE   6 -13.440  -0.817  -6.157
   62    H    THR   7           HN       THR   7 -14.889   3.583  -7.275
   63    HA   THR   7           HA       THR   7 -15.945   5.814  -5.673
   64    HB   THR   7           HB       THR   7 -15.726   6.346  -8.528
   65    HG1  THR   7           HG1      THR   7 -13.681   5.042  -7.317
   66   HG21  THR   7          HG21      THR   7 -15.892   7.839  -6.309
   67   HG22  THR   7          HG22      THR   7 -15.162   8.430  -7.803
   68   HG23  THR   7          HG23      THR   7 -14.139   7.815  -6.502
   69    H    GLY   8           HN       GLY   8 -17.979   6.559  -6.030
   70    HA2  GLY   8           HA1      GLY   8 -20.189   6.462  -6.720
   71    HA3  GLY   8           HA2      GLY   8 -19.741   5.221  -7.892
   72    H    MET   9           HN       MET   9 -18.863   3.171  -6.725
   73    HA   MET   9           HA       MET   9 -21.009   2.307  -4.959
   74    HB2  MET   9           HB2      MET   9 -18.835   0.480  -5.921
   75    HB3  MET   9           HB3      MET   9 -20.516   0.127  -5.550
   76    HG2  MET   9           HG2      MET   9 -20.394   2.035  -7.640
   77    HG3  MET   9           HG3      MET   9 -19.387   0.650  -8.056
   78    HE1  MET   9           HE1      MET   9 -22.557   1.962  -6.748
   79    HE2  MET   9           HE2      MET   9 -23.409   1.679  -8.267
   80    HE3  MET   9           HE3      MET   9 -23.748   0.667  -6.863
   81    H    THR  10           HN       THR  10 -20.728   2.607  -2.845
   82    HA   THR  10           HA       THR  10 -17.967   2.489  -1.805
   83    HB   THR  10           HB       THR  10 -19.878   4.121  -0.302
   84    HG1  THR  10           HG1      THR  10 -19.761   4.421  -2.951
   85   HG21  THR  10          HG21      THR  10 -17.789   5.708  -0.665
   86   HG22  THR  10          HG22      THR  10 -17.016   4.189  -1.122
   87   HG23  THR  10          HG23      THR  10 -17.733   4.364   0.479
   88    H    CYS  11           HN       CYS  11 -19.696   0.242  -1.840
   89    HA   CYS  11           HA       CYS  11 -19.917  -0.252   1.015
   90    HB2  CYS  11           HB2      CYS  11 -22.239  -1.058   0.830
   91    HB3  CYS  11           HB3      CYS  11 -22.093   0.665   0.510
   92    HG   CYS  11           HG       CYS  11 -23.947  -0.060  -1.312
   93    H    ASP  12           HN       ASP  12 -20.241  -2.437   1.569
   94    HA   ASP  12           HA       ASP  12 -18.552  -4.233   0.369
   95    HB2  ASP  12           HB2      ASP  12 -19.132  -4.637   2.604
   96    HB3  ASP  12           HB3      ASP  12 -20.856  -4.547   2.275
   97    H    SER  13           HN       SER  13 -22.074  -4.016  -0.040
   98    HA   SER  13           HA       SER  13 -22.485  -6.339  -1.499
   99    HB2  SER  13           HB2      SER  13 -24.003  -3.811  -2.090
  100    HB3  SER  13           HB3      SER  13 -24.599  -5.471  -2.015
  101    HG   SER  13           HG       SER  13 -24.103  -5.406   0.268
  102    H    CYS  14           HN       CYS  14 -21.270  -3.239  -2.559
  103    HA   CYS  14           HA       CYS  14 -21.280  -4.071  -5.351
  104    HB2  CYS  14           HB2      CYS  14 -20.459  -1.502  -3.986
  105    HB3  CYS  14           HB3      CYS  14 -20.362  -1.755  -5.726
  106    HG   CYS  14           HG       CYS  14 -23.385  -2.565  -4.914
  107    H    ALA  15           HN       ALA  15 -19.086  -3.442  -2.705
  108    HA   ALA  15           HA       ALA  15 -16.661  -3.527  -4.131
  109    HB1  ALA  15           HB1      ALA  15 -17.064  -4.276  -1.242
  110    HB2  ALA  15           HB2      ALA  15 -15.594  -3.674  -2.005
  111    HB3  ALA  15           HB3      ALA  15 -16.992  -2.615  -1.830
  112    H    ALA  16           HN       ALA  16 -18.740  -6.038  -2.920
  113    HA   ALA  16           HA       ALA  16 -16.925  -8.165  -2.778
  114    HB1  ALA  16           HB1      ALA  16 -19.871  -8.119  -3.400
  115    HB2  ALA  16           HB2      ALA  16 -18.951  -9.605  -3.169
  116    HB3  ALA  16           HB3      ALA  16 -19.096  -8.443  -1.850
  117    H    HIS  17           HN       HIS  17 -18.879  -6.999  -5.497
  118    HA   HIS  17           HA       HIS  17 -18.038  -8.992  -7.325
  119    HB2  HIS  17           HB2      HIS  17 -20.021  -7.221  -7.399
  120    HB3  HIS  17           HB3      HIS  17 -18.832  -6.296  -8.311
  121    HD1  HIS  17           HD1      HIS  17 -19.510  -6.512 -10.671
  122    HD2  HIS  17           HD2      HIS  17 -19.686 -10.151  -8.661
  123    HE1  HIS  17           HE1      HIS  17 -20.058  -8.235 -12.424
  124    HE2  HIS  17           HE2      HIS  17 -19.959 -10.448 -11.217
  125    H    VAL  18           HN       VAL  18 -16.862  -5.771  -6.534
  126    HA   VAL  18           HA       VAL  18 -14.914  -5.562  -8.557
  127    HB   VAL  18           HB       VAL  18 -14.845  -4.371  -5.775
  128   HG11  VAL  18          HG11      VAL  18 -13.403  -2.651  -6.812
  129   HG12  VAL  18          HG12      VAL  18 -12.673  -4.256  -6.821
  130   HG13  VAL  18          HG13      VAL  18 -13.381  -3.600  -8.298
  131   HG21  VAL  18          HG21      VAL  18 -15.668  -2.316  -7.124
  132   HG22  VAL  18          HG22      VAL  18 -16.192  -3.515  -8.307
  133   HG23  VAL  18          HG23      VAL  18 -16.827  -3.563  -6.663
  134    H    LYS  19           HN       LYS  19 -14.780  -6.800  -5.242
  135    HA   LYS  19           HA       LYS  19 -12.066  -7.507  -5.210
  136    HB2  LYS  19           HB2      LYS  19 -13.475  -7.383  -3.190
  137    HB3  LYS  19           HB3      LYS  19 -14.381  -8.785  -3.739
  138    HG2  LYS  19           HG2      LYS  19 -11.860  -9.767  -3.783
  139    HG3  LYS  19           HG3      LYS  19 -11.753  -8.622  -2.443
  140    HD2  LYS  19           HD2      LYS  19 -14.013  -9.745  -1.724
  141    HD3  LYS  19           HD3      LYS  19 -13.430 -11.072  -2.729
  142    HE2  LYS  19           HE2      LYS  19 -11.339 -10.086  -1.009
  143    HE3  LYS  19           HE3      LYS  19 -12.763 -10.533  -0.071
  144    HZ1  LYS  19           HZ1      LYS  19 -12.029 -12.437  -2.120
  145    HZ2  LYS  19           HZ2      LYS  19 -12.468 -12.692  -0.503
  146    HZ3  LYS  19           HZ3      LYS  19 -10.876 -12.255  -0.891
  147    H    GLU  20           HN       GLU  20 -14.949  -9.336  -6.129
  148    HA   GLU  20           HA       GLU  20 -13.657 -11.768  -6.662
  149    HB2  GLU  20           HB2      GLU  20 -15.954 -11.979  -6.501
  150    HB3  GLU  20           HB3      GLU  20 -16.255 -10.526  -7.441
  151    HG2  GLU  20           HG2      GLU  20 -15.240 -11.972  -9.386
  152    HG3  GLU  20           HG3      GLU  20 -15.745 -13.308  -8.351
  153    H    ALA  21           HN       ALA  21 -14.362  -8.999  -8.733
  154    HA   ALA  21           HA       ALA  21 -13.360 -10.105 -11.127
  155    HB1  ALA  21           HB1      ALA  21 -14.489  -7.661 -10.316
  156    HB2  ALA  21           HB2      ALA  21 -12.927  -7.271 -11.037
  157    HB3  ALA  21           HB3      ALA  21 -14.120  -8.190 -11.957
  158    H    LEU  22           HN       LEU  22 -11.870  -8.365  -8.471
  159    HA   LEU  22           HA       LEU  22  -9.311  -8.070  -9.666
  160    HB2  LEU  22           HB2      LEU  22 -10.390  -7.879  -6.890
  161    HB3  LEU  22           HB3      LEU  22  -8.653  -7.966  -7.114
  162    HG   LEU  22           HG       LEU  22 -10.234  -5.928  -8.633
  163   HD11  LEU  22          HD11      LEU  22  -9.409  -4.470  -6.548
  164   HD12  LEU  22          HD12      LEU  22 -11.017  -5.189  -6.646
  165   HD13  LEU  22          HD13      LEU  22  -9.748  -5.991  -5.719
  166   HD21  LEU  22          HD21      LEU  22  -7.434  -6.510  -8.019
  167   HD22  LEU  22          HD22      LEU  22  -8.142  -5.605  -9.357
  168   HD23  LEU  22          HD23      LEU  22  -7.884  -4.818  -7.800
  169    H    GLU  23           HN       GLU  23 -10.746 -10.484  -7.528
  170    HA   GLU  23           HA       GLU  23  -8.380 -12.014  -7.209
  171    HB2  GLU  23           HB2      GLU  23 -11.286 -12.502  -6.706
  172    HB3  GLU  23           HB3      GLU  23 -10.136 -13.827  -6.575
  173    HG2  GLU  23           HG2      GLU  23  -8.829 -12.307  -5.004
  174    HG3  GLU  23           HG3      GLU  23 -10.279 -11.311  -4.962
  175    H    LYS  24           HN       LYS  24 -10.789 -11.841  -9.688
  176    HA   LYS  24           HA       LYS  24 -10.186 -14.380 -10.872
  177    HB2  LYS  24           HB2      LYS  24 -11.954 -13.923 -12.181
  178    HB3  LYS  24           HB3      LYS  24 -12.183 -12.495 -11.190
  179    HG2  LYS  24           HG2      LYS  24 -10.723 -11.254 -12.803
  180    HG3  LYS  24           HG3      LYS  24 -10.787 -12.676 -13.846
  181    HD2  LYS  24           HD2      LYS  24 -13.161 -12.480 -14.083
  182    HD3  LYS  24           HD3      LYS  24 -13.236 -11.236 -12.833
  183    HE2  LYS  24           HE2      LYS  24 -13.345  -9.953 -14.734
  184    HE3  LYS  24           HE3      LYS  24 -11.609  -9.953 -14.426
  185    HZ1  LYS  24           HZ1      LYS  24 -12.189 -10.384 -16.765
  186    HZ2  LYS  24           HZ2      LYS  24 -12.979 -11.809 -16.296
  187    HZ3  LYS  24           HZ3      LYS  24 -11.307 -11.654 -16.064
  188    H    VAL  25           HN       VAL  25  -8.754 -11.296 -10.840
  189    HA   VAL  25           HA       VAL  25  -7.146 -11.710 -13.212
  190    HB   VAL  25           HB       VAL  25  -7.154  -9.551 -11.097
  191   HG11  VAL  25          HG11      VAL  25  -5.255  -8.637 -11.878
  192   HG12  VAL  25          HG12      VAL  25  -4.922 -10.252 -12.504
  193   HG13  VAL  25          HG13      VAL  25  -5.641  -9.030 -13.553
  194   HG21  VAL  25          HG21      VAL  25  -8.107  -8.156 -12.755
  195   HG22  VAL  25          HG22      VAL  25  -7.797  -9.336 -14.028
  196   HG23  VAL  25          HG23      VAL  25  -9.012  -9.669 -12.792
  197    HA   PRO  26           HA       PRO  26  -4.400 -14.350 -10.905
  198    HB2  PRO  26           HB2      PRO  26  -2.639 -13.946 -13.249
  199    HB3  PRO  26           HB3      PRO  26  -3.267 -15.443 -12.555
  200    HG2  PRO  26           HG2      PRO  26  -4.227 -14.499 -14.852
  201    HG3  PRO  26           HG3      PRO  26  -5.297 -15.260 -13.658
  202    HD2  PRO  26           HD2      PRO  26  -4.869 -12.350 -14.242
  203    HD3  PRO  26           HD3      PRO  26  -6.383 -13.223 -13.914
  204    H    GLY  27           HN       GLY  27  -3.554 -11.218 -12.142
  205    HA2  GLY  27           HA1      GLY  27  -0.925 -11.094 -11.033
  206    HA3  GLY  27           HA2      GLY  27  -1.879  -9.728 -11.595
  207    H    VAL  28           HN       VAL  28  -3.995 -10.983  -9.614
  208    HA   VAL  28           HA       VAL  28  -3.100  -9.354  -7.359
  209    HB   VAL  28           HB       VAL  28  -5.791 -10.578  -7.984
  210   HG11  VAL  28          HG11      VAL  28  -4.861  -8.933  -5.649
  211   HG12  VAL  28          HG12      VAL  28  -6.557  -9.024  -6.121
  212   HG13  VAL  28          HG13      VAL  28  -5.698 -10.485  -5.634
  213   HG21  VAL  28          HG21      VAL  28  -6.255  -7.965  -7.992
  214   HG22  VAL  28          HG22      VAL  28  -4.554  -7.929  -8.458
  215   HG23  VAL  28          HG23      VAL  28  -5.717  -8.830  -9.432
  216    H    GLN  29           HN       GLN  29  -2.067 -10.332  -5.764
  217    HA   GLN  29           HA       GLN  29  -2.215 -13.183  -5.373
  218    HB2  GLN  29           HB2      GLN  29  -0.310 -11.246  -4.846
  219    HB3  GLN  29           HB3      GLN  29  -0.926 -11.635  -3.248
  220    HG2  GLN  29           HG2      GLN  29  -0.492 -14.064  -4.653
  221    HG3  GLN  29           HG3      GLN  29   0.948 -13.056  -4.805
  222   HE21  GLN  29          HE21      GLN  29  -0.654 -15.249  -2.909
  223   HE22  GLN  29          HE22      GLN  29   0.201 -15.004  -1.424
  224    H    SER  30           HN       SER  30  -3.301 -10.277  -3.699
  225    HA   SER  30           HA       SER  30  -5.408 -11.787  -2.412
  226    HB2  SER  30           HB2      SER  30  -4.346 -10.159  -0.332
  227    HB3  SER  30           HB3      SER  30  -4.477 -11.916  -0.373
  228    HG   SER  30           HG       SER  30  -2.416 -12.087  -0.915
  229    H    ALA  31           HN       ALA  31  -7.216 -10.571  -2.140
  230    HA   ALA  31           HA       ALA  31  -6.963  -7.658  -2.512
  231    HB1  ALA  31           HB1      ALA  31  -8.278  -7.681  -4.305
  232    HB2  ALA  31           HB2      ALA  31  -8.149  -9.441  -4.301
  233    HB3  ALA  31           HB3      ALA  31  -9.491  -8.653  -3.471
  234    H    LEU  32           HN       LEU  32  -7.360  -6.896  -0.520
  235    HA   LEU  32           HA       LEU  32  -9.711  -7.937   0.921
  236    HB2  LEU  32           HB2      LEU  32  -7.335  -6.389   1.967
  237    HB3  LEU  32           HB3      LEU  32  -8.691  -6.933   2.936
  238    HG   LEU  32           HG       LEU  32  -7.805  -9.268   1.752
  239   HD11  LEU  32          HD11      LEU  32  -5.805  -8.123   0.924
  240   HD12  LEU  32          HD12      LEU  32  -5.410  -7.625   2.569
  241   HD13  LEU  32          HD13      LEU  32  -5.402  -9.336   2.138
  242   HD21  LEU  32          HD21      LEU  32  -7.059  -8.112   4.436
  243   HD22  LEU  32          HD22      LEU  32  -8.546  -8.982   4.058
  244   HD23  LEU  32          HD23      LEU  32  -6.992  -9.817   3.988
  245    H    VAL  33           HN       VAL  33 -11.377  -6.715   0.165
  246    HA   VAL  33           HA       VAL  33 -11.000  -3.829  -0.113
  247    HB   VAL  33           HB       VAL  33 -13.525  -5.345  -0.746
  248   HG11  VAL  33          HG11      VAL  33 -13.542  -2.844  -0.605
  249   HG12  VAL  33          HG12      VAL  33 -12.416  -2.823  -1.963
  250   HG13  VAL  33          HG13      VAL  33 -14.032  -3.501  -2.166
  251   HG21  VAL  33          HG21      VAL  33 -12.771  -6.001  -2.800
  252   HG22  VAL  33          HG22      VAL  33 -11.569  -4.715  -2.895
  253   HG23  VAL  33          HG23      VAL  33 -11.270  -6.130  -1.885
  254    H    SER  34           HN       SER  34 -11.759  -2.390   1.282
  255    HA   SER  34           HA       SER  34 -13.154  -3.381   3.652
  256    HB2  SER  34           HB2      SER  34 -12.426  -0.653   3.949
  257    HB3  SER  34           HB3      SER  34 -11.688  -2.059   4.718
  258    HG   SER  34           HG       SER  34 -10.854  -0.589   2.504
  259    H    TYR  35           HN       TYR  35 -15.294  -3.279   3.527
  260    HA   TYR  35           HA       TYR  35 -16.884  -1.614   1.969
  261    HB2  TYR  35           HB2      TYR  35 -18.095  -3.344   2.844
  262    HB3  TYR  35           HB3      TYR  35 -17.303  -3.261   4.410
  263    HD1  TYR  35           HD1      TYR  35 -19.574  -1.131   2.327
  264    HD2  TYR  35           HD2      TYR  35 -18.653  -2.651   6.193
  265    HE1  TYR  35           HE1      TYR  35 -21.547   0.014   3.243
  266    HE2  TYR  35           HE2      TYR  35 -20.626  -1.512   7.117
  267    HH   TYR  35           HH       TYR  35 -22.069   0.438   6.555
  268    HA   PRO  36           HA       PRO  36 -17.388   1.357   5.839
  269    HB2  PRO  36           HB2      PRO  36 -15.121   1.496   7.409
  270    HB3  PRO  36           HB3      PRO  36 -16.574   0.574   7.810
  271    HG2  PRO  36           HG2      PRO  36 -14.014  -0.356   6.580
  272    HG3  PRO  36           HG3      PRO  36 -15.013  -1.138   7.819
  273    HD2  PRO  36           HD2      PRO  36 -15.079  -1.950   5.277
  274    HD3  PRO  36           HD3      PRO  36 -16.555  -1.910   6.264
  275    H    LYS  37           HN       LYS  37 -14.242   0.844   4.327
  276    HA   LYS  37           HA       LYS  37 -13.730   3.716   4.364
  277    HB2  LYS  37           HB2      LYS  37 -12.090   1.286   4.168
  278    HB3  LYS  37           HB3      LYS  37 -11.578   2.592   3.107
  279    HG2  LYS  37           HG2      LYS  37 -12.032   2.922   6.061
  280    HG3  LYS  37           HG3      LYS  37 -10.467   2.550   5.338
  281    HD2  LYS  37           HD2      LYS  37 -10.145   4.729   5.032
  282    HD3  LYS  37           HD3      LYS  37 -11.498   4.729   3.897
  283    HE2  LYS  37           HE2      LYS  37 -12.724   5.932   5.300
  284    HE3  LYS  37           HE3      LYS  37 -12.504   4.736   6.575
  285    HZ1  LYS  37           HZ1      LYS  37 -10.437   5.802   7.190
  286    HZ2  LYS  37           HZ2      LYS  37 -11.707   6.929   7.232
  287    HZ3  LYS  37           HZ3      LYS  37 -10.611   6.932   5.938
  288    H    GLY  38           HN       GLY  38 -14.760   1.200   2.263
  289    HA2  GLY  38           HA1      GLY  38 -15.449   1.248   0.068
  290    HA3  GLY  38           HA2      GLY  38 -15.220   2.995   0.087
  291    H    THR  39           HN       THR  39 -12.663   0.828   1.002
  292    HA   THR  39           HA       THR  39 -11.279   1.492  -1.515
  293    HB   THR  39           HB       THR  39  -9.147   1.478  -0.078
  294    HG1  THR  39           HG1      THR  39  -9.578   2.154   2.122
  295   HG21  THR  39          HG21      THR  39 -11.093   3.740   0.377
  296   HG22  THR  39          HG22      THR  39 -10.192   3.494  -1.118
  297   HG23  THR  39          HG23      THR  39  -9.331   3.835   0.384
  298    H    ALA  40           HN       ALA  40  -9.722   0.004  -2.245
  299    HA   ALA  40           HA       ALA  40 -10.097  -2.707  -1.165
  300    HB1  ALA  40           HB1      ALA  40 -10.685  -3.144  -3.282
  301    HB2  ALA  40           HB2      ALA  40  -9.996  -1.636  -3.880
  302    HB3  ALA  40           HB3      ALA  40  -8.961  -3.045  -3.639
  303    H    GLN  41           HN       GLN  41  -8.446  -3.366   0.034
  304    HA   GLN  41           HA       GLN  41  -5.787  -2.259  -0.394
  305    HB2  GLN  41           HB2      GLN  41  -6.751  -4.257   1.666
  306    HB3  GLN  41           HB3      GLN  41  -5.176  -3.471   1.646
  307    HG2  GLN  41           HG2      GLN  41  -5.982  -1.525   2.457
  308    HG3  GLN  41           HG3      GLN  41  -7.533  -1.696   1.636
  309   HE21  GLN  41          HE21      GLN  41  -8.780  -3.711   2.515
  310   HE22  GLN  41          HE22      GLN  41  -8.913  -3.762   4.242
  311    H    LEU  42           HN       LEU  42  -5.048  -3.130  -2.267
  312    HA   LEU  42           HA       LEU  42  -5.284  -6.019  -2.643
  313    HB2  LEU  42           HB2      LEU  42  -4.098  -4.922  -4.915
  314    HB3  LEU  42           HB3      LEU  42  -5.760  -5.445  -4.732
  315    HG   LEU  42           HG       LEU  42  -5.767  -2.883  -3.670
  316   HD11  LEU  42          HD11      LEU  42  -3.437  -2.729  -4.719
  317   HD12  LEU  42          HD12      LEU  42  -4.278  -2.732  -6.270
  318   HD13  LEU  42          HD13      LEU  42  -4.595  -1.454  -5.097
  319   HD21  LEU  42          HD21      LEU  42  -7.395  -2.572  -5.198
  320   HD22  LEU  42          HD22      LEU  42  -6.398  -3.143  -6.536
  321   HD23  LEU  42          HD23      LEU  42  -7.189  -4.301  -5.469
  322    H    ALA  43           HN       ALA  43  -3.621  -7.356  -2.705
  323    HA   ALA  43           HA       ALA  43  -0.895  -6.230  -2.649
  324    HB1  ALA  43           HB1      ALA  43  -0.516  -7.576  -0.910
  325    HB2  ALA  43           HB2      ALA  43  -2.142  -8.249  -1.036
  326    HB3  ALA  43           HB3      ALA  43  -0.817  -8.966  -1.953
  327    H    ILE  44           HN       ILE  44  -0.749  -6.032  -4.880
  328    HA   ILE  44           HA       ILE  44  -1.316  -8.359  -6.541
  329    HB   ILE  44           HB       ILE  44  -0.785  -6.756  -8.431
  330   HG12  ILE  44          HG12      ILE  44  -1.161  -4.566  -6.410
  331   HG13  ILE  44          HG13      ILE  44   0.450  -5.199  -6.733
  332   HG21  ILE  44          HG21      ILE  44  -3.051  -6.189  -6.531
  333   HG22  ILE  44          HG22      ILE  44  -2.953  -5.532  -8.163
  334   HG23  ILE  44          HG23      ILE  44  -3.057  -7.277  -7.919
  335   HD11  ILE  44          HD11      ILE  44  -0.844  -3.187  -8.110
  336   HD12  ILE  44          HD12      ILE  44   0.614  -4.041  -8.616
  337   HD13  ILE  44          HD13      ILE  44  -0.967  -4.586  -9.177
  338    H    VAL  45           HN       VAL  45   0.226  -8.879  -8.290
  339    HA   VAL  45           HA       VAL  45   2.940  -9.035  -7.266
  340    HB   VAL  45           HB       VAL  45   1.788 -10.099  -9.858
  341   HG11  VAL  45          HG11      VAL  45   4.336 -10.909  -8.471
  342   HG12  VAL  45          HG12      VAL  45   3.763 -11.423 -10.057
  343   HG13  VAL  45          HG13      VAL  45   4.269  -9.752  -9.801
  344   HG21  VAL  45          HG21      VAL  45   0.888 -11.764  -8.701
  345   HG22  VAL  45          HG22      VAL  45   2.453 -12.136  -7.980
  346   HG23  VAL  45          HG23      VAL  45   1.380 -10.973  -7.202
  347    HA   PRO  46           HA       PRO  46   4.267  -5.240  -9.279
  348    HB2  PRO  46           HB2      PRO  46   6.825  -6.774  -9.108
  349    HB3  PRO  46           HB3      PRO  46   6.494  -5.090  -8.684
  350    HG2  PRO  46           HG2      PRO  46   6.724  -6.931  -6.786
  351    HG3  PRO  46           HG3      PRO  46   5.497  -5.655  -6.666
  352    HD2  PRO  46           HD2      PRO  46   5.178  -8.537  -7.347
  353    HD3  PRO  46           HD3      PRO  46   4.074  -7.450  -6.480
  354    H    GLY  47           HN       GLY  47   3.801  -5.042 -11.349
  355    HA2  GLY  47           HA1      GLY  47   4.933  -5.525 -13.622
  356    HA3  GLY  47           HA2      GLY  47   4.505  -7.190 -13.227
  357    H    THR  48           HN       THR  48   2.091  -6.794 -11.988
  358    HA   THR  48           HA       THR  48   0.271  -6.131 -14.096
  359    HB   THR  48           HB       THR  48  -0.821  -6.256 -11.365
  360    HG1  THR  48           HG1      THR  48   0.803  -7.721 -10.961
  361   HG21  THR  48          HG21      THR  48  -2.131  -6.440 -13.488
  362   HG22  THR  48          HG22      THR  48  -2.379  -7.786 -12.376
  363   HG23  THR  48          HG23      THR  48  -1.337  -7.985 -13.785
  364    H    SER  49           HN       SER  49  -0.260  -4.129 -14.628
  365    HA   SER  49           HA       SER  49   0.652  -1.955 -13.046
  366    HB2  SER  49           HB2      SER  49  -1.166  -1.246 -15.212
  367    HB3  SER  49           HB3      SER  49   0.537  -0.832 -14.993
  368    HG   SER  49           HG       SER  49   1.123  -2.746 -15.937
  369    HA   PRO  50           HA       PRO  50  -3.047  -1.557 -10.591
  370    HB2  PRO  50           HB2      PRO  50  -1.944   1.090  -9.899
  371    HB3  PRO  50           HB3      PRO  50  -2.340  -0.268  -8.843
  372    HG2  PRO  50           HG2      PRO  50   0.206   0.405  -9.370
  373    HG3  PRO  50           HG3      PRO  50  -0.288  -1.283  -9.150
  374    HD2  PRO  50           HD2      PRO  50   0.281   0.213 -11.683
  375    HD3  PRO  50           HD3      PRO  50   0.697  -1.458 -11.238
  376    H    ASP  51           HN       ASP  51  -1.918   0.654 -12.972
  377    HA   ASP  51           HA       ASP  51  -4.188   2.369 -13.040
  378    HB2  ASP  51           HB2      ASP  51  -1.814   2.708 -14.059
  379    HB3  ASP  51           HB3      ASP  51  -2.426   1.760 -15.409
  380    H    ALA  52           HN       ALA  52  -3.410  -0.774 -14.152
  381    HA   ALA  52           HA       ALA  52  -5.432  -0.877 -16.184
  382    HB1  ALA  52           HB1      ALA  52  -4.699  -3.008 -16.670
  383    HB2  ALA  52           HB2      ALA  52  -3.236  -2.274 -16.011
  384    HB3  ALA  52           HB3      ALA  52  -4.221  -3.335 -15.004
  385    H    LEU  53           HN       LEU  53  -5.080  -1.706 -12.837
  386    HA   LEU  53           HA       LEU  53  -7.506  -3.168 -12.570
  387    HB2  LEU  53           HB2      LEU  53  -6.086  -1.636 -10.393
  388    HB3  LEU  53           HB3      LEU  53  -7.152  -3.016 -10.208
  389    HG   LEU  53           HG       LEU  53  -4.474  -3.160 -11.591
  390   HD11  LEU  53          HD11      LEU  53  -4.517  -4.523  -9.089
  391   HD12  LEU  53          HD12      LEU  53  -3.460  -3.216  -9.620
  392   HD13  LEU  53          HD13      LEU  53  -4.993  -2.846  -8.832
  393   HD21  LEU  53          HD21      LEU  53  -6.193  -5.361 -10.458
  394   HD22  LEU  53          HD22      LEU  53  -6.196  -4.884 -12.156
  395   HD23  LEU  53          HD23      LEU  53  -4.727  -5.529 -11.423
  396    H    THR  54           HN       THR  54  -6.555   0.199 -12.020
  397    HA   THR  54           HA       THR  54  -9.014   1.196 -11.166
  398    HB   THR  54           HB       THR  54  -6.975   2.606 -12.904
  399    HG1  THR  54           HG1      THR  54  -7.030   1.926 -10.195
  400   HG21  THR  54          HG21      THR  54  -8.953   3.769 -10.940
  401   HG22  THR  54          HG22      THR  54  -9.180   3.746 -12.689
  402   HG23  THR  54          HG23      THR  54  -7.845   4.657 -11.988
  403    H    ALA  55           HN       ALA  55  -7.690   0.949 -14.457
  404    HA   ALA  55           HA       ALA  55 -10.015   1.953 -15.726
  405    HB1  ALA  55           HB1      ALA  55  -9.014   1.021 -17.800
  406    HB2  ALA  55           HB2      ALA  55  -7.902   2.027 -16.871
  407    HB3  ALA  55           HB3      ALA  55  -7.762   0.269 -16.812
  408    H    ALA  56           HN       ALA  56  -9.027  -1.262 -14.749
  409    HA   ALA  56           HA       ALA  56 -11.023  -2.689 -16.145
  410    HB1  ALA  56           HB1      ALA  56  -9.971  -3.561 -13.476
  411    HB2  ALA  56           HB2      ALA  56 -10.448  -4.547 -14.859
  412    HB3  ALA  56           HB3      ALA  56  -8.957  -3.606 -14.918
  413    H    VAL  57           HN       VAL  57 -10.951  -1.390 -12.821
  414    HA   VAL  57           HA       VAL  57 -13.582  -2.252 -12.210
  415    HB   VAL  57           HB       VAL  57 -11.993  -0.042 -10.926
  416   HG11  VAL  57          HG11      VAL  57 -14.644  -0.446 -10.605
  417   HG12  VAL  57          HG12      VAL  57 -14.001  -1.527  -9.368
  418   HG13  VAL  57          HG13      VAL  57 -13.587   0.188  -9.344
  419   HG21  VAL  57          HG21      VAL  57 -10.715  -1.640 -10.067
  420   HG22  VAL  57          HG22      VAL  57 -12.140  -2.325  -9.285
  421   HG23  VAL  57          HG23      VAL  57 -11.664  -2.876 -10.891
  422    H    ALA  58           HN       ALA  58 -12.271   0.860 -13.366
  423    HA   ALA  58           HA       ALA  58 -14.754   2.213 -13.354
  424    HB1  ALA  58           HB1      ALA  58 -12.444   2.784 -15.197
  425    HB2  ALA  58           HB2      ALA  58 -13.675   3.909 -14.624
  426    HB3  ALA  58           HB3      ALA  58 -12.478   3.267 -13.501
  427    H    GLY  59           HN       GLY  59 -13.279   0.000 -15.587
  428    HA2  GLY  59           HA1      GLY  59 -15.196   0.605 -17.690
  429    HA3  GLY  59           HA2      GLY  59 -13.901  -0.581 -17.767
  430    H    LEU  60           HN       LEU  60 -15.378  -1.083 -14.893
  431    HA   LEU  60           HA       LEU  60 -16.952  -3.272 -15.999
  432    HB2  LEU  60           HB2      LEU  60 -15.384  -2.873 -13.606
  433    HB3  LEU  60           HB3      LEU  60 -16.977  -3.497 -13.229
  434    HG   LEU  60           HG       LEU  60 -15.395  -4.833 -15.375
  435   HD11  LEU  60          HD11      LEU  60 -14.126  -6.123 -13.867
  436   HD12  LEU  60          HD12      LEU  60 -13.902  -4.445 -13.369
  437   HD13  LEU  60          HD13      LEU  60 -15.001  -5.494 -12.471
  438   HD21  LEU  60          HD21      LEU  60 -17.299  -5.826 -13.254
  439   HD22  LEU  60          HD22      LEU  60 -17.697  -5.521 -14.944
  440   HD23  LEU  60          HD23      LEU  60 -16.565  -6.806 -14.524
  441    H    GLY  61           HN       GLY  61 -17.624  -0.280 -15.584
  442    HA2  GLY  61           HA1      GLY  61 -19.866   0.523 -15.668
  443    HA3  GLY  61           HA2      GLY  61 -20.357  -0.830 -14.659
  444    H    TYR  62           HN       TYR  62 -17.764  -0.049 -13.089
  445    HA   TYR  62           HA       TYR  62 -19.145   1.884 -11.368
  446    HB2  TYR  62           HB2      TYR  62 -16.691   0.440 -10.468
  447    HB3  TYR  62           HB3      TYR  62 -18.103   0.927  -9.542
  448    HD1  TYR  62           HD2      TYR  62 -20.342  -0.352 -10.288
  449    HD2  TYR  62           HD1      TYR  62 -16.383  -1.819 -10.821
  450    HE1  TYR  62           HE2      TYR  62 -21.213  -2.645 -10.405
  451    HE2  TYR  62           HE1      TYR  62 -17.248  -4.119 -10.937
  452    HH   TYR  62           HH       TYR  62 -20.710  -4.770 -11.018
  453    H    LYS  63           HN       LYS  63 -16.887   2.789  -9.953
  454    HA   LYS  63           HA       LYS  63 -15.067   3.793 -12.024
  455    HB2  LYS  63           HB2      LYS  63 -16.872   5.353 -10.375
  456    HB3  LYS  63           HB3      LYS  63 -15.199   5.808 -10.083
  457    HG2  LYS  63           HG2      LYS  63 -16.567   5.744 -12.762
  458    HG3  LYS  63           HG3      LYS  63 -16.209   7.186 -11.812
  459    HD2  LYS  63           HD2      LYS  63 -13.774   5.870 -11.992
  460    HD3  LYS  63           HD3      LYS  63 -14.498   5.660 -13.588
  461    HE2  LYS  63           HE2      LYS  63 -14.049   8.264 -12.137
  462    HE3  LYS  63           HE3      LYS  63 -13.174   7.681 -13.551
  463    HZ1  LYS  63           HZ1      LYS  63 -16.028   8.484 -13.411
  464    HZ2  LYS  63           HZ2      LYS  63 -15.349   7.700 -14.746
  465    HZ3  LYS  63           HZ3      LYS  63 -14.789   9.238 -14.288
  466    H    ALA  64           HN       ALA  64 -12.932   3.862 -11.410
  467    HA   ALA  64           HA       ALA  64 -12.376   3.128  -8.613
  468    HB1  ALA  64           HB1      ALA  64 -10.590   2.343 -10.886
  469    HB2  ALA  64           HB2      ALA  64 -10.660   1.684  -9.251
  470    HB3  ALA  64           HB3      ALA  64 -11.959   1.346 -10.395
  471    H    THR  65           HN       THR  65 -10.643   4.040  -7.614
  472    HA   THR  65           HA       THR  65  -8.923   5.879  -9.116
  473    HB   THR  65           HB       THR  65  -9.398   6.783  -6.378
  474    HG1  THR  65           HG1      THR  65 -11.582   6.223  -7.960
  475   HG21  THR  65          HG21      THR  65  -8.980   8.806  -7.282
  476   HG22  THR  65          HG22      THR  65 -10.064   8.535  -8.648
  477   HG23  THR  65          HG23      THR  65  -8.430   7.870  -8.671
  478    H    LEU  66           HN       LEU  66  -7.460   6.637  -6.745
  479    HA   LEU  66           HA       LEU  66  -6.677   4.179  -5.429
  480    HB2  LEU  66           HB2      LEU  66  -4.189   4.997  -6.063
  481    HB3  LEU  66           HB3      LEU  66  -5.062   3.764  -6.951
  482    HG   LEU  66           HG       LEU  66  -5.824   6.168  -8.155
  483   HD11  LEU  66          HD11      LEU  66  -2.853   6.205  -8.144
  484   HD12  LEU  66          HD12      LEU  66  -4.001   7.509  -8.442
  485   HD13  LEU  66          HD13      LEU  66  -3.708   6.952  -6.795
  486   HD21  LEU  66          HD21      LEU  66  -4.526   3.702  -8.813
  487   HD22  LEU  66          HD22      LEU  66  -5.480   4.771  -9.842
  488   HD23  LEU  66          HD23      LEU  66  -3.744   5.035  -9.663
  489    H    ALA  67           HN       ALA  67  -6.231   4.617  -3.367
  490    HA   ALA  67           HA       ALA  67  -5.021   7.072  -2.521
  491    HB1  ALA  67           HB1      ALA  67  -6.800   8.361  -2.175
  492    HB2  ALA  67           HB2      ALA  67  -7.831   7.113  -2.877
  493    HB3  ALA  67           HB3      ALA  67  -7.514   7.121  -1.143
  494    H    ASP  68           HN       ASP  68  -3.677   6.067  -1.151
  495    HA   ASP  68           HA       ASP  68  -4.396   3.849   0.413
  496    HB2  ASP  68           HB2      ASP  68  -2.020   4.901  -0.289
  497    HB3  ASP  68           HB3      ASP  68  -2.148   5.512   1.360
  498    H    ALA  69           HN       ALA  69  -3.777   7.210   1.287
  499    HA   ALA  69           HA       ALA  69  -4.449   8.513   3.013
  500    HB1  ALA  69           HB1      ALA  69  -6.813   8.039   3.855
  501    HB2  ALA  69           HB2      ALA  69  -6.623   8.424   2.144
  502    HB3  ALA  69           HB3      ALA  69  -6.850   6.750   2.654
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1   1.010  -3.356  -0.923
    2    H2   MET   1           H2       MET   1  -0.295  -3.504   0.145
    3    H3   MET   1           H3       MET   1   1.260  -3.206   0.748
    4    HA   MET   1           HA       MET   1  -0.264  -1.251   0.704
    5    HB2  MET   1           HB2      MET   1   2.496  -1.476  -0.099
    6    HB3  MET   1           HB3      MET   1   1.739  -0.121  -0.929
    7    HG2  MET   1           HG2      MET   1   2.750  -0.182   1.676
    8    HG3  MET   1           HG3      MET   1   1.852   1.119   0.895
    9    HE1  MET   1           HE1      MET   1   1.731  -0.184   4.368
   10    HE2  MET   1           HE2      MET   1   1.820   1.381   3.558
   11    HE3  MET   1           HE3      MET   1   0.372   0.936   4.462
   12    H    THR   2           HN       THR   2  -0.020   0.739  -1.182
   13    HA   THR   2           HA       THR   2  -1.024   1.598  -3.019
   14    HB   THR   2           HB       THR   2  -1.137  -1.137  -4.283
   15    HG1  THR   2           HG1      THR   2   0.982  -1.105  -3.872
   16   HG21  THR   2          HG21      THR   2  -1.169  -0.008  -6.314
   17   HG22  THR   2          HG22      THR   2  -0.466   1.456  -5.627
   18   HG23  THR   2          HG23      THR   2  -2.147   1.045  -5.287
   19    H    HIS   3           HN       HIS   3  -2.856   2.004  -1.700
   20    HA   HIS   3           HA       HIS   3  -4.997   0.033  -1.757
   21    HB2  HIS   3           HB2      HIS   3  -5.749   2.600  -0.597
   22    HB3  HIS   3           HB3      HIS   3  -5.834   0.991   0.099
   23    HD1  HIS   3           HD1      HIS   3  -4.681   3.990   1.114
   24    HD2  HIS   3           HD2      HIS   3  -2.705   0.362   0.628
   25    HE1  HIS   3           HE1      HIS   3  -2.655   4.118   2.590
   26    HE2  HIS   3           HE2      HIS   3  -1.345   2.039   2.058
   27    H    LEU   4           HN       LEU   4  -6.726   0.136  -2.987
   28    HA   LEU   4           HA       LEU   4  -6.894   2.241  -4.995
   29    HB2  LEU   4           HB2      LEU   4  -7.148  -0.427  -5.231
   30    HB3  LEU   4           HB3      LEU   4  -8.824  -0.015  -4.932
   31    HG   LEU   4           HG       LEU   4  -8.272   1.759  -6.881
   32   HD11  LEU   4          HD11      LEU   4  -6.835   0.874  -8.529
   33   HD12  LEU   4          HD12      LEU   4  -5.939   0.792  -7.013
   34   HD13  LEU   4          HD13      LEU   4  -6.681  -0.663  -7.679
   35   HD21  LEU   4          HD21      LEU   4  -9.142  -1.112  -7.121
   36   HD22  LEU   4          HD22      LEU   4 -10.159   0.319  -6.967
   37   HD23  LEU   4          HD23      LEU   4  -9.239   0.047  -8.446
   38    H    LYS   5           HN       LYS   5  -8.946   3.282  -5.410
   39    HA   LYS   5           HA       LYS   5 -10.578   3.499  -2.968
   40    HB2  LYS   5           HB2      LYS   5  -9.286   5.485  -4.404
   41    HB3  LYS   5           HB3      LYS   5 -10.960   5.629  -4.909
   42    HG2  LYS   5           HG2      LYS   5 -10.073   5.583  -2.033
   43    HG3  LYS   5           HG3      LYS   5 -10.318   7.060  -2.967
   44    HD2  LYS   5           HD2      LYS   5 -12.490   5.008  -2.773
   45    HD3  LYS   5           HD3      LYS   5 -12.240   6.166  -1.466
   46    HE2  LYS   5           HE2      LYS   5 -12.184   7.663  -3.829
   47    HE3  LYS   5           HE3      LYS   5 -13.521   6.529  -4.016
   48    HZ1  LYS   5           HZ1      LYS   5 -13.168   8.193  -1.588
   49    HZ2  LYS   5           HZ2      LYS   5 -14.544   7.327  -2.069
   50    HZ3  LYS   5           HZ3      LYS   5 -14.070   8.712  -2.930
   51    H    ILE   6           HN       ILE   6 -12.659   3.038  -3.045
   52    HA   ILE   6           HA       ILE   6 -13.737   2.075  -5.594
   53    HB   ILE   6           HB       ILE   6 -14.836   1.690  -2.805
   54   HG12  ILE   6          HG12      ILE   6 -12.689   0.570  -2.996
   55   HG13  ILE   6          HG13      ILE   6 -13.976  -0.630  -3.013
   56   HG21  ILE   6          HG21      ILE   6 -15.920   1.176  -5.413
   57   HG22  ILE   6          HG22      ILE   6 -15.729  -0.333  -4.520
   58   HG23  ILE   6          HG23      ILE   6 -16.674   0.988  -3.830
   59   HD11  ILE   6          HD11      ILE   6 -12.841  -1.457  -4.755
   60   HD12  ILE   6          HD12      ILE   6 -13.657  -0.185  -5.664
   61   HD13  ILE   6          HD13      ILE   6 -12.015   0.068  -5.074
   62    H    THR   7           HN       THR   7 -15.114   3.283  -6.681
   63    HA   THR   7           HA       THR   7 -16.844   5.153  -5.226
   64    HB   THR   7           HB       THR   7 -16.325   6.325  -7.739
   65    HG1  THR   7           HG1      THR   7 -14.347   4.883  -7.485
   66   HG21  THR   7          HG21      THR   7 -16.851   7.600  -5.775
   67   HG22  THR   7          HG22      THR   7 -15.251   8.096  -6.327
   68   HG23  THR   7          HG23      THR   7 -15.412   7.013  -4.945
   69    H    GLY   8           HN       GLY   8 -18.738   5.837  -6.553
   70    HA2  GLY   8           HA1      GLY   8 -20.380   5.414  -8.168
   71    HA3  GLY   8           HA2      GLY   8 -19.440   4.041  -8.743
   72    H    MET   9           HN       MET   9 -19.172   2.333  -6.847
   73    HA   MET   9           HA       MET   9 -21.867   1.511  -6.198
   74    HB2  MET   9           HB2      MET   9 -19.291   0.132  -5.425
   75    HB3  MET   9           HB3      MET   9 -20.902  -0.558  -5.439
   76    HG2  MET   9           HG2      MET   9 -20.835   0.032  -7.974
   77    HG3  MET   9           HG3      MET   9 -19.092   0.047  -7.719
   78    HE1  MET   9           HE1      MET   9 -22.336  -1.901  -7.084
   79    HE2  MET   9           HE2      MET   9 -21.988  -2.249  -8.778
   80    HE3  MET   9           HE3      MET   9 -21.920  -3.542  -7.581
   81    H    THR  10           HN       THR  10 -22.750   1.337  -4.173
   82    HA   THR  10           HA       THR  10 -21.726   3.231  -2.258
   83    HB   THR  10           HB       THR  10 -24.054   1.655  -1.478
   84    HG1  THR  10           HG1      THR  10 -25.082   1.736  -3.328
   85   HG21  THR  10          HG21      THR  10 -23.102   4.056  -0.793
   86   HG22  THR  10          HG22      THR  10 -24.818   3.662  -0.702
   87   HG23  THR  10          HG23      THR  10 -24.191   4.556  -2.087
   88    H    CYS  11           HN       CYS  11 -20.139   0.904  -2.545
   89    HA   CYS  11           HA       CYS  11 -19.168  -0.873  -1.539
   90    HB2  CYS  11           HB2      CYS  11 -18.579  -0.501   0.846
   91    HB3  CYS  11           HB3      CYS  11 -18.176   0.820  -0.234
   92    HG   CYS  11           HG       CYS  11 -19.945   2.604   0.702
   93    H    ASP  12           HN       ASP  12 -19.204  -2.418   0.427
   94    HA   ASP  12           HA       ASP  12 -20.129  -4.309   1.229
   95    HB2  ASP  12           HB2      ASP  12 -21.394  -2.376   2.531
   96    HB3  ASP  12           HB3      ASP  12 -22.785  -3.044   1.680
   97    H    SER  13           HN       SER  13 -20.722  -6.064   0.218
   98    HA   SER  13           HA       SER  13 -21.620  -7.486  -1.311
   99    HB2  SER  13           HB2      SER  13 -23.782  -5.414  -1.795
  100    HB3  SER  13           HB3      SER  13 -23.834  -7.120  -2.236
  101    HG   SER  13           HG       SER  13 -23.309  -6.752   0.418
  102    H    CYS  14           HN       CYS  14 -21.851  -4.125  -2.411
  103    HA   CYS  14           HA       CYS  14 -21.166  -4.454  -5.087
  104    HB2  CYS  14           HB2      CYS  14 -20.216  -2.179  -3.341
  105    HB3  CYS  14           HB3      CYS  14 -20.602  -2.132  -5.053
  106    HG   CYS  14           HG       CYS  14 -22.665  -1.967  -2.379
  107    H    ALA  15           HN       ALA  15 -19.194  -4.168  -2.208
  108    HA   ALA  15           HA       ALA  15 -16.674  -3.983  -3.442
  109    HB1  ALA  15           HB1      ALA  15 -17.448  -4.979  -0.700
  110    HB2  ALA  15           HB2      ALA  15 -15.793  -4.664  -1.221
  111    HB3  ALA  15           HB3      ALA  15 -16.958  -3.343  -1.144
  112    H    ALA  16           HN       ALA  16 -18.753  -6.696  -2.844
  113    HA   ALA  16           HA       ALA  16 -16.770  -8.725  -2.890
  114    HB1  ALA  16           HB1      ALA  16 -19.359  -9.584  -3.868
  115    HB2  ALA  16           HB2      ALA  16 -18.476 -10.078  -2.424
  116    HB3  ALA  16           HB3      ALA  16 -19.484  -8.631  -2.389
  117    H    HIS  17           HN       HIS  17 -18.896  -7.365  -5.392
  118    HA   HIS  17           HA       HIS  17 -17.995  -9.067  -7.463
  119    HB2  HIS  17           HB2      HIS  17 -20.012  -7.257  -7.279
  120    HB3  HIS  17           HB3      HIS  17 -18.860  -6.358  -8.264
  121    HD1  HIS  17           HD1      HIS  17 -20.035  -6.528 -10.506
  122    HD2  HIS  17           HD2      HIS  17 -19.473 -10.221  -8.666
  123    HE1  HIS  17           HE1      HIS  17 -20.664  -8.255 -12.228
  124    HE2  HIS  17           HE2      HIS  17 -20.097 -10.471 -11.162
  125    H    VAL  18           HN       VAL  18 -16.978  -5.866  -6.369
  126    HA   VAL  18           HA       VAL  18 -15.043  -5.418  -8.371
  127    HB   VAL  18           HB       VAL  18 -15.052  -4.412  -5.516
  128   HG11  VAL  18          HG11      VAL  18 -13.140  -3.378  -5.962
  129   HG12  VAL  18          HG12      VAL  18 -13.086  -4.181  -7.530
  130   HG13  VAL  18          HG13      VAL  18 -13.862  -2.604  -7.373
  131   HG21  VAL  18          HG21      VAL  18 -16.988  -3.493  -6.283
  132   HG22  VAL  18          HG22      VAL  18 -15.854  -2.297  -6.912
  133   HG23  VAL  18          HG23      VAL  18 -16.481  -3.560  -7.972
  134    H    LYS  19           HN       LYS  19 -14.820  -6.855  -5.135
  135    HA   LYS  19           HA       LYS  19 -12.089  -7.405  -5.107
  136    HB2  LYS  19           HB2      LYS  19 -13.804  -7.651  -3.218
  137    HB3  LYS  19           HB3      LYS  19 -14.162  -9.231  -3.900
  138    HG2  LYS  19           HG2      LYS  19 -11.317  -8.779  -3.488
  139    HG3  LYS  19           HG3      LYS  19 -12.266  -8.686  -2.003
  140    HD2  LYS  19           HD2      LYS  19 -13.322 -10.893  -3.224
  141    HD3  LYS  19           HD3      LYS  19 -11.623 -10.997  -3.687
  142    HE2  LYS  19           HE2      LYS  19 -12.680 -10.714  -0.878
  143    HE3  LYS  19           HE3      LYS  19 -12.066 -12.197  -1.599
  144    HZ1  LYS  19           HZ1      LYS  19 -10.282 -11.377  -0.395
  145    HZ2  LYS  19           HZ2      LYS  19 -10.574  -9.767  -0.840
  146    HZ3  LYS  19           HZ3      LYS  19  -9.939 -10.857  -1.974
  147    H    GLU  20           HN       GLU  20 -14.783  -9.471  -6.168
  148    HA   GLU  20           HA       GLU  20 -13.118 -11.627  -6.890
  149    HB2  GLU  20           HB2      GLU  20 -15.027 -12.739  -7.383
  150    HB3  GLU  20           HB3      GLU  20 -15.759 -11.409  -6.503
  151    HG2  GLU  20           HG2      GLU  20 -16.516 -10.379  -8.452
  152    HG3  GLU  20           HG3      GLU  20 -15.407 -11.294  -9.474
  153    H    ALA  21           HN       ALA  21 -14.268  -8.835  -8.679
  154    HA   ALA  21           HA       ALA  21 -13.460  -9.758 -11.240
  155    HB1  ALA  21           HB1      ALA  21 -14.418  -7.250 -10.081
  156    HB2  ALA  21           HB2      ALA  21 -13.275  -7.031 -11.406
  157    HB3  ALA  21           HB3      ALA  21 -14.747  -7.970 -11.657
  158    H    LEU  22           HN       LEU  22 -11.897  -7.977  -8.654
  159    HA   LEU  22           HA       LEU  22  -9.486  -7.422 -10.040
  160    HB2  LEU  22           HB2      LEU  22 -10.239  -7.532  -7.133
  161    HB3  LEU  22           HB3      LEU  22  -8.584  -7.245  -7.630
  162    HG   LEU  22           HG       LEU  22 -10.862  -5.524  -8.576
  163   HD11  LEU  22          HD11      LEU  22 -11.070  -4.762  -6.498
  164   HD12  LEU  22          HD12      LEU  22  -9.655  -5.656  -5.942
  165   HD13  LEU  22          HD13      LEU  22  -9.459  -4.072  -6.691
  166   HD21  LEU  22          HD21      LEU  22  -9.262  -4.676  -9.854
  167   HD22  LEU  22          HD22      LEU  22  -8.486  -4.087  -8.384
  168   HD23  LEU  22          HD23      LEU  22  -8.026  -5.650  -9.061
  169    H    GLU  23           HN       GLU  23 -10.418  -9.946  -7.723
  170    HA   GLU  23           HA       GLU  23  -7.891 -11.279  -7.942
  171    HB2  GLU  23           HB2      GLU  23 -10.430 -11.744  -6.476
  172    HB3  GLU  23           HB3      GLU  23  -9.379 -13.132  -6.737
  173    HG2  GLU  23           HG2      GLU  23  -7.580 -12.093  -5.590
  174    HG3  GLU  23           HG3      GLU  23  -8.424 -10.547  -5.539
  175    H    LYS  24           HN       LYS  24 -10.587 -11.202  -9.945
  176    HA   LYS  24           HA       LYS  24 -10.290 -13.795 -11.113
  177    HB2  LYS  24           HB2      LYS  24 -12.042 -11.649 -11.430
  178    HB3  LYS  24           HB3      LYS  24 -11.172 -11.720 -12.956
  179    HG2  LYS  24           HG2      LYS  24 -12.101 -13.691 -13.554
  180    HG3  LYS  24           HG3      LYS  24 -12.195 -14.279 -11.894
  181    HD2  LYS  24           HD2      LYS  24 -13.905 -11.986 -12.294
  182    HD3  LYS  24           HD3      LYS  24 -14.282 -13.272 -13.442
  183    HE2  LYS  24           HE2      LYS  24 -13.906 -13.907 -10.544
  184    HE3  LYS  24           HE3      LYS  24 -15.440 -13.248 -11.109
  185    HZ1  LYS  24           HZ1      LYS  24 -15.167 -15.155 -12.875
  186    HZ2  LYS  24           HZ2      LYS  24 -15.846 -15.453 -11.352
  187    HZ3  LYS  24           HZ3      LYS  24 -14.222 -15.857 -11.648
  188    H    VAL  25           HN       VAL  25  -8.689 -10.757 -11.344
  189    HA   VAL  25           HA       VAL  25  -7.165 -11.395 -13.706
  190    HB   VAL  25           HB       VAL  25  -6.882  -9.217 -11.622
  191   HG11  VAL  25          HG11      VAL  25  -4.690  -9.695 -12.549
  192   HG12  VAL  25          HG12      VAL  25  -5.336  -9.590 -14.186
  193   HG13  VAL  25          HG13      VAL  25  -5.284  -8.153 -13.166
  194   HG21  VAL  25          HG21      VAL  25  -7.810  -7.751 -13.254
  195   HG22  VAL  25          HG22      VAL  25  -7.738  -8.997 -14.501
  196   HG23  VAL  25          HG23      VAL  25  -8.864  -9.163 -13.153
  197    HA   PRO  26           HA       PRO  26  -4.480 -14.166 -11.519
  198    HB2  PRO  26           HB2      PRO  26  -2.480 -14.239 -13.408
  199    HB3  PRO  26           HB3      PRO  26  -3.969 -15.185 -13.492
  200    HG2  PRO  26           HG2      PRO  26  -3.277 -12.609 -14.842
  201    HG3  PRO  26           HG3      PRO  26  -4.142 -14.015 -15.488
  202    HD2  PRO  26           HD2      PRO  26  -5.438 -11.796 -14.701
  203    HD3  PRO  26           HD3      PRO  26  -6.135 -13.413 -14.470
  204    H    GLY  27           HN       GLY  27  -3.652 -10.948 -12.391
  205    HA2  GLY  27           HA1      GLY  27  -1.012 -11.034 -11.193
  206    HA3  GLY  27           HA2      GLY  27  -1.804  -9.619 -11.867
  207    H    VAL  28           HN       VAL  28  -4.158 -10.732 -10.026
  208    HA   VAL  28           HA       VAL  28  -3.312  -9.124  -7.735
  209    HB   VAL  28           HB       VAL  28  -6.032 -10.144  -8.566
  210   HG11  VAL  28          HG11      VAL  28  -6.204  -8.199  -6.498
  211   HG12  VAL  28          HG12      VAL  28  -6.783  -9.865  -6.495
  212   HG13  VAL  28          HG13      VAL  28  -5.145  -9.498  -5.952
  213   HG21  VAL  28          HG21      VAL  28  -6.213  -7.446  -8.348
  214   HG22  VAL  28          HG22      VAL  28  -4.543  -7.632  -8.885
  215   HG23  VAL  28          HG23      VAL  28  -5.861  -8.304  -9.847
  216    H    GLN  29           HN       GLN  29  -2.489 -10.101  -6.029
  217    HA   GLN  29           HA       GLN  29  -2.827 -12.958  -5.689
  218    HB2  GLN  29           HB2      GLN  29  -0.699 -12.713  -5.042
  219    HB3  GLN  29           HB3      GLN  29  -0.862 -10.968  -4.972
  220    HG2  GLN  29           HG2      GLN  29  -1.986 -11.445  -2.670
  221    HG3  GLN  29           HG3      GLN  29  -1.146 -12.992  -2.798
  222   HE21  GLN  29          HE21      GLN  29   1.189 -12.227  -4.032
  223   HE22  GLN  29          HE22      GLN  29   2.085 -11.160  -2.998
  224    H    SER  30           HN       SER  30  -3.794  -9.961  -4.161
  225    HA   SER  30           HA       SER  30  -5.997 -11.296  -2.888
  226    HB2  SER  30           HB2      SER  30  -3.599 -10.595  -1.354
  227    HB3  SER  30           HB3      SER  30  -5.074  -9.897  -0.694
  228    HG   SER  30           HG       SER  30  -4.202 -12.462  -0.638
  229    H    ALA  31           HN       ALA  31  -7.643  -9.885  -2.341
  230    HA   ALA  31           HA       ALA  31  -7.131  -7.016  -2.705
  231    HB1  ALA  31           HB1      ALA  31  -8.192  -7.288  -4.697
  232    HB2  ALA  31           HB2      ALA  31  -9.038  -8.745  -4.172
  233    HB3  ALA  31           HB3      ALA  31  -9.622  -7.156  -3.674
  234    H    LEU  32           HN       LEU  32  -7.219  -6.594  -0.511
  235    HA   LEU  32           HA       LEU  32  -9.490  -7.574   1.029
  236    HB2  LEU  32           HB2      LEU  32  -7.614  -5.648   2.258
  237    HB3  LEU  32           HB3      LEU  32  -8.275  -7.141   2.898
  238    HG   LEU  32           HG       LEU  32  -6.216  -7.291   0.740
  239   HD11  LEU  32          HD11      LEU  32  -4.416  -6.938   2.136
  240   HD12  LEU  32          HD12      LEU  32  -5.538  -5.681   2.658
  241   HD13  LEU  32          HD13      LEU  32  -5.375  -7.163   3.600
  242   HD21  LEU  32          HD21      LEU  32  -7.531  -9.250   1.751
  243   HD22  LEU  32          HD22      LEU  32  -5.779  -9.406   1.617
  244   HD23  LEU  32          HD23      LEU  32  -6.513  -9.016   3.172
  245    H    VAL  33           HN       VAL  33 -11.055  -6.394  -0.212
  246    HA   VAL  33           HA       VAL  33 -10.958  -3.560  -0.438
  247    HB   VAL  33           HB       VAL  33 -13.469  -5.198  -0.607
  248   HG11  VAL  33          HG11      VAL  33 -13.624  -2.720  -0.694
  249   HG12  VAL  33          HG12      VAL  33 -12.606  -2.749  -2.135
  250   HG13  VAL  33          HG13      VAL  33 -14.192  -3.516  -2.163
  251   HG21  VAL  33          HG21      VAL  33 -12.321  -4.828  -3.178
  252   HG22  VAL  33          HG22      VAL  33 -11.117  -5.587  -2.136
  253   HG23  VAL  33          HG23      VAL  33 -12.698  -6.337  -2.347
  254    H    SER  34           HN       SER  34 -11.277  -2.154   1.091
  255    HA   SER  34           HA       SER  34 -12.571  -2.889   3.579
  256    HB2  SER  34           HB2      SER  34 -11.865  -0.150   3.583
  257    HB3  SER  34           HB3      SER  34 -11.014  -1.477   4.375
  258    HG   SER  34           HG       SER  34  -9.602  -1.583   2.756
  259    H    TYR  35           HN       TYR  35 -14.709  -3.121   2.746
  260    HA   TYR  35           HA       TYR  35 -16.098  -1.246   1.287
  261    HB2  TYR  35           HB2      TYR  35 -17.854  -2.620   1.496
  262    HB3  TYR  35           HB3      TYR  35 -16.675  -3.702   2.192
  263    HD1  TYR  35           HD1      TYR  35 -19.304  -1.226   3.082
  264    HD2  TYR  35           HD2      TYR  35 -16.974  -4.550   4.355
  265    HE1  TYR  35           HE1      TYR  35 -20.690  -1.420   5.102
  266    HE2  TYR  35           HE2      TYR  35 -18.354  -4.748   6.379
  267    HH   TYR  35           HH       TYR  35 -21.042  -3.894   6.867
  268    HA   PRO  36           HA       PRO  36 -17.645   0.872   5.341
  269    HB2  PRO  36           HB2      PRO  36 -15.457   0.556   7.259
  270    HB3  PRO  36           HB3      PRO  36 -17.183   0.260   7.475
  271    HG2  PRO  36           HG2      PRO  36 -15.388  -1.745   7.395
  272    HG3  PRO  36           HG3      PRO  36 -17.036  -1.924   6.761
  273    HD2  PRO  36           HD2      PRO  36 -14.480  -1.417   5.279
  274    HD3  PRO  36           HD3      PRO  36 -15.814  -2.522   4.882
  275    H    LYS  37           HN       LYS  37 -14.477   0.861   4.059
  276    HA   LYS  37           HA       LYS  37 -14.047   3.670   4.813
  277    HB2  LYS  37           HB2      LYS  37 -12.322   1.467   4.791
  278    HB3  LYS  37           HB3      LYS  37 -11.842   2.433   3.403
  279    HG2  LYS  37           HG2      LYS  37 -10.616   3.600   4.834
  280    HG3  LYS  37           HG3      LYS  37 -12.136   4.313   5.378
  281    HD2  LYS  37           HD2      LYS  37 -12.125   2.026   6.814
  282    HD3  LYS  37           HD3      LYS  37 -10.392   2.328   6.683
  283    HE2  LYS  37           HE2      LYS  37 -10.528   3.868   8.266
  284    HE3  LYS  37           HE3      LYS  37 -11.667   4.787   7.286
  285    HZ1  LYS  37           HZ1      LYS  37 -13.393   4.113   8.516
  286    HZ2  LYS  37           HZ2      LYS  37 -12.231   3.703   9.684
  287    HZ3  LYS  37           HZ3      LYS  37 -12.836   2.518   8.634
  288    H    GLY  38           HN       GLY  38 -14.863   1.611   2.220
  289    HA2  GLY  38           HA1      GLY  38 -15.455   2.124   0.047
  290    HA3  GLY  38           HA2      GLY  38 -15.058   3.805   0.375
  291    H    THR  39           HN       THR  39 -12.768   1.274   1.028
  292    HA   THR  39           HA       THR  39 -11.234   2.059  -1.359
  293    HB   THR  39           HB       THR  39  -9.185   1.620   0.181
  294    HG1  THR  39           HG1      THR  39 -10.423   0.893   1.992
  295   HG21  THR  39          HG21      THR  39 -10.513   3.917  -0.610
  296   HG22  THR  39          HG22      THR  39  -8.895   3.836   0.087
  297   HG23  THR  39          HG23      THR  39 -10.289   4.137   1.126
  298    H    ALA  40           HN       ALA  40  -9.328   0.458  -1.622
  299    HA   ALA  40           HA       ALA  40 -10.072  -2.251  -0.772
  300    HB1  ALA  40           HB1      ALA  40  -9.224  -1.568  -3.582
  301    HB2  ALA  40           HB2      ALA  40  -9.697  -3.152  -2.965
  302    HB3  ALA  40           HB3      ALA  40 -10.891  -1.859  -3.086
  303    H    GLN  41           HN       GLN  41  -8.409  -3.075   0.308
  304    HA   GLN  41           HA       GLN  41  -5.739  -1.990  -0.109
  305    HB2  GLN  41           HB2      GLN  41  -7.048  -3.675   1.970
  306    HB3  GLN  41           HB3      GLN  41  -5.315  -3.865   1.745
  307    HG2  GLN  41           HG2      GLN  41  -5.078  -2.164   3.146
  308    HG3  GLN  41           HG3      GLN  41  -5.644  -1.134   1.832
  309   HE21  GLN  41          HE21      GLN  41  -6.280   0.180   3.750
  310   HE22  GLN  41          HE22      GLN  41  -7.846  -0.105   4.421
  311    H    LEU  42           HN       LEU  42  -4.974  -2.763  -2.010
  312    HA   LEU  42           HA       LEU  42  -5.519  -5.503  -2.763
  313    HB2  LEU  42           HB2      LEU  42  -4.581  -3.059  -4.127
  314    HB3  LEU  42           HB3      LEU  42  -3.956  -4.569  -4.751
  315    HG   LEU  42           HG       LEU  42  -5.986  -5.244  -5.576
  316   HD11  LEU  42          HD11      LEU  42  -7.822  -5.290  -4.343
  317   HD12  LEU  42          HD12      LEU  42  -6.974  -4.363  -3.105
  318   HD13  LEU  42          HD13      LEU  42  -7.918  -3.529  -4.339
  319   HD21  LEU  42          HD21      LEU  42  -5.330  -2.547  -6.001
  320   HD22  LEU  42          HD22      LEU  42  -6.282  -3.608  -7.039
  321   HD23  LEU  42          HD23      LEU  42  -7.083  -2.613  -5.823
  322    H    ALA  43           HN       ALA  43  -3.902  -6.937  -3.482
  323    HA   ALA  43           HA       ALA  43  -1.141  -6.352  -2.681
  324    HB1  ALA  43           HB1      ALA  43  -1.433  -7.839  -1.011
  325    HB2  ALA  43           HB2      ALA  43  -2.873  -8.539  -1.749
  326    HB3  ALA  43           HB3      ALA  43  -1.273  -9.038  -2.296
  327    H    ILE  44           HN       ILE  44  -0.203  -6.176  -4.619
  328    HA   ILE  44           HA       ILE  44  -1.308  -7.668  -6.863
  329    HB   ILE  44           HB       ILE  44   0.332  -6.165  -8.171
  330   HG12  ILE  44          HG12      ILE  44   0.180  -4.004  -6.312
  331   HG13  ILE  44          HG13      ILE  44   0.938  -5.370  -5.499
  332   HG21  ILE  44          HG21      ILE  44  -1.351  -4.165  -7.674
  333   HG22  ILE  44          HG22      ILE  44  -1.823  -5.603  -8.579
  334   HG23  ILE  44          HG23      ILE  44  -2.229  -5.465  -6.868
  335   HD11  ILE  44          HD11      ILE  44   1.884  -3.765  -7.805
  336   HD12  ILE  44          HD12      ILE  44   2.767  -4.367  -6.402
  337   HD13  ILE  44          HD13      ILE  44   2.349  -5.464  -7.718
  338    H    VAL  45           HN       VAL  45  -0.121  -8.920  -8.257
  339    HA   VAL  45           HA       VAL  45   2.340 -10.072  -7.243
  340    HB   VAL  45           HB       VAL  45   0.479 -10.671  -9.519
  341   HG11  VAL  45          HG11      VAL  45   1.983 -11.629 -10.841
  342   HG12  VAL  45          HG12      VAL  45   3.230 -10.847  -9.870
  343   HG13  VAL  45          HG13      VAL  45   2.718 -12.491  -9.490
  344   HG21  VAL  45          HG21      VAL  45  -0.023 -12.550  -8.371
  345   HG22  VAL  45          HG22      VAL  45   1.629 -12.772  -7.794
  346   HG23  VAL  45          HG23      VAL  45   0.570 -11.599  -7.009
  347    HA   PRO  46           HA       PRO  46   4.979  -7.042  -9.160
  348    HB2  PRO  46           HB2      PRO  46   6.758  -9.432  -9.378
  349    HB3  PRO  46           HB3      PRO  46   7.118  -7.814  -8.761
  350    HG2  PRO  46           HG2      PRO  46   6.724  -9.840  -7.085
  351    HG3  PRO  46           HG3      PRO  46   6.099  -8.221  -6.718
  352    HD2  PRO  46           HD2      PRO  46   4.643 -10.651  -7.636
  353    HD3  PRO  46           HD3      PRO  46   4.101  -9.346  -6.563
  354    H    GLY  47           HN       GLY  47   4.728  -6.395 -11.174
  355    HA2  GLY  47           HA1      GLY  47   5.508  -6.832 -13.508
  356    HA3  GLY  47           HA2      GLY  47   4.747  -8.412 -13.334
  357    H    THR  48           HN       THR  48   2.487  -7.485 -11.874
  358    HA   THR  48           HA       THR  48   0.825  -6.635 -14.047
  359    HB   THR  48           HB       THR  48  -0.198  -6.650 -11.251
  360    HG1  THR  48           HG1      THR  48   0.956  -8.496 -11.079
  361   HG21  THR  48          HG21      THR  48  -1.644  -8.288 -13.092
  362   HG22  THR  48          HG22      THR  48  -1.268  -6.750 -13.871
  363   HG23  THR  48          HG23      THR  48  -2.142  -6.771 -12.339
  364    H    SER  49           HN       SER  49   0.002  -4.692 -14.472
  365    HA   SER  49           HA       SER  49   1.028  -2.439 -13.010
  366    HB2  SER  49           HB2      SER  49  -0.801  -1.635 -15.044
  367    HB3  SER  49           HB3      SER  49   0.957  -1.499 -15.045
  368    HG   SER  49           HG       SER  49   1.128  -3.424 -16.080
  369    HA   PRO  50           HA       PRO  50  -2.623  -2.307 -10.469
  370    HB2  PRO  50           HB2      PRO  50  -1.677   0.342  -9.620
  371    HB3  PRO  50           HB3      PRO  50  -1.897  -1.126  -8.665
  372    HG2  PRO  50           HG2      PRO  50   0.547  -0.176  -9.263
  373    HG3  PRO  50           HG3      PRO  50   0.215  -1.914  -9.144
  374    HD2  PRO  50           HD2      PRO  50   0.476  -0.200 -11.591
  375    HD3  PRO  50           HD3      PRO  50   1.104  -1.837 -11.292
  376    H    ASP  51           HN       ASP  51  -1.745   0.125 -12.756
  377    HA   ASP  51           HA       ASP  51  -4.102   1.732 -12.506
  378    HB2  ASP  51           HB2      ASP  51  -2.142   2.745 -13.451
  379    HB3  ASP  51           HB3      ASP  51  -1.969   1.464 -14.640
  380    H    ALA  52           HN       ALA  52  -3.290  -1.253 -13.898
  381    HA   ALA  52           HA       ALA  52  -5.298  -1.268 -15.942
  382    HB1  ALA  52           HB1      ALA  52  -3.354  -3.221 -14.863
  383    HB2  ALA  52           HB2      ALA  52  -4.794  -3.873 -15.643
  384    HB3  ALA  52           HB3      ALA  52  -3.721  -2.793 -16.535
  385    H    LEU  53           HN       LEU  53  -5.081  -2.099 -12.600
  386    HA   LEU  53           HA       LEU  53  -7.532  -3.559 -12.453
  387    HB2  LEU  53           HB2      LEU  53  -6.189  -2.113 -10.179
  388    HB3  LEU  53           HB3      LEU  53  -7.208  -3.539 -10.104
  389    HG   LEU  53           HG       LEU  53  -4.464  -3.489 -11.362
  390   HD11  LEU  53          HD11      LEU  53  -5.230  -3.524  -8.605
  391   HD12  LEU  53          HD12      LEU  53  -4.496  -5.068  -9.038
  392   HD13  LEU  53          HD13      LEU  53  -3.615  -3.565  -9.315
  393   HD21  LEU  53          HD21      LEU  53  -5.798  -5.239 -12.286
  394   HD22  LEU  53          HD22      LEU  53  -4.695  -5.967 -11.118
  395   HD23  LEU  53          HD23      LEU  53  -6.387  -5.707 -10.691
  396    H    THR  54           HN       THR  54  -6.509  -0.254 -11.749
  397    HA   THR  54           HA       THR  54  -8.929   0.825 -10.930
  398    HB   THR  54           HB       THR  54  -7.412   2.626 -12.648
  399    HG1  THR  54           HG1      THR  54  -5.440   2.238 -11.971
  400   HG21  THR  54          HG21      THR  54  -7.259   2.915  -9.730
  401   HG22  THR  54          HG22      THR  54  -8.898   2.835 -10.380
  402   HG23  THR  54          HG23      THR  54  -7.778   4.066 -10.961
  403    H    ALA  55           HN       ALA  55  -7.557   0.630 -14.207
  404    HA   ALA  55           HA       ALA  55  -9.819   1.720 -15.514
  405    HB1  ALA  55           HB1      ALA  55  -8.293  -0.191 -17.105
  406    HB2  ALA  55           HB2      ALA  55  -8.575   1.531 -17.364
  407    HB3  ALA  55           HB3      ALA  55  -7.285   1.002 -16.284
  408    H    ALA  56           HN       ALA  56  -8.947  -1.558 -14.576
  409    HA   ALA  56           HA       ALA  56 -10.947  -2.904 -16.028
  410    HB1  ALA  56           HB1      ALA  56 -10.019  -4.707 -15.114
  411    HB2  ALA  56           HB2      ALA  56  -8.946  -3.630 -14.220
  412    HB3  ALA  56           HB3      ALA  56 -10.455  -4.176 -13.489
  413    H    VAL  57           HN       VAL  57 -10.968  -1.610 -12.700
  414    HA   VAL  57           HA       VAL  57 -13.655  -2.406 -12.211
  415    HB   VAL  57           HB       VAL  57 -12.076  -0.257 -10.814
  416   HG11  VAL  57          HG11      VAL  57 -14.614  -0.310 -10.542
  417   HG12  VAL  57          HG12      VAL  57 -14.366  -1.827  -9.677
  418   HG13  VAL  57          HG13      VAL  57 -13.641  -0.336  -9.072
  419   HG21  VAL  57          HG21      VAL  57 -11.046  -1.820  -9.562
  420   HG22  VAL  57          HG22      VAL  57 -12.459  -2.873  -9.528
  421   HG23  VAL  57          HG23      VAL  57 -11.393  -2.871 -10.933
  422    H    ALA  58           HN       ALA  58 -12.167   0.624 -13.318
  423    HA   ALA  58           HA       ALA  58 -14.550   2.135 -13.363
  424    HB1  ALA  58           HB1      ALA  58 -12.321   3.149 -13.440
  425    HB2  ALA  58           HB2      ALA  58 -12.081   2.484 -15.056
  426    HB3  ALA  58           HB3      ALA  58 -13.333   3.694 -14.778
  427    H    GLY  59           HN       GLY  59 -13.168  -0.139 -15.611
  428    HA2  GLY  59           HA1      GLY  59 -14.966   0.589 -17.751
  429    HA3  GLY  59           HA2      GLY  59 -13.845  -0.764 -17.743
  430    H    LEU  60           HN       LEU  60 -15.232  -1.284 -14.956
  431    HA   LEU  60           HA       LEU  60 -17.128  -3.158 -16.100
  432    HB2  LEU  60           HB2      LEU  60 -15.496  -3.033 -13.724
  433    HB3  LEU  60           HB3      LEU  60 -17.147  -3.472 -13.334
  434    HG   LEU  60           HG       LEU  60 -15.979  -4.938 -15.601
  435   HD11  LEU  60          HD11      LEU  60 -13.993  -4.864 -14.285
  436   HD12  LEU  60          HD12      LEU  60 -14.890  -5.227 -12.809
  437   HD13  LEU  60          HD13      LEU  60 -14.725  -6.454 -14.066
  438   HD21  LEU  60          HD21      LEU  60 -17.695  -5.502 -13.219
  439   HD22  LEU  60          HD22      LEU  60 -18.051  -5.719 -14.933
  440   HD23  LEU  60          HD23      LEU  60 -16.950  -6.827 -14.115
  441    H    GLY  61           HN       GLY  61 -17.540  -0.150 -15.696
  442    HA2  GLY  61           HA1      GLY  61 -19.611   0.955 -15.649
  443    HA3  GLY  61           HA2      GLY  61 -20.314  -0.444 -14.849
  444    H    TYR  62           HN       TYR  62 -17.600   0.018 -13.202
  445    HA   TYR  62           HA       TYR  62 -18.923   1.717 -11.215
  446    HB2  TYR  62           HB2      TYR  62 -16.505   0.050 -10.600
  447    HB3  TYR  62           HB3      TYR  62 -17.815   0.542  -9.539
  448    HD1  TYR  62           HD2      TYR  62 -20.208  -0.378 -10.864
  449    HD2  TYR  62           HD1      TYR  62 -16.402  -2.266 -10.619
  450    HE1  TYR  62           HE2      TYR  62 -21.280  -2.570 -11.175
  451    HE2  TYR  62           HE1      TYR  62 -17.465  -4.461 -10.924
  452    HH   TYR  62           HH       TYR  62 -19.764  -5.462 -10.506
  453    H    LYS  63           HN       LYS  63 -16.948   2.702  -9.741
  454    HA   LYS  63           HA       LYS  63 -15.116   3.993 -11.650
  455    HB2  LYS  63           HB2      LYS  63 -16.872   5.175  -9.560
  456    HB3  LYS  63           HB3      LYS  63 -15.279   5.887  -9.776
  457    HG2  LYS  63           HG2      LYS  63 -16.125   7.094 -11.424
  458    HG3  LYS  63           HG3      LYS  63 -16.303   5.604 -12.351
  459    HD2  LYS  63           HD2      LYS  63 -18.447   5.830 -10.465
  460    HD3  LYS  63           HD3      LYS  63 -18.336   7.312 -11.418
  461    HE2  LYS  63           HE2      LYS  63 -18.260   5.857 -13.467
  462    HE3  LYS  63           HE3      LYS  63 -18.645   4.490 -12.423
  463    HZ1  LYS  63           HZ1      LYS  63 -20.731   5.372 -11.913
  464    HZ2  LYS  63           HZ2      LYS  63 -20.569   5.624 -13.584
  465    HZ3  LYS  63           HZ3      LYS  63 -20.337   6.913 -12.503
  466    H    ALA  64           HN       ALA  64 -13.082   3.469 -11.228
  467    HA   ALA  64           HA       ALA  64 -12.379   2.900  -8.433
  468    HB1  ALA  64           HB1      ALA  64 -10.584   2.053 -10.635
  469    HB2  ALA  64           HB2      ALA  64 -10.936   1.273  -9.092
  470    HB3  ALA  64           HB3      ALA  64 -12.097   1.173 -10.417
  471    H    THR  65           HN       THR  65 -11.152   4.293  -7.441
  472    HA   THR  65           HA       THR  65  -9.236   5.888  -9.016
  473    HB   THR  65           HB       THR  65  -9.422   7.005  -6.444
  474    HG1  THR  65           HG1      THR  65 -12.007   6.437  -7.532
  475   HG21  THR  65          HG21      THR  65 -10.374   8.930  -7.617
  476   HG22  THR  65          HG22      THR  65 -10.714   7.912  -9.017
  477   HG23  THR  65          HG23      THR  65  -9.045   8.224  -8.537
  478    H    LEU  66           HN       LEU  66  -7.520   6.601  -6.910
  479    HA   LEU  66           HA       LEU  66  -6.897   4.208  -5.418
  480    HB2  LEU  66           HB2      LEU  66  -4.740   3.796  -6.308
  481    HB3  LEU  66           HB3      LEU  66  -5.843   3.864  -7.667
  482    HG   LEU  66           HG       LEU  66  -4.739   6.472  -7.232
  483   HD11  LEU  66          HD11      LEU  66  -2.660   6.044  -6.579
  484   HD12  LEU  66          HD12      LEU  66  -2.922   4.304  -6.688
  485   HD13  LEU  66          HD13      LEU  66  -2.415   5.210  -8.112
  486   HD21  LEU  66          HD21      LEU  66  -3.773   5.024  -9.548
  487   HD22  LEU  66          HD22      LEU  66  -5.512   4.830  -9.325
  488   HD23  LEU  66          HD23      LEU  66  -4.815   6.444  -9.457
  489    H    ALA  67           HN       ALA  67  -5.768   4.603  -3.594
  490    HA   ALA  67           HA       ALA  67  -4.610   7.283  -3.243
  491    HB1  ALA  67           HB1      ALA  67  -7.018   7.198  -2.429
  492    HB2  ALA  67           HB2      ALA  67  -6.439   6.115  -1.163
  493    HB3  ALA  67           HB3      ALA  67  -5.810   7.757  -1.274
  494    H    ASP  68           HN       ASP  68  -2.558   6.769  -2.854
  495    HA   ASP  68           HA       ASP  68  -1.883   5.312  -0.499
  496    HB2  ASP  68           HB2      ASP  68  -2.174   3.446  -2.070
  497    HB3  ASP  68           HB3      ASP  68  -1.043   4.208  -3.183
  498    H    ALA  69           HN       ALA  69  -0.383   6.125  -3.582
  499    HA   ALA  69           HA       ALA  69   1.339   8.062  -2.254
  500    HB1  ALA  69           HB1      ALA  69   3.018   6.721  -4.071
  501    HB2  ALA  69           HB2      ALA  69   3.137   6.745  -2.311
  502    HB3  ALA  69           HB3      ALA  69   2.226   5.469  -3.116
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1   2.579   1.803  -2.671
    2    H2   MET   1           H2       MET   1   2.726   1.331  -1.053
    3    H3   MET   1           H3       MET   1   1.235   1.885  -1.642
    4    HA   MET   1           HA       MET   1   2.609  -0.528  -2.665
    5    HB2  MET   1           HB2      MET   1   1.818  -0.477  -0.156
    6    HB3  MET   1           HB3      MET   1   0.218  -0.655  -0.864
    7    HG2  MET   1           HG2      MET   1   1.114  -2.666  -2.090
    8    HG3  MET   1           HG3      MET   1   2.553  -2.533  -1.080
    9    HE1  MET   1           HE1      MET   1   1.691  -5.406   0.277
   10    HE2  MET   1           HE2      MET   1   0.037  -5.503  -0.329
   11    HE3  MET   1           HE3      MET   1   1.330  -4.937  -1.384
   12    H    THR   2           HN       THR   2  -0.744  -0.616  -1.985
   13    HA   THR   2           HA       THR   2  -1.540   0.373  -4.569
   14    HB   THR   2           HB       THR   2  -2.692  -2.191  -4.561
   15    HG1  THR   2           HG1      THR   2  -1.206  -3.505  -3.856
   16   HG21  THR   2          HG21      THR   2  -2.309  -1.626  -6.691
   17   HG22  THR   2          HG22      THR   2  -0.681  -2.263  -6.456
   18   HG23  THR   2          HG23      THR   2  -0.993  -0.539  -6.249
   19    H    HIS   3           HN       HIS   3  -2.463   1.582  -2.528
   20    HA   HIS   3           HA       HIS   3  -4.980   0.406  -1.655
   21    HB2  HIS   3           HB2      HIS   3  -3.866   3.179  -1.313
   22    HB3  HIS   3           HB3      HIS   3  -5.426   2.687  -0.706
   23    HD1  HIS   3           HD1      HIS   3  -5.500   1.612   1.551
   24    HD2  HIS   3           HD2      HIS   3  -1.641   1.863   0.015
   25    HE1  HIS   3           HE1      HIS   3  -3.977   0.973   3.441
   26    HE2  HIS   3           HE2      HIS   3  -1.651   1.373   2.558
   27    H    LEU   4           HN       LEU   4  -6.769   0.531  -2.746
   28    HA   LEU   4           HA       LEU   4  -6.935   2.396  -5.020
   29    HB2  LEU   4           HB2      LEU   4  -7.178  -0.371  -5.005
   30    HB3  LEU   4           HB3      LEU   4  -8.833   0.194  -5.079
   31    HG   LEU   4           HG       LEU   4  -8.070   1.645  -7.049
   32   HD11  LEU   4          HD11      LEU   4  -5.917   1.647  -7.554
   33   HD12  LEU   4          HD12      LEU   4  -5.589   0.394  -6.357
   34   HD13  LEU   4          HD13      LEU   4  -6.054  -0.054  -7.998
   35   HD21  LEU   4          HD21      LEU   4  -9.475  -0.061  -7.658
   36   HD22  LEU   4          HD22      LEU   4  -8.016  -0.503  -8.545
   37   HD23  LEU   4          HD23      LEU   4  -8.407  -1.315  -7.030
   38    H    LYS   5           HN       LYS   5  -8.891   3.443  -5.404
   39    HA   LYS   5           HA       LYS   5 -10.636   3.594  -3.037
   40    HB2  LYS   5           HB2      LYS   5  -9.674   5.739  -3.506
   41    HB3  LYS   5           HB3      LYS   5 -10.069   5.610  -5.213
   42    HG2  LYS   5           HG2      LYS   5 -12.280   6.114  -4.890
   43    HG3  LYS   5           HG3      LYS   5 -12.281   5.533  -3.226
   44    HD2  LYS   5           HD2      LYS   5 -10.727   7.518  -2.743
   45    HD3  LYS   5           HD3      LYS   5 -11.247   8.131  -4.314
   46    HE2  LYS   5           HE2      LYS   5 -13.618   7.421  -3.105
   47    HE3  LYS   5           HE3      LYS   5 -12.667   8.064  -1.769
   48    HZ1  LYS   5           HZ1      LYS   5 -13.474   9.433  -4.264
   49    HZ2  LYS   5           HZ2      LYS   5 -12.218  10.022  -3.292
   50    HZ3  LYS   5           HZ3      LYS   5 -13.782   9.891  -2.658
   51    H    ILE   6           HN       ILE   6 -12.624   2.817  -3.191
   52    HA   ILE   6           HA       ILE   6 -13.630   2.003  -5.807
   53    HB   ILE   6           HB       ILE   6 -14.811   1.422  -3.090
   54   HG12  ILE   6          HG12      ILE   6 -12.599   0.461  -3.127
   55   HG13  ILE   6          HG13      ILE   6 -13.765  -0.837  -3.353
   56   HG21  ILE   6          HG21      ILE   6 -16.170   1.229  -5.297
   57   HG22  ILE   6          HG22      ILE   6 -15.219  -0.235  -5.543
   58   HG23  ILE   6          HG23      ILE   6 -16.241  -0.078  -4.114
   59   HD11  ILE   6          HD11      ILE   6 -11.549  -0.187  -4.957
   60   HD12  ILE   6          HD12      ILE   6 -12.758  -1.444  -5.223
   61   HD13  ILE   6          HD13      ILE   6 -12.993   0.163  -5.906
   62    H    THR   7           HN       THR   7 -15.270   3.007  -6.802
   63    HA   THR   7           HA       THR   7 -17.024   4.785  -5.300
   64    HB   THR   7           HB       THR   7 -16.406   6.170  -7.688
   65    HG1  THR   7           HG1      THR   7 -14.390   4.780  -7.335
   66   HG21  THR   7          HG21      THR   7 -15.302   7.739  -5.878
   67   HG22  THR   7          HG22      THR   7 -16.059   6.610  -4.753
   68   HG23  THR   7          HG23      THR   7 -17.047   7.495  -5.914
   69    H    GLY   8           HN       GLY   8 -18.878   5.510  -6.653
   70    HA2  GLY   8           HA1      GLY   8 -20.348   5.198  -8.487
   71    HA3  GLY   8           HA2      GLY   8 -19.411   3.790  -8.972
   72    H    MET   9           HN       MET   9 -19.307   2.202  -6.879
   73    HA   MET   9           HA       MET   9 -22.075   1.480  -6.357
   74    HB2  MET   9           HB2      MET   9 -19.515   0.105  -5.511
   75    HB3  MET   9           HB3      MET   9 -21.138  -0.506  -5.233
   76    HG2  MET   9           HG2      MET   9 -21.512  -0.833  -7.541
   77    HG3  MET   9           HG3      MET   9 -20.071   0.082  -7.978
   78    HE1  MET   9           HE1      MET   9 -21.654  -2.782  -8.098
   79    HE2  MET   9           HE2      MET   9 -20.376  -3.899  -8.581
   80    HE3  MET   9           HE3      MET   9 -21.017  -3.953  -6.941
   81    H    THR  10           HN       THR  10 -22.699   0.898  -4.088
   82    HA   THR  10           HA       THR  10 -22.153   3.155  -2.423
   83    HB   THR  10           HB       THR  10 -23.593   1.127  -1.030
   84    HG1  THR  10           HG1      THR  10 -24.701   1.675  -3.597
   85   HG21  THR  10          HG21      THR  10 -24.859   2.909  -0.539
   86   HG22  THR  10          HG22      THR  10 -25.222   3.192  -2.240
   87   HG23  THR  10          HG23      THR  10 -23.753   3.860  -1.531
   88    H    CYS  11           HN       CYS  11 -22.179  -0.284  -1.514
   89    HA   CYS  11           HA       CYS  11 -19.685  -0.562  -0.383
   90    HB2  CYS  11           HB2      CYS  11 -20.174  -0.113   2.009
   91    HB3  CYS  11           HB3      CYS  11 -20.138   1.340   1.024
   92    HG   CYS  11           HG       CYS  11 -23.075  -0.209   1.830
   93    H    ASP  12           HN       ASP  12 -19.487  -2.600   0.480
   94    HA   ASP  12           HA       ASP  12 -19.996  -4.717   1.092
   95    HB2  ASP  12           HB2      ASP  12 -21.251  -3.586   2.928
   96    HB3  ASP  12           HB3      ASP  12 -22.695  -3.628   1.920
   97    H    SER  13           HN       SER  13 -20.546  -6.480  -0.012
   98    HA   SER  13           HA       SER  13 -21.359  -7.808  -1.668
   99    HB2  SER  13           HB2      SER  13 -23.675  -5.877  -1.948
  100    HB3  SER  13           HB3      SER  13 -23.617  -7.561  -2.476
  101    HG   SER  13           HG       SER  13 -23.193  -6.895   0.231
  102    H    CYS  14           HN       CYS  14 -21.760  -4.369  -2.410
  103    HA   CYS  14           HA       CYS  14 -21.152  -4.433  -5.138
  104    HB2  CYS  14           HB2      CYS  14 -20.225  -2.225  -3.307
  105    HB3  CYS  14           HB3      CYS  14 -20.835  -2.110  -4.949
  106    HG   CYS  14           HG       CYS  14 -22.754  -2.857  -2.203
  107    H    ALA  15           HN       ALA  15 -19.118  -4.158  -2.279
  108    HA   ALA  15           HA       ALA  15 -16.634  -3.926  -3.595
  109    HB1  ALA  15           HB1      ALA  15 -15.711  -4.674  -1.363
  110    HB2  ALA  15           HB2      ALA  15 -16.753  -3.252  -1.332
  111    HB3  ALA  15           HB3      ALA  15 -17.384  -4.819  -0.822
  112    H    ALA  16           HN       ALA  16 -18.672  -6.642  -2.984
  113    HA   ALA  16           HA       ALA  16 -16.695  -8.677  -3.050
  114    HB1  ALA  16           HB1      ALA  16 -19.038  -9.836  -3.978
  115    HB2  ALA  16           HB2      ALA  16 -18.480  -9.778  -2.306
  116    HB3  ALA  16           HB3      ALA  16 -19.581  -8.540  -2.912
  117    H    HIS  17           HN       HIS  17 -18.803  -7.256  -5.544
  118    HA   HIS  17           HA       HIS  17 -17.891  -8.936  -7.640
  119    HB2  HIS  17           HB2      HIS  17 -19.956  -7.259  -7.495
  120    HB3  HIS  17           HB3      HIS  17 -18.809  -6.174  -8.276
  121    HD1  HIS  17           HD1      HIS  17 -20.097  -9.727  -8.820
  122    HD2  HIS  17           HD2      HIS  17 -18.854  -6.383 -10.964
  123    HE1  HIS  17           HE1      HIS  17 -20.392 -10.325 -11.243
  124    HE2  HIS  17           HE2      HIS  17 -19.442  -8.369 -12.519
  125    H    VAL  18           HN       VAL  18 -16.837  -5.823  -6.402
  126    HA   VAL  18           HA       VAL  18 -14.858  -5.291  -8.338
  127    HB   VAL  18           HB       VAL  18 -14.859  -4.518  -5.410
  128   HG11  VAL  18          HG11      VAL  18 -13.520  -2.970  -7.589
  129   HG12  VAL  18          HG12      VAL  18 -13.195  -2.973  -5.856
  130   HG13  VAL  18          HG13      VAL  18 -12.701  -4.345  -6.847
  131   HG21  VAL  18          HG21      VAL  18 -15.581  -2.277  -6.690
  132   HG22  VAL  18          HG22      VAL  18 -16.301  -3.475  -7.766
  133   HG23  VAL  18          HG23      VAL  18 -16.741  -3.446  -6.059
  134    H    LYS  19           HN       LYS  19 -14.739  -6.967  -5.213
  135    HA   LYS  19           HA       LYS  19 -12.032  -7.679  -5.264
  136    HB2  LYS  19           HB2      LYS  19 -13.819  -7.893  -3.383
  137    HB3  LYS  19           HB3      LYS  19 -14.138  -9.469  -4.094
  138    HG2  LYS  19           HG2      LYS  19 -11.746 -10.041  -3.776
  139    HG3  LYS  19           HG3      LYS  19 -11.526  -8.499  -2.944
  140    HD2  LYS  19           HD2      LYS  19 -12.875  -9.149  -1.144
  141    HD3  LYS  19           HD3      LYS  19 -13.623 -10.458  -2.062
  142    HE2  LYS  19           HE2      LYS  19 -10.692 -10.598  -1.672
  143    HE3  LYS  19           HE3      LYS  19 -11.698 -10.860  -0.249
  144    HZ1  LYS  19           HZ1      LYS  19 -12.141 -12.901  -0.949
  145    HZ2  LYS  19           HZ2      LYS  19 -11.101 -12.674  -2.278
  146    HZ3  LYS  19           HZ3      LYS  19 -12.751 -12.316  -2.420
  147    H    GLU  20           HN       GLU  20 -14.885  -9.290  -6.580
  148    HA   GLU  20           HA       GLU  20 -13.639 -11.627  -7.479
  149    HB2  GLU  20           HB2      GLU  20 -16.060 -10.122  -8.451
  150    HB3  GLU  20           HB3      GLU  20 -15.525 -11.605  -9.224
  151    HG2  GLU  20           HG2      GLU  20 -15.946 -12.881  -7.282
  152    HG3  GLU  20           HG3      GLU  20 -16.152 -11.433  -6.294
  153    H    ALA  21           HN       ALA  21 -14.175  -8.535  -9.095
  154    HA   ALA  21           HA       ALA  21 -13.044  -9.270 -11.577
  155    HB1  ALA  21           HB1      ALA  21 -14.140  -7.338 -11.936
  156    HB2  ALA  21           HB2      ALA  21 -13.906  -6.782 -10.278
  157    HB3  ALA  21           HB3      ALA  21 -12.617  -6.584 -11.466
  158    H    LEU  22           HN       LEU  22 -11.728  -8.007  -8.605
  159    HA   LEU  22           HA       LEU  22  -9.114  -7.472  -9.561
  160    HB2  LEU  22           HB2      LEU  22 -10.260  -7.967  -6.826
  161    HB3  LEU  22           HB3      LEU  22  -8.546  -7.708  -7.071
  162    HG   LEU  22           HG       LEU  22 -10.570  -5.714  -8.040
  163   HD11  LEU  22          HD11      LEU  22 -10.665  -6.327  -5.499
  164   HD12  LEU  22          HD12      LEU  22  -9.184  -5.372  -5.423
  165   HD13  LEU  22          HD13      LEU  22 -10.676  -4.640  -6.013
  166   HD21  LEU  22          HD21      LEU  22  -8.174  -5.680  -8.822
  167   HD22  LEU  22          HD22      LEU  22  -8.743  -4.200  -8.047
  168   HD23  LEU  22          HD23      LEU  22  -7.720  -5.327  -7.154
  169    H    GLU  23           HN       GLU  23 -10.595 -10.242  -7.924
  170    HA   GLU  23           HA       GLU  23  -8.152 -11.748  -7.897
  171    HB2  GLU  23           HB2      GLU  23 -11.015 -12.449  -7.283
  172    HB3  GLU  23           HB3      GLU  23  -9.724 -13.644  -7.230
  173    HG2  GLU  23           HG2      GLU  23  -8.567 -12.339  -5.536
  174    HG3  GLU  23           HG3      GLU  23  -9.829 -11.111  -5.604
  175    H    LYS  24           HN       LYS  24 -10.510 -11.142 -10.251
  176    HA   LYS  24           HA       LYS  24 -10.195 -13.554 -11.756
  177    HB2  LYS  24           HB2      LYS  24 -11.545 -10.970 -12.090
  178    HB3  LYS  24           HB3      LYS  24 -10.893 -11.615 -13.590
  179    HG2  LYS  24           HG2      LYS  24 -12.325 -13.597 -12.002
  180    HG3  LYS  24           HG3      LYS  24 -13.324 -12.234 -12.506
  181    HD2  LYS  24           HD2      LYS  24 -12.581 -12.582 -14.832
  182    HD3  LYS  24           HD3      LYS  24 -11.657 -13.989 -14.307
  183    HE2  LYS  24           HE2      LYS  24 -13.938 -14.783 -13.337
  184    HE3  LYS  24           HE3      LYS  24 -14.619 -13.612 -14.466
  185    HZ1  LYS  24           HZ1      LYS  24 -14.326 -16.010 -15.241
  186    HZ2  LYS  24           HZ2      LYS  24 -12.676 -15.644 -15.374
  187    HZ3  LYS  24           HZ3      LYS  24 -13.812 -14.777 -16.286
  188    H    VAL  25           HN       VAL  25  -8.510 -10.577 -11.405
  189    HA   VAL  25           HA       VAL  25  -6.734 -11.038 -13.648
  190    HB   VAL  25           HB       VAL  25  -6.720  -8.960 -11.446
  191   HG11  VAL  25          HG11      VAL  25  -4.849  -9.413 -13.746
  192   HG12  VAL  25          HG12      VAL  25  -5.095  -7.802 -13.074
  193   HG13  VAL  25          HG13      VAL  25  -4.471  -9.099 -12.053
  194   HG21  VAL  25          HG21      VAL  25  -7.143  -7.535 -13.629
  195   HG22  VAL  25          HG22      VAL  25  -7.804  -9.062 -14.211
  196   HG23  VAL  25          HG23      VAL  25  -8.469  -8.308 -12.761
  197    HA   PRO  26           HA       PRO  26  -4.346 -13.877 -11.155
  198    HB2  PRO  26           HB2      PRO  26  -2.375 -13.582 -13.342
  199    HB3  PRO  26           HB3      PRO  26  -3.176 -15.036 -12.736
  200    HG2  PRO  26           HG2      PRO  26  -3.843 -13.978 -15.094
  201    HG3  PRO  26           HG3      PRO  26  -5.069 -14.686 -14.026
  202    HD2  PRO  26           HD2      PRO  26  -4.392 -11.802 -14.480
  203    HD3  PRO  26           HD3      PRO  26  -5.987 -12.570 -14.326
  204    H    GLY  27           HN       GLY  27  -3.520 -10.699 -11.973
  205    HA2  GLY  27           HA1      GLY  27  -0.869 -10.714 -10.834
  206    HA3  GLY  27           HA2      GLY  27  -1.768  -9.302 -11.370
  207    H    VAL  28           HN       VAL  28  -3.991 -10.642  -9.528
  208    HA   VAL  28           HA       VAL  28  -3.170  -9.102  -7.183
  209    HB   VAL  28           HB       VAL  28  -5.840 -10.171  -8.091
  210   HG11  VAL  28          HG11      VAL  28  -6.273 -10.469  -5.891
  211   HG12  VAL  28          HG12      VAL  28  -4.988  -9.378  -5.375
  212   HG13  VAL  28          HG13      VAL  28  -6.524  -8.725  -5.940
  213   HG21  VAL  28          HG21      VAL  28  -5.245  -7.345  -7.331
  214   HG22  VAL  28          HG22      VAL  28  -4.713  -7.958  -8.897
  215   HG23  VAL  28          HG23      VAL  28  -6.426  -7.978  -8.479
  216    H    GLN  29           HN       GLN  29  -2.543 -10.019  -5.340
  217    HA   GLN  29           HA       GLN  29  -2.691 -12.938  -5.117
  218    HB2  GLN  29           HB2      GLN  29  -0.816 -10.869  -4.221
  219    HB3  GLN  29           HB3      GLN  29  -1.171 -12.076  -2.995
  220    HG2  GLN  29           HG2      GLN  29  -0.734 -13.577  -5.263
  221    HG3  GLN  29           HG3      GLN  29   0.446 -12.275  -5.390
  222   HE21  GLN  29          HE21      GLN  29   1.574 -14.586  -5.150
  223   HE22  GLN  29          HE22      GLN  29   2.154 -14.894  -3.550
  224    H    SER  30           HN       SER  30  -3.543  -9.975  -3.395
  225    HA   SER  30           HA       SER  30  -5.609 -11.413  -1.954
  226    HB2  SER  30           HB2      SER  30  -4.170  -9.728  -0.065
  227    HB3  SER  30           HB3      SER  30  -4.679 -11.407   0.098
  228    HG   SER  30           HG       SER  30  -2.771 -12.086  -0.591
  229    H    ALA  31           HN       ALA  31  -7.323 -10.216  -2.433
  230    HA   ALA  31           HA       ALA  31  -7.031  -7.304  -2.638
  231    HB1  ALA  31           HB1      ALA  31  -8.057  -8.538  -4.525
  232    HB2  ALA  31           HB2      ALA  31  -9.373  -9.021  -3.453
  233    HB3  ALA  31           HB3      ALA  31  -9.123  -7.317  -3.830
  234    H    LEU  32           HN       LEU  32  -7.015  -6.699  -0.493
  235    HA   LEU  32           HA       LEU  32  -9.199  -7.525   1.248
  236    HB2  LEU  32           HB2      LEU  32  -6.643  -6.010   1.623
  237    HB3  LEU  32           HB3      LEU  32  -7.915  -5.871   2.821
  238    HG   LEU  32           HG       LEU  32  -7.359  -8.645   2.177
  239   HD11  LEU  32          HD11      LEU  32  -5.102  -7.425   1.817
  240   HD12  LEU  32          HD12      LEU  32  -5.104  -7.259   3.573
  241   HD13  LEU  32          HD13      LEU  32  -5.150  -8.862   2.838
  242   HD21  LEU  32          HD21      LEU  32  -7.183  -7.057   4.736
  243   HD22  LEU  32          HD22      LEU  32  -8.627  -7.863   4.121
  244   HD23  LEU  32          HD23      LEU  32  -7.222  -8.816   4.598
  245    H    VAL  33           HN       VAL  33 -10.798  -6.466  -0.151
  246    HA   VAL  33           HA       VAL  33 -10.831  -3.587  -0.266
  247    HB   VAL  33           HB       VAL  33 -13.179  -5.388  -0.800
  248   HG11  VAL  33          HG11      VAL  33 -14.039  -3.308  -1.040
  249   HG12  VAL  33          HG12      VAL  33 -12.467  -2.579  -1.363
  250   HG13  VAL  33          HG13      VAL  33 -13.316  -3.447  -2.643
  251   HG21  VAL  33          HG21      VAL  33 -11.153  -6.207  -2.006
  252   HG22  VAL  33          HG22      VAL  33 -12.467  -5.691  -3.064
  253   HG23  VAL  33          HG23      VAL  33 -11.068  -4.644  -2.815
  254    H    SER  34           HN       SER  34 -11.708  -2.229   1.170
  255    HA   SER  34           HA       SER  34 -13.091  -3.408   3.480
  256    HB2  SER  34           HB2      SER  34 -11.945  -0.643   3.510
  257    HB3  SER  34           HB3      SER  34 -12.115  -1.800   4.832
  258    HG   SER  34           HG       SER  34 -10.518  -2.910   3.055
  259    H    TYR  35           HN       TYR  35 -15.204  -3.259   3.288
  260    HA   TYR  35           HA       TYR  35 -16.532  -1.393   1.652
  261    HB2  TYR  35           HB2      TYR  35 -18.206  -2.835   1.894
  262    HB3  TYR  35           HB3      TYR  35 -17.204  -3.756   2.995
  263    HD1  TYR  35           HD1      TYR  35 -19.659  -0.937   2.944
  264    HD2  TYR  35           HD2      TYR  35 -17.923  -4.121   5.169
  265    HE1  TYR  35           HE1      TYR  35 -21.291  -0.563   4.740
  266    HE2  TYR  35           HE2      TYR  35 -19.550  -3.754   6.971
  267    HH   TYR  35           HH       TYR  35 -21.747  -1.013   6.939
  268    HA   PRO  36           HA       PRO  36 -17.731   0.971   5.661
  269    HB2  PRO  36           HB2      PRO  36 -15.723   0.442   7.691
  270    HB3  PRO  36           HB3      PRO  36 -17.472   0.224   7.780
  271    HG2  PRO  36           HG2      PRO  36 -15.709  -1.850   7.757
  272    HG3  PRO  36           HG3      PRO  36 -17.359  -1.969   7.119
  273    HD2  PRO  36           HD2      PRO  36 -14.780  -1.579   5.644
  274    HD3  PRO  36           HD3      PRO  36 -16.170  -2.608   5.232
  275    H    LYS  37           HN       LYS  37 -14.666   0.623   4.321
  276    HA   LYS  37           HA       LYS  37 -13.831   3.290   5.218
  277    HB2  LYS  37           HB2      LYS  37 -12.400   0.827   4.535
  278    HB3  LYS  37           HB3      LYS  37 -11.719   2.262   3.779
  279    HG2  LYS  37           HG2      LYS  37 -11.415   3.313   5.920
  280    HG3  LYS  37           HG3      LYS  37 -12.250   1.987   6.732
  281    HD2  LYS  37           HD2      LYS  37 -10.363   0.572   5.502
  282    HD3  LYS  37           HD3      LYS  37  -9.507   2.112   5.608
  283    HE2  LYS  37           HE2      LYS  37  -8.890   1.306   7.626
  284    HE3  LYS  37           HE3      LYS  37 -10.458   1.950   8.112
  285    HZ1  LYS  37           HZ1      LYS  37 -11.420  -0.248   7.781
  286    HZ2  LYS  37           HZ2      LYS  37 -10.147  -0.313   8.902
  287    HZ3  LYS  37           HZ3      LYS  37  -9.907  -0.864   7.314
  288    H    GLY  38           HN       GLY  38 -14.732   1.386   2.454
  289    HA2  GLY  38           HA1      GLY  38 -15.456   2.139   0.380
  290    HA3  GLY  38           HA2      GLY  38 -14.985   3.770   0.840
  291    H    THR  39           HN       THR  39 -12.700   1.250   1.289
  292    HA   THR  39           HA       THR  39 -11.271   2.038  -1.156
  293    HB   THR  39           HB       THR  39  -9.186   1.740   0.531
  294    HG1  THR  39           HG1      THR  39  -9.921   3.124   2.412
  295   HG21  THR  39          HG21      THR  39 -10.354   3.806  -0.903
  296   HG22  THR  39          HG22      THR  39  -8.778   3.843  -0.112
  297   HG23  THR  39          HG23      THR  39 -10.202   4.453   0.732
  298    H    ALA  40           HN       ALA  40  -9.429   0.545  -1.626
  299    HA   ALA  40           HA       ALA  40  -9.891  -2.156  -0.549
  300    HB1  ALA  40           HB1      ALA  40 -10.934  -2.236  -2.658
  301    HB2  ALA  40           HB2      ALA  40  -9.638  -1.320  -3.425
  302    HB3  ALA  40           HB3      ALA  40  -9.351  -2.977  -2.895
  303    H    GLN  41           HN       GLN  41  -8.105  -3.218   0.046
  304    HA   GLN  41           HA       GLN  41  -5.502  -2.054  -0.711
  305    HB2  GLN  41           HB2      GLN  41  -5.854  -2.121   1.696
  306    HB3  GLN  41           HB3      GLN  41  -6.259  -3.830   1.625
  307    HG2  GLN  41           HG2      GLN  41  -4.087  -3.867   2.380
  308    HG3  GLN  41           HG3      GLN  41  -3.884  -4.112   0.648
  309   HE21  GLN  41          HE21      GLN  41  -2.320  -2.829   2.980
  310   HE22  GLN  41          HE22      GLN  41  -1.741  -1.355   2.290
  311    H    LEU  42           HN       LEU  42  -4.918  -3.045  -2.565
  312    HA   LEU  42           HA       LEU  42  -5.384  -5.937  -2.772
  313    HB2  LEU  42           HB2      LEU  42  -4.550  -5.049  -5.264
  314    HB3  LEU  42           HB3      LEU  42  -6.192  -5.417  -4.773
  315    HG   LEU  42           HG       LEU  42  -5.432  -2.720  -4.011
  316   HD11  LEU  42          HD11      LEU  42  -5.034  -1.732  -6.066
  317   HD12  LEU  42          HD12      LEU  42  -4.060  -3.201  -6.150
  318   HD13  LEU  42          HD13      LEU  42  -5.620  -3.131  -6.968
  319   HD21  LEU  42          HD21      LEU  42  -7.714  -4.135  -4.600
  320   HD22  LEU  42          HD22      LEU  42  -7.607  -2.388  -4.383
  321   HD23  LEU  42          HD23      LEU  42  -7.525  -3.081  -6.001
  322    H    ALA  43           HN       ALA  43  -3.684  -7.077  -2.139
  323    HA   ALA  43           HA       ALA  43  -0.972  -6.166  -2.570
  324    HB1  ALA  43           HB1      ALA  43  -0.348  -8.376  -1.643
  325    HB2  ALA  43           HB2      ALA  43  -1.453  -7.489  -0.592
  326    HB3  ALA  43           HB3      ALA  43  -2.056  -8.813  -1.591
  327    H    ILE  44           HN       ILE  44  -0.133  -6.244  -4.551
  328    HA   ILE  44           HA       ILE  44  -1.169  -8.281  -6.405
  329    HB   ILE  44           HB       ILE  44  -0.219  -6.707  -8.190
  330   HG12  ILE  44          HG12      ILE  44  -0.662  -4.354  -6.562
  331   HG13  ILE  44          HG13      ILE  44   0.661  -5.319  -5.917
  332   HG21  ILE  44          HG21      ILE  44  -2.341  -5.088  -7.237
  333   HG22  ILE  44          HG22      ILE  44  -2.380  -6.328  -8.489
  334   HG23  ILE  44          HG23      ILE  44  -2.698  -6.762  -6.810
  335   HD11  ILE  44          HD11      ILE  44   0.502  -3.733  -8.377
  336   HD12  ILE  44          HD12      ILE  44   1.887  -4.130  -7.360
  337   HD13  ILE  44          HD13      ILE  44   1.294  -5.300  -8.538
  338    H    VAL  45           HN       VAL  45   0.309  -9.106  -8.014
  339    HA   VAL  45           HA       VAL  45   2.860  -9.839  -6.940
  340    HB   VAL  45           HB       VAL  45   1.790 -10.206  -9.751
  341   HG11  VAL  45          HG11      VAL  45   3.899 -11.888  -8.436
  342   HG12  VAL  45          HG12      VAL  45   3.500 -11.738 -10.148
  343   HG13  VAL  45          HG13      VAL  45   4.310 -10.414  -9.315
  344   HG21  VAL  45          HG21      VAL  45   1.166 -12.451  -9.050
  345   HG22  VAL  45          HG22      VAL  45   1.728 -12.114  -7.413
  346   HG23  VAL  45          HG23      VAL  45   0.343 -11.239  -8.067
  347    HA   PRO  46           HA       PRO  46   5.076  -6.134  -8.080
  348    HB2  PRO  46           HB2      PRO  46   7.306  -8.124  -8.142
  349    HB3  PRO  46           HB3      PRO  46   7.230  -6.546  -7.350
  350    HG2  PRO  46           HG2      PRO  46   6.971  -8.771  -5.924
  351    HG3  PRO  46           HG3      PRO  46   5.967  -7.351  -5.575
  352    HD2  PRO  46           HD2      PRO  46   5.239  -9.894  -6.951
  353    HD3  PRO  46           HD3      PRO  46   4.262  -8.870  -5.880
  354    H    GLY  47           HN       GLY  47   4.607  -5.532 -10.132
  355    HA2  GLY  47           HA1      GLY  47   5.954  -5.461 -12.288
  356    HA3  GLY  47           HA2      GLY  47   5.667  -7.196 -12.320
  357    H    THR  48           HN       THR  48   2.969  -6.982 -11.275
  358    HA   THR  48           HA       THR  48   1.583  -6.686 -13.729
  359    HB   THR  48           HB       THR  48   0.067  -6.612 -11.170
  360    HG1  THR  48           HG1      THR  48   1.603  -8.086 -10.552
  361   HG21  THR  48          HG21      THR  48  -0.505  -7.133 -13.829
  362   HG22  THR  48          HG22      THR  48  -1.557  -7.461 -12.453
  363   HG23  THR  48          HG23      THR  48  -0.499  -8.728 -13.075
  364    H    SER  49           HN       SER  49   0.487  -5.037 -14.570
  365    HA   SER  49           HA       SER  49   0.934  -2.439 -13.498
  366    HB2  SER  49           HB2      SER  49  -0.921  -2.294 -15.627
  367    HB3  SER  49           HB3      SER  49   0.819  -2.001 -15.691
  368    HG   SER  49           HG       SER  49   1.166  -4.113 -16.267
  369    HA   PRO  50           HA       PRO  50  -2.780  -2.659 -11.002
  370    HB2  PRO  50           HB2      PRO  50  -2.057   0.068 -10.192
  371    HB3  PRO  50           HB3      PRO  50  -2.190  -1.390  -9.207
  372    HG2  PRO  50           HG2      PRO  50   0.192  -0.261  -9.765
  373    HG3  PRO  50           HG3      PRO  50  -0.003  -2.017  -9.601
  374    HD2  PRO  50           HD2      PRO  50   0.188  -0.354 -12.090
  375    HD3  PRO  50           HD3      PRO  50   0.937  -1.925 -11.726
  376    H    ASP  51           HN       ASP  51  -2.030  -0.483 -13.478
  377    HA   ASP  51           HA       ASP  51  -4.268   1.265 -13.342
  378    HB2  ASP  51           HB2      ASP  51  -2.567   2.124 -14.660
  379    HB3  ASP  51           HB3      ASP  51  -2.152   0.561 -15.336
  380    H    ALA  52           HN       ALA  52  -3.691  -1.926 -14.419
  381    HA   ALA  52           HA       ALA  52  -5.819  -2.150 -16.276
  382    HB1  ALA  52           HB1      ALA  52  -3.943  -4.009 -14.955
  383    HB2  ALA  52           HB2      ALA  52  -5.459  -4.700 -15.531
  384    HB3  ALA  52           HB3      ALA  52  -4.388  -3.866 -16.655
  385    H    LEU  53           HN       LEU  53  -5.511  -2.578 -12.842
  386    HA   LEU  53           HA       LEU  53  -8.053  -3.837 -12.469
  387    HB2  LEU  53           HB2      LEU  53  -6.522  -2.334 -10.360
  388    HB3  LEU  53           HB3      LEU  53  -7.611  -3.691 -10.154
  389    HG   LEU  53           HG       LEU  53  -5.049  -4.027 -11.675
  390   HD11  LEU  53          HD11      LEU  53  -5.065  -3.106  -9.088
  391   HD12  LEU  53          HD12      LEU  53  -4.934  -4.854  -8.890
  392   HD13  LEU  53          HD13      LEU  53  -3.751  -3.985  -9.867
  393   HD21  LEU  53          HD21      LEU  53  -5.954  -6.170  -9.950
  394   HD22  LEU  53          HD22      LEU  53  -7.190  -5.689 -11.112
  395   HD23  LEU  53          HD23      LEU  53  -5.594  -6.181 -11.678
  396    H    THR  54           HN       THR  54  -6.756  -0.570 -12.049
  397    HA   THR  54           HA       THR  54  -9.072   0.702 -11.164
  398    HB   THR  54           HB       THR  54  -7.485   2.342 -12.979
  399    HG1  THR  54           HG1      THR  54  -5.883   1.597 -10.881
  400   HG21  THR  54          HG21      THR  54  -6.993   3.048 -10.319
  401   HG22  THR  54          HG22      THR  54  -8.650   2.447 -10.340
  402   HG23  THR  54          HG23      THR  54  -8.178   3.769 -11.408
  403    H    ALA  55           HN       ALA  55  -7.824   0.282 -14.461
  404    HA   ALA  55           HA       ALA  55 -10.018   1.526 -15.742
  405    HB1  ALA  55           HB1      ALA  55  -8.173  -0.538 -16.935
  406    HB2  ALA  55           HB2      ALA  55  -9.113   0.681 -17.793
  407    HB3  ALA  55           HB3      ALA  55  -7.764   1.169 -16.766
  408    H    ALA  56           HN       ALA  56  -9.388  -1.783 -14.730
  409    HA   ALA  56           HA       ALA  56 -11.553  -2.989 -16.069
  410    HB1  ALA  56           HB1      ALA  56  -9.558  -3.936 -14.500
  411    HB2  ALA  56           HB2      ALA  56 -10.931  -4.064 -13.401
  412    HB3  ALA  56           HB3      ALA  56 -10.977  -4.872 -14.968
  413    H    VAL  57           HN       VAL  57 -11.332  -1.647 -12.768
  414    HA   VAL  57           HA       VAL  57 -14.051  -2.168 -12.158
  415    HB   VAL  57           HB       VAL  57 -12.226  -0.134 -10.899
  416   HG11  VAL  57          HG11      VAL  57 -14.689  -1.414  -9.738
  417   HG12  VAL  57          HG12      VAL  57 -13.706  -0.138  -9.020
  418   HG13  VAL  57          HG13      VAL  57 -14.659   0.192 -10.466
  419   HG21  VAL  57          HG21      VAL  57 -12.204  -2.995 -10.819
  420   HG22  VAL  57          HG22      VAL  57 -11.111  -1.850 -10.040
  421   HG23  VAL  57          HG23      VAL  57 -12.589  -2.357  -9.220
  422    H    ALA  58           HN       ALA  58 -12.371   0.735 -13.369
  423    HA   ALA  58           HA       ALA  58 -14.668   2.384 -13.383
  424    HB1  ALA  58           HB1      ALA  58 -11.967   2.501 -14.592
  425    HB2  ALA  58           HB2      ALA  58 -13.212   3.541 -15.283
  426    HB3  ALA  58           HB3      ALA  58 -12.804   3.671 -13.573
  427    H    GLY  59           HN       GLY  59 -13.414   0.037 -15.632
  428    HA2  GLY  59           HA1      GLY  59 -15.179   0.838 -17.775
  429    HA3  GLY  59           HA2      GLY  59 -14.105  -0.554 -17.766
  430    H    LEU  60           HN       LEU  60 -15.618  -0.877 -14.959
  431    HA   LEU  60           HA       LEU  60 -17.575  -2.720 -16.049
  432    HB2  LEU  60           HB2      LEU  60 -16.052  -2.490 -13.605
  433    HB3  LEU  60           HB3      LEU  60 -17.744  -2.793 -13.269
  434    HG   LEU  60           HG       LEU  60 -16.548  -4.532 -15.324
  435   HD11  LEU  60          HD11      LEU  60 -14.826  -5.327 -14.173
  436   HD12  LEU  60          HD12      LEU  60 -15.086  -4.072 -12.960
  437   HD13  LEU  60          HD13      LEU  60 -15.863  -5.644 -12.783
  438   HD21  LEU  60          HD21      LEU  60 -17.876  -6.204 -14.218
  439   HD22  LEU  60          HD22      LEU  60 -18.150  -5.135 -12.841
  440   HD23  LEU  60          HD23      LEU  60 -18.851  -4.746 -14.411
  441    H    GLY  61           HN       GLY  61 -17.656   0.377 -15.698
  442    HA2  GLY  61           HA1      GLY  61 -19.669   1.624 -15.925
  443    HA3  GLY  61           HA2      GLY  61 -20.495   0.408 -14.960
  444    H    TYR  62           HN       TYR  62 -17.969   0.602 -13.144
  445    HA   TYR  62           HA       TYR  62 -19.111   2.744 -11.516
  446    HB2  TYR  62           HB2      TYR  62 -16.916   1.138 -10.366
  447    HB3  TYR  62           HB3      TYR  62 -18.455   1.607  -9.660
  448    HD1  TYR  62           HD2      TYR  62 -20.511   0.374 -11.044
  449    HD2  TYR  62           HD1      TYR  62 -16.583  -1.147 -10.441
  450    HE1  TYR  62           HE2      TYR  62 -21.356  -1.913 -11.352
  451    HE2  TYR  62           HE1      TYR  62 -17.417  -3.438 -10.755
  452    HH   TYR  62           HH       TYR  62 -19.179  -4.685 -11.483
  453    H    LYS  63           HN       LYS  63 -16.782   3.181  -9.934
  454    HA   LYS  63           HA       LYS  63 -14.878   4.299 -11.862
  455    HB2  LYS  63           HB2      LYS  63 -16.214   6.195 -11.336
  456    HB3  LYS  63           HB3      LYS  63 -16.265   5.777  -9.628
  457    HG2  LYS  63           HG2      LYS  63 -14.669   7.333  -9.431
  458    HG3  LYS  63           HG3      LYS  63 -13.594   6.066 -10.020
  459    HD2  LYS  63           HD2      LYS  63 -14.911   7.436 -12.200
  460    HD3  LYS  63           HD3      LYS  63 -14.033   8.564 -11.164
  461    HE2  LYS  63           HE2      LYS  63 -11.998   7.313 -11.436
  462    HE3  LYS  63           HE3      LYS  63 -12.846   6.050 -12.328
  463    HZ1  LYS  63           HZ1      LYS  63 -12.037   8.728 -13.200
  464    HZ2  LYS  63           HZ2      LYS  63 -13.462   8.076 -13.855
  465    HZ3  LYS  63           HZ3      LYS  63 -11.991   7.255 -14.041
  466    H    ALA  64           HN       ALA  64 -12.856   3.738 -11.361
  467    HA   ALA  64           HA       ALA  64 -12.291   3.080  -8.550
  468    HB1  ALA  64           HB1      ALA  64 -11.265   1.215  -9.186
  469    HB2  ALA  64           HB2      ALA  64 -11.955   1.476 -10.788
  470    HB3  ALA  64           HB3      ALA  64 -10.332   2.063 -10.419
  471    H    THR  65           HN       THR  65 -10.782   4.192  -7.536
  472    HA   THR  65           HA       THR  65  -8.882   5.770  -9.145
  473    HB   THR  65           HB       THR  65  -9.235   6.886  -6.504
  474    HG1  THR  65           HG1      THR  65 -11.519   6.104  -7.819
  475   HG21  THR  65          HG21      THR  65 -10.130   8.300  -8.961
  476   HG22  THR  65          HG22      THR  65  -8.437   7.814  -8.872
  477   HG23  THR  65          HG23      THR  65  -9.117   8.872  -7.635
  478    H    LEU  66           HN       LEU  66  -7.374   6.599  -6.821
  479    HA   LEU  66           HA       LEU  66  -6.603   4.181  -5.446
  480    HB2  LEU  66           HB2      LEU  66  -4.834   3.628  -6.680
  481    HB3  LEU  66           HB3      LEU  66  -5.288   4.853  -7.845
  482    HG   LEU  66           HG       LEU  66  -3.887   6.162  -5.752
  483   HD11  LEU  66          HD11      LEU  66  -1.757   4.581  -6.659
  484   HD12  LEU  66          HD12      LEU  66  -2.389   4.706  -5.018
  485   HD13  LEU  66          HD13      LEU  66  -3.003   3.462  -6.107
  486   HD21  LEU  66          HD21      LEU  66  -3.233   5.501  -8.614
  487   HD22  LEU  66          HD22      LEU  66  -3.935   6.990  -7.982
  488   HD23  LEU  66          HD23      LEU  66  -2.262   6.574  -7.608
  489    H    ALA  67           HN       ALA  67  -5.736   4.617  -3.500
  490    HA   ALA  67           HA       ALA  67  -5.139   7.427  -2.881
  491    HB1  ALA  67           HB1      ALA  67  -7.556   6.347  -2.284
  492    HB2  ALA  67           HB2      ALA  67  -6.652   5.996  -0.811
  493    HB3  ALA  67           HB3      ALA  67  -6.798   7.658  -1.379
  494    H    ASP  68           HN       ASP  68  -3.050   5.935  -3.187
  495    HA   ASP  68           HA       ASP  68  -2.303   4.635  -0.740
  496    HB2  ASP  68           HB2      ASP  68  -1.470   4.299  -3.312
  497    HB3  ASP  68           HB3      ASP  68  -0.171   5.297  -2.663
  498    H    ALA  69           HN       ALA  69  -1.432   5.608   0.949
  499    HA   ALA  69           HA       ALA  69  -0.473   7.147   2.303
  500    HB1  ALA  69           HB1      ALA  69   0.795   8.247  -0.204
  501    HB2  ALA  69           HB2      ALA  69   1.295   8.574   1.455
  502    HB3  ALA  69           HB3      ALA  69   1.458   6.949   0.789
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1   1.880  -4.724  -1.512
    2    H2   MET   1           H2       MET   1   2.417  -3.118  -1.504
    3    H3   MET   1           H3       MET   1   1.318  -3.638  -2.682
    4    HA   MET   1           HA       MET   1  -0.215  -4.194  -0.770
    5    HB2  MET   1           HB2      MET   1   0.164  -3.140   1.310
    6    HB3  MET   1           HB3      MET   1   1.695  -3.886   0.882
    7    HG2  MET   1           HG2      MET   1   0.986  -0.968   0.623
    8    HG3  MET   1           HG3      MET   1   2.046  -1.689   1.832
    9    HE1  MET   1           HE1      MET   1   4.087   0.557  -0.896
   10    HE2  MET   1           HE2      MET   1   2.371   0.725  -0.530
   11    HE3  MET   1           HE3      MET   1   3.538   0.554   0.781
   12    H    THR   2           HN       THR   2   0.065  -2.696  -3.227
   13    HA   THR   2           HA       THR   2  -0.398   0.052  -2.950
   14    HB   THR   2           HB       THR   2  -1.549  -1.588  -5.193
   15    HG1  THR   2           HG1      THR   2   1.184  -0.877  -4.739
   16   HG21  THR   2          HG21      THR   2  -1.873   0.926  -5.029
   17   HG22  THR   2          HG22      THR   2  -1.136   0.340  -6.521
   18   HG23  THR   2          HG23      THR   2  -0.130   1.070  -5.270
   19    H    HIS   3           HN       HIS   3  -2.119   1.181  -2.305
   20    HA   HIS   3           HA       HIS   3  -4.603  -0.263  -1.801
   21    HB2  HIS   3           HB2      HIS   3  -3.791   2.526  -0.981
   22    HB3  HIS   3           HB3      HIS   3  -5.276   1.721  -0.510
   23    HD1  HIS   3           HD1      HIS   3  -1.521   1.417  -0.018
   24    HD2  HIS   3           HD2      HIS   3  -5.088   0.183   1.736
   25    HE1  HIS   3           HE1      HIS   3  -0.874   0.322   2.150
   26    HE2  HIS   3           HE2      HIS   3  -3.053  -0.210   3.283
   27    H    LEU   4           HN       LEU   4  -6.449   0.126  -2.809
   28    HA   LEU   4           HA       LEU   4  -6.433   2.075  -5.019
   29    HB2  LEU   4           HB2      LEU   4  -7.005  -0.736  -4.961
   30    HB3  LEU   4           HB3      LEU   4  -8.466   0.128  -5.396
   31    HG   LEU   4           HG       LEU   4  -6.927   1.334  -7.125
   32   HD11  LEU   4          HD11      LEU   4  -4.840   0.624  -7.336
   33   HD12  LEU   4          HD12      LEU   4  -5.081  -0.445  -5.955
   34   HD13  LEU   4          HD13      LEU   4  -5.398  -1.030  -7.588
   35   HD21  LEU   4          HD21      LEU   4  -7.967   0.072  -8.658
   36   HD22  LEU   4          HD22      LEU   4  -7.306  -1.432  -8.014
   37   HD23  LEU   4          HD23      LEU   4  -8.729  -0.704  -7.267
   38    H    LYS   5           HN       LYS   5  -8.622   2.953  -5.544
   39    HA   LYS   5           HA       LYS   5 -10.224   3.188  -3.081
   40    HB2  LYS   5           HB2      LYS   5  -9.301   5.206  -5.052
   41    HB3  LYS   5           HB3      LYS   5 -10.908   5.422  -4.374
   42    HG2  LYS   5           HG2      LYS   5  -9.493   4.938  -2.127
   43    HG3  LYS   5           HG3      LYS   5  -8.269   5.730  -3.120
   44    HD2  LYS   5           HD2      LYS   5  -9.283   7.506  -2.014
   45    HD3  LYS   5           HD3      LYS   5 -10.104   7.487  -3.576
   46    HE2  LYS   5           HE2      LYS   5 -11.821   5.962  -2.383
   47    HE3  LYS   5           HE3      LYS   5 -11.110   6.597  -0.900
   48    HZ1  LYS   5           HZ1      LYS   5 -12.214   8.288  -3.076
   49    HZ2  LYS   5           HZ2      LYS   5 -11.683   8.805  -1.549
   50    HZ3  LYS   5           HZ3      LYS   5 -13.077   7.848  -1.682
   51    H    ILE   6           HN       ILE   6 -12.409   3.012  -3.202
   52    HA   ILE   6           HA       ILE   6 -13.491   2.094  -5.789
   53    HB   ILE   6           HB       ILE   6 -14.283   1.296  -2.982
   54   HG12  ILE   6          HG12      ILE   6 -12.262   0.171  -3.638
   55   HG13  ILE   6          HG13      ILE   6 -13.586  -0.982  -3.776
   56   HG21  ILE   6          HG21      ILE   6 -15.536  -0.434  -4.742
   57   HG22  ILE   6          HG22      ILE   6 -16.300   0.863  -3.826
   58   HG23  ILE   6          HG23      ILE   6 -15.753   1.155  -5.477
   59   HD11  ILE   6          HD11      ILE   6 -12.025  -1.135  -5.647
   60   HD12  ILE   6          HD12      ILE   6 -13.640  -0.670  -6.176
   61   HD13  ILE   6          HD13      ILE   6 -12.367   0.543  -6.067
   62    H    THR   7           HN       THR   7 -15.153   3.215  -6.632
   63    HA   THR   7           HA       THR   7 -16.679   5.009  -4.889
   64    HB   THR   7           HB       THR   7 -16.292   6.395  -7.316
   65    HG1  THR   7           HG1      THR   7 -14.365   4.891  -7.321
   66   HG21  THR   7          HG21      THR   7 -16.634   7.621  -5.337
   67   HG22  THR   7          HG22      THR   7 -14.955   7.945  -5.769
   68   HG23  THR   7          HG23      THR   7 -15.330   6.788  -4.492
   69    H    GLY   8           HN       GLY   8 -18.607   5.908  -6.051
   70    HA2  GLY   8           HA1      GLY   8 -20.241   5.793  -7.753
   71    HA3  GLY   8           HA2      GLY   8 -19.473   4.332  -8.359
   72    H    MET   9           HN       MET   9 -19.380   2.668  -6.283
   73    HA   MET   9           HA       MET   9 -22.194   2.066  -5.872
   74    HB2  MET   9           HB2      MET   9 -19.729   0.473  -5.162
   75    HB3  MET   9           HB3      MET   9 -21.384  -0.067  -4.938
   76    HG2  MET   9           HG2      MET   9 -21.759  -0.324  -7.171
   77    HG3  MET   9           HG3      MET   9 -20.518   0.837  -7.631
   78    HE1  MET   9           HE1      MET   9 -17.242  -1.147  -6.861
   79    HE2  MET   9           HE2      MET   9 -17.834   0.122  -7.934
   80    HE3  MET   9           HE3      MET   9 -18.103   0.241  -6.194
   81    H    THR  10           HN       THR  10 -22.785   1.132  -3.651
   82    HA   THR  10           HA       THR  10 -22.326   3.177  -1.701
   83    HB   THR  10           HB       THR  10 -23.673   0.915  -0.608
   84    HG1  THR  10           HG1      THR  10 -25.358   1.412  -2.582
   85   HG21  THR  10          HG21      THR  10 -23.953   3.655  -0.674
   86   HG22  THR  10          HG22      THR  10 -25.088   2.524   0.064
   87   HG23  THR  10          HG23      THR  10 -25.353   3.091  -1.585
   88    H    CYS  11           HN       CYS  11 -22.241  -0.336  -1.260
   89    HA   CYS  11           HA       CYS  11 -19.619  -0.507  -0.225
   90    HB2  CYS  11           HB2      CYS  11 -20.351  -0.984   2.155
   91    HB3  CYS  11           HB3      CYS  11 -20.347   0.705   1.672
   92    HG   CYS  11           HG       CYS  11 -23.238  -1.099   1.508
   93    H    ASP  12           HN       ASP  12 -19.500  -2.651   1.140
   94    HA   ASP  12           HA       ASP  12 -19.653  -4.970   0.851
   95    HB2  ASP  12           HB2      ASP  12 -20.906  -3.890   2.911
   96    HB3  ASP  12           HB3      ASP  12 -22.296  -4.661   2.151
   97    H    SER  13           HN       SER  13 -20.123  -6.522  -0.464
   98    HA   SER  13           HA       SER  13 -21.130  -7.813  -2.041
   99    HB2  SER  13           HB2      SER  13 -23.506  -5.941  -2.071
  100    HB3  SER  13           HB3      SER  13 -23.425  -7.590  -2.693
  101    HG   SER  13           HG       SER  13 -23.833  -6.685  -0.128
  102    H    CYS  14           HN       CYS  14 -21.737  -4.329  -2.568
  103    HA   CYS  14           HA       CYS  14 -21.103  -4.369  -5.319
  104    HB2  CYS  14           HB2      CYS  14 -20.678  -2.089  -3.369
  105    HB3  CYS  14           HB3      CYS  14 -20.848  -1.956  -5.115
  106    HG   CYS  14           HG       CYS  14 -23.529  -3.347  -4.634
  107    H    ALA  15           HN       ALA  15 -19.174  -3.862  -2.421
  108    HA   ALA  15           HA       ALA  15 -16.685  -3.573  -3.768
  109    HB1  ALA  15           HB1      ALA  15 -15.842  -4.257  -1.384
  110    HB2  ALA  15           HB2      ALA  15 -16.605  -2.689  -1.648
  111    HB3  ALA  15           HB3      ALA  15 -17.534  -4.015  -0.945
  112    H    ALA  16           HN       ALA  16 -18.631  -6.266  -2.824
  113    HA   ALA  16           HA       ALA  16 -16.566  -8.237  -2.831
  114    HB1  ALA  16           HB1      ALA  16 -18.529  -8.797  -1.634
  115    HB2  ALA  16           HB2      ALA  16 -19.564  -8.421  -3.012
  116    HB3  ALA  16           HB3      ALA  16 -18.517  -9.839  -3.057
  117    H    HIS  17           HN       HIS  17 -18.957  -7.100  -5.182
  118    HA   HIS  17           HA       HIS  17 -18.302  -8.753  -7.331
  119    HB2  HIS  17           HB2      HIS  17 -20.116  -6.820  -6.979
  120    HB3  HIS  17           HB3      HIS  17 -18.918  -5.892  -7.873
  121    HD1  HIS  17           HD1      HIS  17 -18.898  -9.339  -9.024
  122    HD2  HIS  17           HD2      HIS  17 -21.160  -5.928  -9.787
  123    HE1  HIS  17           HE1      HIS  17 -20.054  -9.759 -11.220
  124    HE2  HIS  17           HE2      HIS  17 -21.568  -7.771 -11.551
  125    H    VAL  18           HN       VAL  18 -16.961  -5.628  -6.355
  126    HA   VAL  18           HA       VAL  18 -15.001  -5.390  -8.344
  127    HB   VAL  18           HB       VAL  18 -15.001  -4.364  -5.497
  128   HG11  VAL  18          HG11      VAL  18 -13.366  -3.035  -7.573
  129   HG12  VAL  18          HG12      VAL  18 -13.069  -3.228  -5.846
  130   HG13  VAL  18          HG13      VAL  18 -12.759  -4.569  -6.948
  131   HG21  VAL  18          HG21      VAL  18 -15.405  -2.660  -7.903
  132   HG22  VAL  18          HG22      VAL  18 -16.743  -3.662  -7.338
  133   HG23  VAL  18          HG23      VAL  18 -16.023  -2.463  -6.263
  134    H    LYS  19           HN       LYS  19 -14.937  -6.924  -5.153
  135    HA   LYS  19           HA       LYS  19 -12.260  -7.696  -5.108
  136    HB2  LYS  19           HB2      LYS  19 -13.772  -7.871  -3.168
  137    HB3  LYS  19           HB3      LYS  19 -14.624  -9.190  -3.956
  138    HG2  LYS  19           HG2      LYS  19 -12.186 -10.229  -4.025
  139    HG3  LYS  19           HG3      LYS  19 -11.971  -9.160  -2.637
  140    HD2  LYS  19           HD2      LYS  19 -12.671 -11.336  -1.866
  141    HD3  LYS  19           HD3      LYS  19 -13.973 -10.177  -1.594
  142    HE2  LYS  19           HE2      LYS  19 -15.340 -11.529  -2.703
  143    HE3  LYS  19           HE3      LYS  19 -14.396 -11.221  -4.160
  144    HZ1  LYS  19           HZ1      LYS  19 -13.846 -13.379  -2.190
  145    HZ2  LYS  19           HZ2      LYS  19 -12.993 -13.100  -3.634
  146    HZ3  LYS  19           HZ3      LYS  19 -14.617 -13.588  -3.685
  147    H    GLU  20           HN       GLU  20 -15.085  -9.442  -6.415
  148    HA   GLU  20           HA       GLU  20 -13.637 -11.688  -7.305
  149    HB2  GLU  20           HB2      GLU  20 -16.047 -10.641  -8.766
  150    HB3  GLU  20           HB3      GLU  20 -15.525 -12.307  -8.583
  151    HG2  GLU  20           HG2      GLU  20 -16.531 -12.545  -6.583
  152    HG3  GLU  20           HG3      GLU  20 -16.213 -10.879  -6.100
  153    H    ALA  21           HN       ALA  21 -14.437  -8.637  -8.879
  154    HA   ALA  21           HA       ALA  21 -13.393  -9.250 -11.415
  155    HB1  ALA  21           HB1      ALA  21 -14.735  -7.141 -10.408
  156    HB2  ALA  21           HB2      ALA  21 -13.110  -6.462 -10.492
  157    HB3  ALA  21           HB3      ALA  21 -13.874  -7.104 -11.946
  158    H    LEU  22           HN       LEU  22 -11.932  -7.977  -8.491
  159    HA   LEU  22           HA       LEU  22  -9.365  -7.479  -9.601
  160    HB2  LEU  22           HB2      LEU  22 -10.451  -7.775  -6.830
  161    HB3  LEU  22           HB3      LEU  22  -8.714  -7.761  -7.077
  162    HG   LEU  22           HG       LEU  22 -10.480  -5.554  -8.113
  163   HD11  LEU  22          HD11      LEU  22  -9.651  -4.318  -6.046
  164   HD12  LEU  22          HD12      LEU  22 -10.943  -5.495  -5.812
  165   HD13  LEU  22          HD13      LEU  22  -9.283  -5.910  -5.382
  166   HD21  LEU  22          HD21      LEU  22  -8.186  -4.370  -7.653
  167   HD22  LEU  22          HD22      LEU  22  -7.555  -6.012  -7.776
  168   HD23  LEU  22          HD23      LEU  22  -8.437  -5.303  -9.129
  169    H    GLU  23           HN       GLU  23 -10.778 -10.215  -7.849
  170    HA   GLU  23           HA       GLU  23  -8.351 -11.722  -7.845
  171    HB2  GLU  23           HB2      GLU  23 -11.206 -12.446  -7.214
  172    HB3  GLU  23           HB3      GLU  23  -9.879 -13.597  -7.094
  173    HG2  GLU  23           HG2      GLU  23  -8.760 -12.057  -5.504
  174    HG3  GLU  23           HG3      GLU  23 -10.190 -11.034  -5.554
  175    H    LYS  24           HN       LYS  24 -10.708 -11.140 -10.210
  176    HA   LYS  24           HA       LYS  24 -10.280 -13.554 -11.708
  177    HB2  LYS  24           HB2      LYS  24 -11.986 -12.802 -12.955
  178    HB3  LYS  24           HB3      LYS  24 -12.129 -11.498 -11.791
  179    HG2  LYS  24           HG2      LYS  24 -10.776 -10.057 -13.168
  180    HG3  LYS  24           HG3      LYS  24 -10.476 -11.374 -14.304
  181    HD2  LYS  24           HD2      LYS  24 -13.227 -11.291 -14.126
  182    HD3  LYS  24           HD3      LYS  24 -12.763  -9.590 -14.069
  183    HE2  LYS  24           HE2      LYS  24 -11.162 -10.580 -16.060
  184    HE3  LYS  24           HE3      LYS  24 -12.648 -11.502 -16.276
  185    HZ1  LYS  24           HZ1      LYS  24 -12.905  -9.587 -17.570
  186    HZ2  LYS  24           HZ2      LYS  24 -12.285  -8.563 -16.366
  187    HZ3  LYS  24           HZ3      LYS  24 -13.816  -9.269 -16.173
  188    H    VAL  25           HN       VAL  25  -8.551 -10.708 -11.155
  189    HA   VAL  25           HA       VAL  25  -7.002 -10.784 -13.605
  190    HB   VAL  25           HB       VAL  25  -6.749  -9.129 -11.087
  191   HG11  VAL  25          HG11      VAL  25  -5.265  -7.847 -13.016
  192   HG12  VAL  25          HG12      VAL  25  -4.614  -8.805 -11.685
  193   HG13  VAL  25          HG13      VAL  25  -4.855  -9.546 -13.269
  194   HG21  VAL  25          HG21      VAL  25  -8.627  -8.397 -12.292
  195   HG22  VAL  25          HG22      VAL  25  -7.335  -7.285 -12.745
  196   HG23  VAL  25          HG23      VAL  25  -7.809  -8.580 -13.843
  197    HA   PRO  26           HA       PRO  26  -4.448 -14.030 -11.964
  198    HB2  PRO  26           HB2      PRO  26  -2.626 -13.309 -14.169
  199    HB3  PRO  26           HB3      PRO  26  -3.446 -14.837 -13.841
  200    HG2  PRO  26           HG2      PRO  26  -4.210 -13.254 -15.862
  201    HG3  PRO  26           HG3      PRO  26  -5.387 -14.179 -14.911
  202    HD2  PRO  26           HD2      PRO  26  -4.678 -11.275 -14.743
  203    HD3  PRO  26           HD3      PRO  26  -6.274 -12.051 -14.660
  204    H    GLY  27           HN       GLY  27  -3.448 -10.758 -12.385
  205    HA2  GLY  27           HA1      GLY  27  -0.810 -11.179 -11.245
  206    HA3  GLY  27           HA2      GLY  27  -1.493  -9.644 -11.757
  207    H    VAL  28           HN       VAL  28  -3.821 -11.045  -9.925
  208    HA   VAL  28           HA       VAL  28  -3.059  -9.394  -7.643
  209    HB   VAL  28           HB       VAL  28  -5.693 -10.641  -8.426
  210   HG11  VAL  28          HG11      VAL  28  -6.505 -10.391  -6.369
  211   HG12  VAL  28          HG12      VAL  28  -4.858 -10.097  -5.813
  212   HG13  VAL  28          HG13      VAL  28  -5.890  -8.742  -6.269
  213   HG21  VAL  28          HG21      VAL  28  -4.467  -8.277  -9.191
  214   HG22  VAL  28          HG22      VAL  28  -6.175  -8.681  -9.363
  215   HG23  VAL  28          HG23      VAL  28  -5.619  -7.786  -7.949
  216    H    GLN  29           HN       GLN  29  -2.300 -10.209  -5.843
  217    HA   GLN  29           HA       GLN  29  -2.214 -13.076  -5.410
  218    HB2  GLN  29           HB2      GLN  29  -0.577 -10.918  -4.732
  219    HB3  GLN  29           HB3      GLN  29  -1.286 -11.423  -3.204
  220    HG2  GLN  29           HG2      GLN  29  -0.536 -13.761  -3.772
  221    HG3  GLN  29           HG3      GLN  29   0.384 -13.047  -5.096
  222   HE21  GLN  29          HE21      GLN  29   0.873 -14.307  -2.255
  223   HE22  GLN  29          HE22      GLN  29   2.122 -13.287  -1.623
  224    H    SER  30           HN       SER  30  -3.502 -10.197  -3.802
  225    HA   SER  30           HA       SER  30  -5.736 -11.707  -2.752
  226    HB2  SER  30           HB2      SER  30  -3.555 -10.604  -1.006
  227    HB3  SER  30           HB3      SER  30  -5.216 -10.632  -0.414
  228    HG   SER  30           HG       SER  30  -3.531 -12.789  -1.126
  229    H    ALA  31           HN       ALA  31  -7.480 -10.336  -2.133
  230    HA   ALA  31           HA       ALA  31  -7.053  -7.461  -2.566
  231    HB1  ALA  31           HB1      ALA  31  -9.599  -8.234  -3.643
  232    HB2  ALA  31           HB2      ALA  31  -8.264  -7.392  -4.431
  233    HB3  ALA  31           HB3      ALA  31  -8.310  -9.156  -4.419
  234    H    LEU  32           HN       LEU  32  -7.445  -6.781  -0.516
  235    HA   LEU  32           HA       LEU  32  -9.884  -7.761   0.803
  236    HB2  LEU  32           HB2      LEU  32  -7.819  -6.118   2.209
  237    HB3  LEU  32           HB3      LEU  32  -8.912  -7.323   2.862
  238    HG   LEU  32           HG       LEU  32  -6.810  -8.258   0.976
  239   HD11  LEU  32          HD11      LEU  32  -6.187  -6.714   3.287
  240   HD12  LEU  32          HD12      LEU  32  -5.726  -8.391   3.580
  241   HD13  LEU  32          HD13      LEU  32  -5.094  -7.536   2.173
  242   HD21  LEU  32          HD21      LEU  32  -6.836 -10.193   2.477
  243   HD22  LEU  32          HD22      LEU  32  -7.993  -9.366   3.520
  244   HD23  LEU  32          HD23      LEU  32  -8.451  -9.816   1.876
  245    H    VAL  33           HN       VAL  33 -11.367  -6.450  -0.230
  246    HA   VAL  33           HA       VAL  33 -10.980  -3.594  -0.364
  247    HB   VAL  33           HB       VAL  33 -13.594  -4.961  -0.902
  248   HG11  VAL  33          HG11      VAL  33 -13.709  -2.598  -1.026
  249   HG12  VAL  33          HG12      VAL  33 -12.216  -2.508  -1.962
  250   HG13  VAL  33          HG13      VAL  33 -13.673  -3.187  -2.690
  251   HG21  VAL  33          HG21      VAL  33 -12.764  -5.195  -3.291
  252   HG22  VAL  33          HG22      VAL  33 -11.138  -4.996  -2.635
  253   HG23  VAL  33          HG23      VAL  33 -12.137  -6.357  -2.120
  254    H    SER  34           HN       SER  34 -11.520  -2.194   1.164
  255    HA   SER  34           HA       SER  34 -13.106  -3.095   3.441
  256    HB2  SER  34           HB2      SER  34 -11.863  -0.382   3.310
  257    HB3  SER  34           HB3      SER  34 -12.025  -1.476   4.684
  258    HG   SER  34           HG       SER  34 -10.432  -2.823   3.627
  259    H    TYR  35           HN       TYR  35 -15.230  -2.860   3.206
  260    HA   TYR  35           HA       TYR  35 -16.431  -1.218   1.294
  261    HB2  TYR  35           HB2      TYR  35 -18.362  -1.739   3.307
  262    HB3  TYR  35           HB3      TYR  35 -18.191  -2.491   1.732
  263    HD1  TYR  35           HD2      TYR  35 -16.667  -4.563   1.567
  264    HD2  TYR  35           HD1      TYR  35 -18.027  -2.947   5.260
  265    HE1  TYR  35           HE2      TYR  35 -16.215  -6.717   2.674
  266    HE2  TYR  35           HE1      TYR  35 -17.586  -5.089   6.371
  267    HH   TYR  35           HH       TYR  35 -17.448  -7.764   5.206
  268    HA   PRO  36           HA       PRO  36 -17.780   1.846   4.674
  269    HB2  PRO  36           HB2      PRO  36 -16.743   1.778   7.151
  270    HB3  PRO  36           HB3      PRO  36 -18.102   0.753   6.675
  271    HG2  PRO  36           HG2      PRO  36 -15.206   0.060   6.932
  272    HG3  PRO  36           HG3      PRO  36 -16.632  -0.876   7.417
  273    HD2  PRO  36           HD2      PRO  36 -15.224  -1.315   5.107
  274    HD3  PRO  36           HD3      PRO  36 -16.935  -1.729   5.321
  275    H    LYS  37           HN       LYS  37 -14.667   1.097   3.840
  276    HA   LYS  37           HA       LYS  37 -13.639   3.725   4.650
  277    HB2  LYS  37           HB2      LYS  37 -12.468   1.234   4.826
  278    HB3  LYS  37           HB3      LYS  37 -11.752   1.895   3.364
  279    HG2  LYS  37           HG2      LYS  37 -11.033   3.870   4.615
  280    HG3  LYS  37           HG3      LYS  37 -11.735   3.186   6.083
  281    HD2  LYS  37           HD2      LYS  37 -10.229   1.246   5.862
  282    HD3  LYS  37           HD3      LYS  37  -9.498   2.001   4.444
  283    HE2  LYS  37           HE2      LYS  37  -8.849   3.924   5.848
  284    HE3  LYS  37           HE3      LYS  37  -9.513   3.094   7.255
  285    HZ1  LYS  37           HZ1      LYS  37  -7.158   2.750   7.172
  286    HZ2  LYS  37           HZ2      LYS  37  -7.239   2.196   5.572
  287    HZ3  LYS  37           HZ3      LYS  37  -7.922   1.275   6.822
  288    H    GLY  38           HN       GLY  38 -14.771   1.883   2.012
  289    HA2  GLY  38           HA1      GLY  38 -15.062   2.398  -0.206
  290    HA3  GLY  38           HA2      GLY  38 -14.578   4.044   0.182
  291    H    THR  39           HN       THR  39 -12.558   1.269   0.853
  292    HA   THR  39           HA       THR  39 -10.807   2.030  -1.383
  293    HB   THR  39           HB       THR  39  -9.005   1.390   0.586
  294    HG1  THR  39           HG1      THR  39 -10.884   3.148   1.790
  295   HG21  THR  39          HG21      THR  39  -8.278   3.603   0.416
  296   HG22  THR  39          HG22      THR  39  -9.913   4.225   0.195
  297   HG23  THR  39          HG23      THR  39  -9.124   3.335  -1.107
  298    H    ALA  40           HN       ALA  40  -9.277   0.394  -1.991
  299    HA   ALA  40           HA       ALA  40 -10.021  -2.306  -1.068
  300    HB1  ALA  40           HB1      ALA  40  -9.247  -3.046  -3.360
  301    HB2  ALA  40           HB2      ALA  40 -10.748  -2.123  -3.317
  302    HB3  ALA  40           HB3      ALA  40  -9.248  -1.343  -3.814
  303    H    GLN  41           HN       GLN  41  -8.448  -3.168   0.112
  304    HA   GLN  41           HA       GLN  41  -5.693  -2.264  -0.322
  305    HB2  GLN  41           HB2      GLN  41  -6.845  -2.314   1.991
  306    HB3  GLN  41           HB3      GLN  41  -6.623  -4.057   1.911
  307    HG2  GLN  41           HG2      GLN  41  -4.179  -3.636   1.569
  308    HG3  GLN  41           HG3      GLN  41  -4.495  -1.936   1.912
  309   HE21  GLN  41          HE21      GLN  41  -5.108  -5.146   3.266
  310   HE22  GLN  41          HE22      GLN  41  -4.848  -4.695   4.918
  311    H    LEU  42           HN       LEU  42  -5.004  -3.420  -2.070
  312    HA   LEU  42           HA       LEU  42  -5.263  -6.340  -1.868
  313    HB2  LEU  42           HB2      LEU  42  -5.617  -6.526  -4.159
  314    HB3  LEU  42           HB3      LEU  42  -6.596  -5.154  -3.684
  315    HG   LEU  42           HG       LEU  42  -3.867  -4.525  -4.640
  316   HD11  LEU  42          HD11      LEU  42  -4.006  -5.635  -6.552
  317   HD12  LEU  42          HD12      LEU  42  -5.615  -6.228  -6.147
  318   HD13  LEU  42          HD13      LEU  42  -5.426  -4.675  -6.960
  319   HD21  LEU  42          HD21      LEU  42  -4.990  -2.648  -5.625
  320   HD22  LEU  42          HD22      LEU  42  -6.569  -3.373  -5.316
  321   HD23  LEU  42          HD23      LEU  42  -5.565  -2.836  -3.968
  322    H    ALA  43           HN       ALA  43  -3.613  -7.570  -2.935
  323    HA   ALA  43           HA       ALA  43  -1.014  -6.191  -3.047
  324    HB1  ALA  43           HB1      ALA  43  -1.646  -8.941  -1.977
  325    HB2  ALA  43           HB2      ALA  43  -0.013  -8.343  -2.268
  326    HB3  ALA  43           HB3      ALA  43  -1.039  -7.558  -1.067
  327    H    ILE  44           HN       ILE  44  -0.087  -6.315  -4.993
  328    HA   ILE  44           HA       ILE  44  -1.054  -8.387  -6.848
  329    HB   ILE  44           HB       ILE  44  -0.100  -6.686  -8.603
  330   HG12  ILE  44          HG12      ILE  44  -1.114  -4.483  -7.026
  331   HG13  ILE  44          HG13      ILE  44   0.277  -5.220  -6.240
  332   HG21  ILE  44          HG21      ILE  44  -2.711  -6.029  -7.267
  333   HG22  ILE  44          HG22      ILE  44  -2.285  -5.865  -8.969
  334   HG23  ILE  44          HG23      ILE  44  -2.471  -7.467  -8.258
  335   HD11  ILE  44          HD11      ILE  44   0.195  -3.449  -8.472
  336   HD12  ILE  44          HD12      ILE  44   1.592  -4.073  -7.593
  337   HD13  ILE  44          HD13      ILE  44   0.935  -4.974  -8.959
  338    H    VAL  45           HN       VAL  45   0.425  -9.320  -8.284
  339    HA   VAL  45           HA       VAL  45   3.055  -9.726  -7.230
  340    HB   VAL  45           HB       VAL  45   2.013 -10.552  -9.950
  341   HG11  VAL  45          HG11      VAL  45   4.543 -10.698  -9.126
  342   HG12  VAL  45          HG12      VAL  45   3.940 -12.192  -8.406
  343   HG13  VAL  45          HG13      VAL  45   3.805 -11.934 -10.147
  344   HG21  VAL  45          HG21      VAL  45   1.870 -12.778  -8.339
  345   HG22  VAL  45          HG22      VAL  45   1.287 -11.488  -7.285
  346   HG23  VAL  45          HG23      VAL  45   0.506 -11.779  -8.840
  347    HA   PRO  46           HA       PRO  46   5.232  -6.266  -9.062
  348    HB2  PRO  46           HB2      PRO  46   7.298  -8.405  -9.382
  349    HB3  PRO  46           HB3      PRO  46   7.473  -6.759  -8.762
  350    HG2  PRO  46           HG2      PRO  46   7.382  -8.824  -7.090
  351    HG3  PRO  46           HG3      PRO  46   6.565  -7.300  -6.695
  352    HD2  PRO  46           HD2      PRO  46   5.409  -9.897  -7.571
  353    HD3  PRO  46           HD3      PRO  46   4.722  -8.654  -6.508
  354    H    GLY  47           HN       GLY  47   4.463  -5.748 -11.010
  355    HA2  GLY  47           HA1      GLY  47   5.270  -6.082 -13.443
  356    HA3  GLY  47           HA2      GLY  47   4.637  -7.709 -13.201
  357    H    THR  48           HN       THR  48   2.500  -6.761 -11.469
  358    HA   THR  48           HA       THR  48   0.521  -6.081 -13.425
  359    HB   THR  48           HB       THR  48   0.025  -5.888 -10.477
  360    HG1  THR  48           HG1      THR  48   1.123  -7.791 -10.484
  361   HG21  THR  48          HG21      THR  48  -1.707  -7.460 -12.281
  362   HG22  THR  48          HG22      THR  48  -1.636  -5.727 -12.599
  363   HG23  THR  48          HG23      THR  48  -2.137  -6.311 -11.013
  364    H    SER  49           HN       SER  49  -0.983  -4.212 -13.086
  365    HA   SER  49           HA       SER  49   0.502  -1.894 -12.136
  366    HB2  SER  49           HB2      SER  49  -1.117  -1.791 -14.668
  367    HB3  SER  49           HB3      SER  49   0.137  -0.679 -14.120
  368    HG   SER  49           HG       SER  49   1.683  -2.288 -14.495
  369    HA   PRO  50           HA       PRO  50  -3.280  -1.221  -9.976
  370    HB2  PRO  50           HB2      PRO  50  -2.326   1.509  -9.486
  371    HB3  PRO  50           HB3      PRO  50  -2.620   0.204  -8.333
  372    HG2  PRO  50           HG2      PRO  50  -0.130   1.033  -8.950
  373    HG3  PRO  50           HG3      PRO  50  -0.496  -0.659  -8.566
  374    HD2  PRO  50           HD2      PRO  50  -0.077   0.629 -11.234
  375    HD3  PRO  50           HD3      PRO  50   0.492  -0.945 -10.641
  376    H    ASP  51           HN       ASP  51  -2.233   0.957 -12.511
  377    HA   ASP  51           HA       ASP  51  -4.716   2.392 -12.590
  378    HB2  ASP  51           HB2      ASP  51  -2.341   3.030 -13.581
  379    HB3  ASP  51           HB3      ASP  51  -2.946   2.174 -14.995
  380    H    ALA  52           HN       ALA  52  -3.561  -0.623 -13.618
  381    HA   ALA  52           HA       ALA  52  -5.434  -0.983 -15.772
  382    HB1  ALA  52           HB1      ALA  52  -3.182  -2.137 -15.585
  383    HB2  ALA  52           HB2      ALA  52  -3.930  -3.171 -14.368
  384    HB3  ALA  52           HB3      ALA  52  -4.554  -3.158 -16.017
  385    H    LEU  53           HN       LEU  53  -5.155  -1.908 -12.403
  386    HA   LEU  53           HA       LEU  53  -7.536  -3.448 -12.273
  387    HB2  LEU  53           HB2      LEU  53  -6.388  -1.881  -9.975
  388    HB3  LEU  53           HB3      LEU  53  -7.262  -3.399  -9.927
  389    HG   LEU  53           HG       LEU  53  -4.610  -3.280 -11.306
  390   HD11  LEU  53          HD11      LEU  53  -3.597  -3.956  -9.102
  391   HD12  LEU  53          HD12      LEU  53  -4.050  -2.259  -9.251
  392   HD13  LEU  53          HD13      LEU  53  -5.074  -3.368  -8.337
  393   HD21  LEU  53          HD21      LEU  53  -4.668  -5.534 -11.172
  394   HD22  LEU  53          HD22      LEU  53  -5.454  -5.530  -9.594
  395   HD23  LEU  53          HD23      LEU  53  -6.405  -5.259 -11.052
  396    H    THR  54           HN       THR  54  -6.717  -0.093 -11.668
  397    HA   THR  54           HA       THR  54  -9.181   0.944 -10.956
  398    HB   THR  54           HB       THR  54  -6.964   2.166 -12.619
  399    HG1  THR  54           HG1      THR  54  -6.257   1.752 -10.557
  400   HG21  THR  54          HG21      THR  54  -9.424   3.193 -12.628
  401   HG22  THR  54          HG22      THR  54  -7.978   4.202 -12.612
  402   HG23  THR  54          HG23      THR  54  -8.850   3.887 -11.111
  403    H    ALA  55           HN       ALA  55  -7.778   0.574 -14.209
  404    HA   ALA  55           HA       ALA  55 -10.074   1.492 -15.585
  405    HB1  ALA  55           HB1      ALA  55  -8.210  -0.431 -16.889
  406    HB2  ALA  55           HB2      ALA  55  -8.928   1.051 -17.520
  407    HB3  ALA  55           HB3      ALA  55  -7.583   1.137 -16.380
  408    H    ALA  56           HN       ALA  56  -9.067  -1.662 -14.447
  409    HA   ALA  56           HA       ALA  56 -10.979  -3.184 -15.841
  410    HB1  ALA  56           HB1      ALA  56 -10.172  -4.951 -14.691
  411    HB2  ALA  56           HB2      ALA  56  -8.902  -3.808 -14.251
  412    HB3  ALA  56           HB3      ALA  56 -10.240  -4.110 -13.141
  413    H    VAL  57           HN       VAL  57 -11.094  -1.692 -12.598
  414    HA   VAL  57           HA       VAL  57 -13.765  -2.609 -12.142
  415    HB   VAL  57           HB       VAL  57 -12.338  -0.384 -10.710
  416   HG11  VAL  57          HG11      VAL  57 -14.190  -1.970  -9.157
  417   HG12  VAL  57          HG12      VAL  57 -14.115  -0.222  -9.377
  418   HG13  VAL  57          HG13      VAL  57 -14.984  -1.221 -10.542
  419   HG21  VAL  57          HG21      VAL  57 -11.145  -2.616 -10.755
  420   HG22  VAL  57          HG22      VAL  57 -11.511  -1.956  -9.161
  421   HG23  VAL  57          HG23      VAL  57 -12.505  -3.250  -9.828
  422    H    ALA  58           HN       ALA  58 -12.331   0.444 -13.264
  423    HA   ALA  58           HA       ALA  58 -14.742   1.894 -13.426
  424    HB1  ALA  58           HB1      ALA  58 -13.280   3.494 -13.904
  425    HB2  ALA  58           HB2      ALA  58 -12.012   2.295 -14.161
  426    HB3  ALA  58           HB3      ALA  58 -13.052   2.779 -15.501
  427    H    GLY  59           HN       GLY  59 -13.185  -0.363 -15.599
  428    HA2  GLY  59           HA1      GLY  59 -14.911   0.140 -17.820
  429    HA3  GLY  59           HA2      GLY  59 -13.840  -1.239 -17.623
  430    H    LEU  60           HN       LEU  60 -15.338  -1.546 -14.895
  431    HA   LEU  60           HA       LEU  60 -17.283  -3.396 -15.967
  432    HB2  LEU  60           HB2      LEU  60 -15.823  -3.063 -13.486
  433    HB3  LEU  60           HB3      LEU  60 -17.503  -3.467 -13.212
  434    HG   LEU  60           HG       LEU  60 -15.341  -5.192 -13.877
  435   HD11  LEU  60          HD11      LEU  60 -17.460  -6.815 -13.791
  436   HD12  LEU  60          HD12      LEU  60 -16.742  -6.096 -12.351
  437   HD13  LEU  60          HD13      LEU  60 -18.178  -5.375 -13.074
  438   HD21  LEU  60          HD21      LEU  60 -16.215  -6.405 -15.772
  439   HD22  LEU  60          HD22      LEU  60 -17.569  -5.281 -15.908
  440   HD23  LEU  60          HD23      LEU  60 -15.926  -4.727 -16.231
  441    H    GLY  61           HN       GLY  61 -17.469  -0.303 -15.705
  442    HA2  GLY  61           HA1      GLY  61 -19.439   0.959 -15.909
  443    HA3  GLY  61           HA2      GLY  61 -20.322  -0.336 -15.117
  444    H    TYR  62           HN       TYR  62 -17.694   0.045 -13.261
  445    HA   TYR  62           HA       TYR  62 -19.122   1.853 -11.446
  446    HB2  TYR  62           HB2      TYR  62 -16.905  -0.067 -10.725
  447    HB3  TYR  62           HB3      TYR  62 -18.042   0.725  -9.641
  448    HD1  TYR  62           HD2      TYR  62 -20.632   0.248 -10.639
  449    HD2  TYR  62           HD1      TYR  62 -17.265  -2.347 -10.810
  450    HE1  TYR  62           HE2      TYR  62 -22.142  -1.683 -10.814
  451    HE2  TYR  62           HE1      TYR  62 -18.766  -4.289 -10.989
  452    HH   TYR  62           HH       TYR  62 -21.976  -4.223 -10.250
  453    H    LYS  63           HN       LYS  63 -17.156   2.684  -9.758
  454    HA   LYS  63           HA       LYS  63 -15.304   4.078 -11.574
  455    HB2  LYS  63           HB2      LYS  63 -17.331   5.166  -9.873
  456    HB3  LYS  63           HB3      LYS  63 -15.760   5.672  -9.269
  457    HG2  LYS  63           HG2      LYS  63 -15.910   7.317 -10.754
  458    HG3  LYS  63           HG3      LYS  63 -15.522   6.090 -11.963
  459    HD2  LYS  63           HD2      LYS  63 -18.362   6.342 -11.151
  460    HD3  LYS  63           HD3      LYS  63 -17.686   7.645 -12.132
  461    HE2  LYS  63           HE2      LYS  63 -16.902   5.091 -13.192
  462    HE3  LYS  63           HE3      LYS  63 -18.654   5.159 -13.006
  463    HZ1  LYS  63           HZ1      LYS  63 -18.851   6.806 -14.536
  464    HZ2  LYS  63           HZ2      LYS  63 -17.458   6.054 -15.151
  465    HZ3  LYS  63           HZ3      LYS  63 -17.317   7.464 -14.219
  466    H    ALA  64           HN       ALA  64 -13.321   3.305 -11.178
  467    HA   ALA  64           HA       ALA  64 -12.554   3.048  -8.347
  468    HB1  ALA  64           HB1      ALA  64 -10.710   1.521  -9.587
  469    HB2  ALA  64           HB2      ALA  64 -12.210   0.900  -8.901
  470    HB3  ALA  64           HB3      ALA  64 -12.107   1.250 -10.627
  471    H    THR  65           HN       THR  65 -10.391   3.525  -7.828
  472    HA   THR  65           HA       THR  65  -8.619   4.586  -9.819
  473    HB   THR  65           HB       THR  65  -9.903   6.624  -9.242
  474    HG1  THR  65           HG1      THR  65  -7.986   7.384  -9.715
  475   HG21  THR  65          HG21      THR  65 -10.667   6.729  -7.130
  476   HG22  THR  65          HG22      THR  65  -9.093   7.444  -6.779
  477   HG23  THR  65          HG23      THR  65  -9.361   5.722  -6.503
  478    H    LEU  66           HN       LEU  66  -6.872   5.790  -7.820
  479    HA   LEU  66           HA       LEU  66  -6.377   3.627  -5.956
  480    HB2  LEU  66           HB2      LEU  66  -4.271   2.950  -6.781
  481    HB3  LEU  66           HB3      LEU  66  -5.372   2.902  -8.144
  482    HG   LEU  66           HG       LEU  66  -4.103   5.469  -8.074
  483   HD11  LEU  66          HD11      LEU  66  -2.402   4.040  -6.780
  484   HD12  LEU  66          HD12      LEU  66  -2.097   3.258  -8.331
  485   HD13  LEU  66          HD13      LEU  66  -1.827   4.991  -8.149
  486   HD21  LEU  66          HD21      LEU  66  -4.884   3.488  -9.912
  487   HD22  LEU  66          HD22      LEU  66  -4.287   5.111 -10.256
  488   HD23  LEU  66          HD23      LEU  66  -3.158   3.758 -10.166
  489    H    ALA  67           HN       ALA  67  -5.168   4.186  -4.259
  490    HA   ALA  67           HA       ALA  67  -3.584   6.597  -4.221
  491    HB1  ALA  67           HB1      ALA  67  -5.180   7.972  -3.487
  492    HB2  ALA  67           HB2      ALA  67  -6.333   6.646  -3.319
  493    HB3  ALA  67           HB3      ALA  67  -5.219   7.020  -2.001
  494    H    ASP  68           HN       ASP  68  -1.861   5.442  -3.506
  495    HA   ASP  68           HA       ASP  68  -2.071   3.430  -1.532
  496    HB2  ASP  68           HB2      ASP  68  -0.246   3.809  -3.400
  497    HB3  ASP  68           HB3      ASP  68   0.552   4.724  -2.123
  498    H    ALA  69           HN       ALA  69  -2.964   4.264   0.303
  499    HA   ALA  69           HA       ALA  69  -1.259   6.099   1.835
  500    HB1  ALA  69           HB1      ALA  69  -3.196   7.256   2.693
  501    HB2  ALA  69           HB2      ALA  69  -3.233   7.305   0.930
  502    HB3  ALA  69           HB3      ALA  69  -4.276   6.181   1.805
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1   2.725  -0.773  -0.400
    2    H2   MET   1           H2       MET   1   2.818  -1.842  -1.714
    3    H3   MET   1           H3       MET   1   1.374  -1.691  -0.847
    4    HA   MET   1           HA       MET   1   1.571   0.793  -1.525
    5    HB2  MET   1           HB2      MET   1   2.622   1.147  -3.636
    6    HB3  MET   1           HB3      MET   1   3.800   0.330  -2.621
    7    HG2  MET   1           HG2      MET   1   3.576  -1.685  -3.785
    8    HG3  MET   1           HG3      MET   1   2.058  -1.189  -4.528
    9    HE1  MET   1           HE1      MET   1   2.977  -2.321  -6.357
   10    HE2  MET   1           HE2      MET   1   3.191  -1.206  -7.708
   11    HE3  MET   1           HE3      MET   1   4.578  -2.075  -7.053
   12    H    THR   2           HN       THR   2   0.348   1.324  -3.676
   13    HA   THR   2           HA       THR   2  -1.362   1.004  -5.122
   14    HB   THR   2           HB       THR   2  -1.189  -1.970  -4.654
   15    HG1  THR   2           HG1      THR   2   0.565  -0.226  -5.926
   16   HG21  THR   2          HG21      THR   2  -2.918  -1.878  -6.092
   17   HG22  THR   2          HG22      THR   2  -1.693  -1.523  -7.312
   18   HG23  THR   2          HG23      THR   2  -2.578  -0.207  -6.537
   19    H    HIS   3           HN       HIS   3  -2.720   2.064  -3.595
   20    HA   HIS   3           HA       HIS   3  -4.764   0.239  -2.514
   21    HB2  HIS   3           HB2      HIS   3  -4.070   3.032  -1.603
   22    HB3  HIS   3           HB3      HIS   3  -5.453   2.129  -1.038
   23    HD1  HIS   3           HD1      HIS   3  -4.087   2.769   1.296
   24    HD2  HIS   3           HD2      HIS   3  -2.541  -0.255  -1.114
   25    HE1  HIS   3           HE1      HIS   3  -2.526   1.452   2.768
   26    HE2  HIS   3           HE2      HIS   3  -1.441  -0.222   1.226
   27    H    LEU   4           HN       LEU   4  -6.805   0.528  -3.229
   28    HA   LEU   4           HA       LEU   4  -7.169   2.575  -5.313
   29    HB2  LEU   4           HB2      LEU   4  -7.582  -0.243  -5.351
   30    HB3  LEU   4           HB3      LEU   4  -9.138   0.536  -5.531
   31    HG   LEU   4           HG       LEU   4  -7.939   1.935  -7.373
   32   HD11  LEU   4          HD11      LEU   4  -6.312  -0.385  -8.020
   33   HD12  LEU   4          HD12      LEU   4  -5.905   1.331  -8.059
   34   HD13  LEU   4          HD13      LEU   4  -5.784   0.429  -6.547
   35   HD21  LEU   4          HD21      LEU   4  -9.762   0.341  -7.746
   36   HD22  LEU   4          HD22      LEU   4  -8.559   0.273  -9.035
   37   HD23  LEU   4          HD23      LEU   4  -8.591  -0.978  -7.793
   38    H    LYS   5           HN       LYS   5  -9.131   3.663  -5.423
   39    HA   LYS   5           HA       LYS   5 -10.689   3.582  -2.923
   40    HB2  LYS   5           HB2      LYS   5  -9.598   5.703  -3.157
   41    HB3  LYS   5           HB3      LYS   5 -10.128   5.857  -4.825
   42    HG2  LYS   5           HG2      LYS   5 -11.708   7.181  -3.935
   43    HG3  LYS   5           HG3      LYS   5 -12.515   5.654  -3.578
   44    HD2  LYS   5           HD2      LYS   5 -12.576   6.835  -1.556
   45    HD3  LYS   5           HD3      LYS   5 -11.236   5.702  -1.366
   46    HE2  LYS   5           HE2      LYS   5 -10.603   7.888  -0.538
   47    HE3  LYS   5           HE3      LYS   5  -9.663   7.485  -1.973
   48    HZ1  LYS   5           HZ1      LYS   5 -12.016   8.867  -2.722
   49    HZ2  LYS   5           HZ2      LYS   5 -10.396   9.305  -2.970
   50    HZ3  LYS   5           HZ3      LYS   5 -11.186   9.760  -1.542
   51    H    ILE   6           HN       ILE   6 -12.829   3.211  -3.003
   52    HA   ILE   6           HA       ILE   6 -13.953   2.434  -5.565
   53    HB   ILE   6           HB       ILE   6 -14.613   1.961  -2.717
   54   HG12  ILE   6          HG12      ILE   6 -15.266  -0.268  -3.677
   55   HG13  ILE   6          HG13      ILE   6 -14.829   0.350  -5.266
   56   HG21  ILE   6          HG21      ILE   6 -16.666   3.100  -3.480
   57   HG22  ILE   6          HG22      ILE   6 -16.817   1.913  -4.776
   58   HG23  ILE   6          HG23      ILE   6 -16.937   1.399  -3.093
   59   HD11  ILE   6          HD11      ILE   6 -12.576   0.878  -3.856
   60   HD12  ILE   6          HD12      ILE   6 -13.138  -0.600  -3.078
   61   HD13  ILE   6          HD13      ILE   6 -12.846  -0.575  -4.817
   62    H    THR   7           HN       THR   7 -15.277   3.673  -6.773
   63    HA   THR   7           HA       THR   7 -16.630   5.930  -5.462
   64    HB   THR   7           HB       THR   7 -15.984   6.638  -8.167
   65    HG1  THR   7           HG1      THR   7 -13.980   5.363  -6.767
   66   HG21  THR   7          HG21      THR   7 -14.923   8.575  -7.043
   67   HG22  THR   7          HG22      THR   7 -15.135   7.761  -5.495
   68   HG23  THR   7          HG23      THR   7 -16.545   8.245  -6.437
   69    H    GLY   8           HN       GLY   8 -18.643   6.497  -6.337
   70    HA2  GLY   8           HA1      GLY   8 -20.417   6.422  -7.856
   71    HA3  GLY   8           HA2      GLY   8 -19.574   5.172  -8.757
   72    H    MET   9           HN       MET   9 -19.106   3.457  -6.510
   73    HA   MET   9           HA       MET   9 -21.665   2.132  -6.510
   74    HB2  MET   9           HB2      MET   9 -19.245   1.180  -5.014
   75    HB3  MET   9           HB3      MET   9 -20.558   0.244  -5.701
   76    HG2  MET   9           HG2      MET   9 -19.795   0.593  -7.890
   77    HG3  MET   9           HG3      MET   9 -18.637   1.816  -7.371
   78    HE1  MET   9           HE1      MET   9 -16.166   1.255  -6.534
   79    HE2  MET   9           HE2      MET   9 -15.547  -0.139  -7.424
   80    HE3  MET   9           HE3      MET   9 -16.537   1.065  -8.249
   81    H    THR  10           HN       THR  10 -22.507   1.168  -4.452
   82    HA   THR  10           HA       THR  10 -22.669   3.315  -2.479
   83    HB   THR  10           HB       THR  10 -24.445   1.052  -2.051
   84    HG1  THR  10           HG1      THR  10 -24.556   2.407  -4.571
   85   HG21  THR  10          HG21      THR  10 -24.804   3.284  -1.120
   86   HG22  THR  10          HG22      THR  10 -26.148   2.816  -2.163
   87   HG23  THR  10          HG23      THR  10 -24.931   3.952  -2.746
   88    H    CYS  11           HN       CYS  11 -20.463   1.299  -2.673
   89    HA   CYS  11           HA       CYS  11 -19.279  -0.272  -1.571
   90    HB2  CYS  11           HB2      CYS  11 -18.626   0.299   0.553
   91    HB3  CYS  11           HB3      CYS  11 -19.248   1.811  -0.079
   92    HG   CYS  11           HG       CYS  11 -21.855   0.758   1.235
   93    H    ASP  12           HN       ASP  12 -19.215  -2.177  -0.301
   94    HA   ASP  12           HA       ASP  12 -19.973  -4.255   0.165
   95    HB2  ASP  12           HB2      ASP  12 -21.255  -2.922   1.967
   96    HB3  ASP  12           HB3      ASP  12 -22.664  -3.149   0.931
   97    H    SER  13           HN       SER  13 -20.918  -5.936  -0.933
   98    HA   SER  13           HA       SER  13 -21.738  -7.017  -2.750
   99    HB2  SER  13           HB2      SER  13 -23.659  -4.768  -3.306
  100    HB3  SER  13           HB3      SER  13 -23.879  -6.504  -3.543
  101    HG   SER  13           HG       SER  13 -24.550  -5.030  -1.432
  102    H    CYS  14           HN       CYS  14 -21.796  -3.542  -3.529
  103    HA   CYS  14           HA       CYS  14 -20.798  -3.691  -6.132
  104    HB2  CYS  14           HB2      CYS  14 -20.356  -1.562  -4.025
  105    HB3  CYS  14           HB3      CYS  14 -20.119  -1.327  -5.753
  106    HG   CYS  14           HG       CYS  14 -23.008  -2.172  -6.031
  107    H    ALA  15           HN       ALA  15 -19.168  -3.374  -3.027
  108    HA   ALA  15           HA       ALA  15 -16.525  -3.376  -4.078
  109    HB1  ALA  15           HB1      ALA  15 -17.777  -3.310  -1.444
  110    HB2  ALA  15           HB2      ALA  15 -16.268  -4.221  -1.479
  111    HB3  ALA  15           HB3      ALA  15 -16.296  -2.541  -2.014
  112    H    ALA  16           HN       ALA  16 -18.830  -5.828  -3.325
  113    HA   ALA  16           HA       ALA  16 -16.958  -7.979  -3.013
  114    HB1  ALA  16           HB1      ALA  16 -19.633  -7.668  -2.474
  115    HB2  ALA  16           HB2      ALA  16 -19.644  -8.732  -3.880
  116    HB3  ALA  16           HB3      ALA  16 -18.751  -9.193  -2.431
  117    H    HIS  17           HN       HIS  17 -18.971  -6.708  -5.622
  118    HA   HIS  17           HA       HIS  17 -18.304  -8.541  -7.627
  119    HB2  HIS  17           HB2      HIS  17 -19.937  -6.404  -7.518
  120    HB3  HIS  17           HB3      HIS  17 -18.585  -5.677  -8.377
  121    HD1  HIS  17           HD1      HIS  17 -20.958  -5.704 -10.034
  122    HD2  HIS  17           HD2      HIS  17 -18.548  -9.083  -9.728
  123    HE1  HIS  17           HE1      HIS  17 -21.474  -7.099 -12.068
  124    HE2  HIS  17           HE2      HIS  17 -20.062  -9.173 -11.827
  125    H    VAL  18           HN       VAL  18 -16.818  -5.432  -6.787
  126    HA   VAL  18           HA       VAL  18 -14.701  -5.508  -8.613
  127    HB   VAL  18           HB       VAL  18 -14.805  -4.213  -5.878
  128   HG11  VAL  18          HG11      VAL  18 -12.502  -4.486  -6.726
  129   HG12  VAL  18          HG12      VAL  18 -12.959  -3.606  -8.185
  130   HG13  VAL  18          HG13      VAL  18 -12.996  -2.795  -6.619
  131   HG21  VAL  18          HG21      VAL  18 -15.758  -2.368  -6.834
  132   HG22  VAL  18          HG22      VAL  18 -15.091  -2.711  -8.431
  133   HG23  VAL  18          HG23      VAL  18 -16.472  -3.631  -7.835
  134    H    LYS  19           HN       LYS  19 -14.912  -6.666  -5.265
  135    HA   LYS  19           HA       LYS  19 -12.256  -7.488  -4.980
  136    HB2  LYS  19           HB2      LYS  19 -14.012  -7.285  -3.169
  137    HB3  LYS  19           HB3      LYS  19 -14.641  -8.834  -3.715
  138    HG2  LYS  19           HG2      LYS  19 -12.050  -9.474  -3.380
  139    HG3  LYS  19           HG3      LYS  19 -12.229  -8.214  -2.157
  140    HD2  LYS  19           HD2      LYS  19 -14.251  -9.429  -1.321
  141    HD3  LYS  19           HD3      LYS  19 -13.844 -10.742  -2.428
  142    HE2  LYS  19           HE2      LYS  19 -11.501 -10.086  -0.987
  143    HE3  LYS  19           HE3      LYS  19 -12.821 -10.211   0.178
  144    HZ1  LYS  19           HZ1      LYS  19 -11.677 -12.335  -0.224
  145    HZ2  LYS  19           HZ2      LYS  19 -12.161 -12.283  -1.853
  146    HZ3  LYS  19           HZ3      LYS  19 -13.326 -12.401  -0.621
  147    H    GLU  20           HN       GLU  20 -15.101  -9.271  -6.100
  148    HA   GLU  20           HA       GLU  20 -13.792 -11.733  -6.477
  149    HB2  GLU  20           HB2      GLU  20 -16.339 -11.113  -6.444
  150    HB3  GLU  20           HB3      GLU  20 -16.114 -10.896  -8.174
  151    HG2  GLU  20           HG2      GLU  20 -14.952 -13.333  -7.727
  152    HG3  GLU  20           HG3      GLU  20 -16.306 -13.336  -6.599
  153    H    ALA  21           HN       ALA  21 -14.364  -8.994  -8.616
  154    HA   ALA  21           HA       ALA  21 -13.344 -10.200 -10.962
  155    HB1  ALA  21           HB1      ALA  21 -13.576  -8.139 -11.960
  156    HB2  ALA  21           HB2      ALA  21 -14.706  -7.992 -10.613
  157    HB3  ALA  21           HB3      ALA  21 -13.104  -7.261 -10.504
  158    H    LEU  22           HN       LEU  22 -11.898  -8.416  -8.324
  159    HA   LEU  22           HA       LEU  22  -9.297  -8.197  -9.439
  160    HB2  LEU  22           HB2      LEU  22 -10.477  -7.891  -6.721
  161    HB3  LEU  22           HB3      LEU  22  -8.739  -8.064  -6.854
  162    HG   LEU  22           HG       LEU  22 -10.264  -5.967  -8.382
  163   HD11  LEU  22          HD11      LEU  22  -8.939  -4.677  -6.338
  164   HD12  LEU  22          HD12      LEU  22 -10.676  -4.964  -6.434
  165   HD13  LEU  22          HD13      LEU  22  -9.646  -6.085  -5.544
  166   HD21  LEU  22          HD21      LEU  22  -8.164  -6.174  -9.341
  167   HD22  LEU  22          HD22      LEU  22  -7.909  -4.903  -8.146
  168   HD23  LEU  22          HD23      LEU  22  -7.385  -6.552  -7.806
  169    H    GLU  23           HN       GLU  23 -10.789 -10.490  -7.192
  170    HA   GLU  23           HA       GLU  23  -8.410 -12.005  -6.805
  171    HB2  GLU  23           HB2      GLU  23 -11.305 -12.413  -6.139
  172    HB3  GLU  23           HB3      GLU  23 -10.162 -13.735  -5.940
  173    HG2  GLU  23           HG2      GLU  23  -8.778 -12.171  -4.535
  174    HG3  GLU  23           HG3      GLU  23 -10.150 -11.066  -4.572
  175    H    LYS  24           HN       LYS  24 -10.807 -11.951  -9.258
  176    HA   LYS  24           HA       LYS  24 -10.307 -14.598 -10.243
  177    HB2  LYS  24           HB2      LYS  24 -11.956 -12.301 -11.014
  178    HB3  LYS  24           HB3      LYS  24 -11.314 -13.202 -12.382
  179    HG2  LYS  24           HG2      LYS  24 -12.258 -15.265 -11.462
  180    HG3  LYS  24           HG3      LYS  24 -12.927 -14.346 -10.111
  181    HD2  LYS  24           HD2      LYS  24 -14.414 -13.176 -11.518
  182    HD3  LYS  24           HD3      LYS  24 -13.562 -13.689 -12.976
  183    HE2  LYS  24           HE2      LYS  24 -14.640 -15.658 -13.058
  184    HE3  LYS  24           HE3      LYS  24 -14.546 -15.888 -11.314
  185    HZ1  LYS  24           HZ1      LYS  24 -16.429 -13.956 -12.530
  186    HZ2  LYS  24           HZ2      LYS  24 -16.460 -14.620 -10.969
  187    HZ3  LYS  24           HZ3      LYS  24 -16.834 -15.588 -12.316
  188    H    VAL  25           HN       VAL  25  -8.580 -11.709 -10.314
  189    HA   VAL  25           HA       VAL  25  -7.210 -12.249 -12.814
  190    HB   VAL  25           HB       VAL  25  -7.215 -10.032 -10.828
  191   HG11  VAL  25          HG11      VAL  25  -4.960  -9.990 -10.719
  192   HG12  VAL  25          HG12      VAL  25  -4.764 -10.959 -12.180
  193   HG13  VAL  25          HG13      VAL  25  -5.108  -9.233 -12.306
  194   HG21  VAL  25          HG21      VAL  25  -7.135 -10.194 -13.835
  195   HG22  VAL  25          HG22      VAL  25  -8.537  -9.843 -12.825
  196   HG23  VAL  25          HG23      VAL  25  -7.203  -8.693 -12.913
  197    HA   PRO  26           HA       PRO  26  -4.430 -15.114 -10.876
  198    HB2  PRO  26           HB2      PRO  26  -2.763 -14.643 -13.266
  199    HB3  PRO  26           HB3      PRO  26  -3.483 -16.143 -12.674
  200    HG2  PRO  26           HG2      PRO  26  -4.439 -14.913 -14.849
  201    HG3  PRO  26           HG3      PRO  26  -5.519 -15.725 -13.697
  202    HD2  PRO  26           HD2      PRO  26  -4.924 -12.804 -14.006
  203    HD3  PRO  26           HD3      PRO  26  -6.478 -13.613 -13.714
  204    H    GLY  27           HN       GLY  27  -3.539 -11.941 -11.937
  205    HA2  GLY  27           HA1      GLY  27  -0.856 -12.048 -10.882
  206    HA3  GLY  27           HA2      GLY  27  -1.667 -10.630 -11.527
  207    H    VAL  28           HN       VAL  28  -3.853 -11.795  -9.437
  208    HA   VAL  28           HA       VAL  28  -3.052  -9.890  -7.405
  209    HB   VAL  28           HB       VAL  28  -5.527 -10.644  -8.405
  210   HG11  VAL  28          HG11      VAL  28  -5.269 -11.736  -5.610
  211   HG12  VAL  28          HG12      VAL  28  -6.794 -11.447  -6.444
  212   HG13  VAL  28          HG13      VAL  28  -5.660 -12.642  -7.072
  213   HG21  VAL  28          HG21      VAL  28  -5.075  -8.475  -7.559
  214   HG22  VAL  28          HG22      VAL  28  -6.402  -9.137  -6.606
  215   HG23  VAL  28          HG23      VAL  28  -4.771  -9.100  -5.938
  216    H    GLN  29           HN       GLN  29  -2.369 -10.352  -5.401
  217    HA   GLN  29           HA       GLN  29  -1.937 -13.175  -4.740
  218    HB2  GLN  29           HB2      GLN  29  -0.561 -10.650  -4.113
  219    HB3  GLN  29           HB3      GLN  29  -0.726 -11.736  -2.741
  220    HG2  GLN  29           HG2      GLN  29   1.395 -11.977  -4.022
  221    HG3  GLN  29           HG3      GLN  29   0.461 -13.462  -3.848
  222   HE21  GLN  29          HE21      GLN  29   0.856 -10.735  -6.079
  223   HE22  GLN  29          HE22      GLN  29   0.708 -11.673  -7.519
  224    H    SER  30           HN       SER  30  -3.248 -10.173  -3.420
  225    HA   SER  30           HA       SER  30  -5.354 -11.626  -2.088
  226    HB2  SER  30           HB2      SER  30  -3.424  -9.939  -0.465
  227    HB3  SER  30           HB3      SER  30  -4.911 -10.667   0.142
  228    HG   SER  30           HG       SER  30  -3.478 -12.578  -1.030
  229    H    ALA  31           HN       ALA  31  -7.185 -10.435  -2.141
  230    HA   ALA  31           HA       ALA  31  -6.901  -7.558  -2.759
  231    HB1  ALA  31           HB1      ALA  31  -8.569  -9.676  -3.947
  232    HB2  ALA  31           HB2      ALA  31  -9.378  -8.133  -3.666
  233    HB3  ALA  31           HB3      ALA  31  -7.924  -8.200  -4.662
  234    H    LEU  32           HN       LEU  32  -7.042  -6.814  -0.637
  235    HA   LEU  32           HA       LEU  32  -9.303  -7.694   0.977
  236    HB2  LEU  32           HB2      LEU  32  -7.133  -5.742   1.731
  237    HB3  LEU  32           HB3      LEU  32  -8.257  -6.544   2.812
  238    HG   LEU  32           HG       LEU  32  -6.558  -8.350   1.214
  239   HD11  LEU  32          HD11      LEU  32  -5.227  -6.200   2.134
  240   HD12  LEU  32          HD12      LEU  32  -5.182  -7.229   3.567
  241   HD13  LEU  32          HD13      LEU  32  -4.527  -7.817   2.039
  242   HD21  LEU  32          HD21      LEU  32  -7.294  -8.187   4.135
  243   HD22  LEU  32          HD22      LEU  32  -8.089  -9.180   2.912
  244   HD23  LEU  32          HD23      LEU  32  -6.417  -9.512   3.369
  245    H    VAL  33           HN       VAL  33 -10.547  -6.604  -0.860
  246    HA   VAL  33           HA       VAL  33 -10.792  -3.767  -0.842
  247    HB   VAL  33           HB       VAL  33 -12.972  -5.685  -1.640
  248   HG11  VAL  33          HG11      VAL  33 -13.296  -3.804  -3.375
  249   HG12  VAL  33          HG12      VAL  33 -13.828  -3.527  -1.717
  250   HG13  VAL  33          HG13      VAL  33 -12.307  -2.839  -2.282
  251   HG21  VAL  33          HG21      VAL  33 -11.090  -4.691  -3.696
  252   HG22  VAL  33          HG22      VAL  33 -10.507  -5.972  -2.633
  253   HG23  VAL  33          HG23      VAL  33 -11.961  -6.223  -3.600
  254    H    SER  34           HN       SER  34 -11.513  -2.628   0.795
  255    HA   SER  34           HA       SER  34 -13.250  -3.941   2.760
  256    HB2  SER  34           HB2      SER  34 -11.579  -1.466   3.200
  257    HB3  SER  34           HB3      SER  34 -12.323  -2.503   4.418
  258    HG   SER  34           HG       SER  34 -10.482  -3.619   2.609
  259    H    TYR  35           HN       TYR  35 -15.283  -3.519   2.269
  260    HA   TYR  35           HA       TYR  35 -16.178  -1.229   0.965
  261    HB2  TYR  35           HB2      TYR  35 -18.299  -2.120   1.101
  262    HB3  TYR  35           HB3      TYR  35 -17.260  -3.520   1.085
  263    HD1  TYR  35           HD1      TYR  35 -19.451  -1.431   3.189
  264    HD2  TYR  35           HD2      TYR  35 -17.256  -5.067   2.913
  265    HE1  TYR  35           HE1      TYR  35 -20.571  -2.254   5.214
  266    HE2  TYR  35           HE2      TYR  35 -18.379  -5.904   4.935
  267    HH   TYR  35           HH       TYR  35 -19.728  -4.231   7.109
  268    HA   PRO  36           HA       PRO  36 -17.572   0.511   5.238
  269    HB2  PRO  36           HB2      PRO  36 -16.122  -0.149   7.419
  270    HB3  PRO  36           HB3      PRO  36 -17.541  -1.073   6.910
  271    HG2  PRO  36           HG2      PRO  36 -14.639  -1.655   6.452
  272    HG3  PRO  36           HG3      PRO  36 -15.934  -2.760   6.949
  273    HD2  PRO  36           HD2      PRO  36 -15.039  -2.605   4.395
  274    HD3  PRO  36           HD3      PRO  36 -16.720  -3.004   4.801
  275    H    LYS  37           HN       LYS  37 -14.408  -0.009   4.100
  276    HA   LYS  37           HA       LYS  37 -13.369   2.430   5.329
  277    HB2  LYS  37           HB2      LYS  37 -12.182   0.006   4.806
  278    HB3  LYS  37           HB3      LYS  37 -11.651   0.976   3.440
  279    HG2  LYS  37           HG2      LYS  37 -10.797   2.670   5.024
  280    HG3  LYS  37           HG3      LYS  37 -11.241   1.599   6.357
  281    HD2  LYS  37           HD2      LYS  37  -9.804  -0.091   4.804
  282    HD3  LYS  37           HD3      LYS  37  -8.995   1.438   4.458
  283    HE2  LYS  37           HE2      LYS  37  -9.379   1.419   7.223
  284    HE3  LYS  37           HE3      LYS  37  -8.873  -0.220   6.815
  285    HZ1  LYS  37           HZ1      LYS  37  -6.799   0.487   6.558
  286    HZ2  LYS  37           HZ2      LYS  37  -7.273   2.034   7.062
  287    HZ3  LYS  37           HZ3      LYS  37  -7.284   1.645   5.415
  288    H    GLY  38           HN       GLY  38 -14.412   1.070   2.302
  289    HA2  GLY  38           HA1      GLY  38 -15.071   2.204   0.380
  290    HA3  GLY  38           HA2      GLY  38 -14.416   3.689   1.062
  291    H    THR  39           HN       THR  39 -12.333   1.011   1.244
  292    HA   THR  39           HA       THR  39 -10.884   1.910  -1.148
  293    HB   THR  39           HB       THR  39  -8.858   1.310   0.628
  294    HG1  THR  39           HG1      THR  39  -9.708   1.575   2.549
  295   HG21  THR  39          HG21      THR  39  -8.861   3.147  -0.986
  296   HG22  THR  39          HG22      THR  39  -8.406   3.722   0.618
  297   HG23  THR  39          HG23      THR  39 -10.030   4.026   0.000
  298    H    ALA  40           HN       ALA  40  -9.498   0.407  -2.074
  299    HA   ALA  40           HA       ALA  40  -9.967  -2.374  -1.234
  300    HB1  ALA  40           HB1      ALA  40  -8.801  -2.032  -3.879
  301    HB2  ALA  40           HB2      ALA  40 -10.227  -2.942  -3.378
  302    HB3  ALA  40           HB3      ALA  40 -10.354  -1.214  -3.709
  303    H    GLN  41           HN       GLN  41  -8.322  -3.234  -0.163
  304    HA   GLN  41           HA       GLN  41  -5.616  -2.229  -0.651
  305    HB2  GLN  41           HB2      GLN  41  -7.039  -3.106   1.684
  306    HB3  GLN  41           HB3      GLN  41  -5.633  -4.133   1.450
  307    HG2  GLN  41           HG2      GLN  41  -4.779  -2.464   2.766
  308    HG3  GLN  41           HG3      GLN  41  -4.367  -1.887   1.153
  309   HE21  GLN  41          HE21      GLN  41  -4.755  -0.448   3.680
  310   HE22  GLN  41          HE22      GLN  41  -5.974   0.746   3.353
  311    H    LEU  42           HN       LEU  42  -5.492  -3.333  -2.686
  312    HA   LEU  42           HA       LEU  42  -5.370  -6.240  -2.446
  313    HB2  LEU  42           HB2      LEU  42  -5.808  -6.450  -4.766
  314    HB3  LEU  42           HB3      LEU  42  -6.988  -5.356  -4.096
  315    HG   LEU  42           HG       LEU  42  -6.512  -4.421  -6.151
  316   HD11  LEU  42          HD11      LEU  42  -4.467  -2.983  -4.491
  317   HD12  LEU  42          HD12      LEU  42  -5.425  -2.349  -5.828
  318   HD13  LEU  42          HD13      LEU  42  -6.207  -2.768  -4.306
  319   HD21  LEU  42          HD21      LEU  42  -4.368  -4.283  -7.208
  320   HD22  LEU  42          HD22      LEU  42  -3.569  -4.889  -5.757
  321   HD23  LEU  42          HD23      LEU  42  -4.649  -5.940  -6.672
  322    H    ALA  43           HN       ALA  43  -3.586  -7.326  -2.725
  323    HA   ALA  43           HA       ALA  43  -1.149  -5.845  -3.437
  324    HB1  ALA  43           HB1      ALA  43  -0.363  -6.816  -1.582
  325    HB2  ALA  43           HB2      ALA  43  -1.764  -7.879  -1.463
  326    HB3  ALA  43           HB3      ALA  43  -0.391  -8.338  -2.470
  327    H    ILE  44           HN       ILE  44  -0.583  -6.078  -5.483
  328    HA   ILE  44           HA       ILE  44  -1.288  -8.560  -6.887
  329    HB   ILE  44           HB       ILE  44  -0.451  -6.976  -8.886
  330   HG12  ILE  44          HG12      ILE  44  -1.929  -4.791  -7.975
  331   HG13  ILE  44          HG13      ILE  44  -0.872  -5.194  -6.624
  332   HG21  ILE  44          HG21      ILE  44  -3.160  -7.226  -7.625
  333   HG22  ILE  44          HG22      ILE  44  -2.912  -6.341  -9.129
  334   HG23  ILE  44          HG23      ILE  44  -2.514  -8.056  -9.042
  335   HD11  ILE  44          HD11      ILE  44   0.544  -5.212  -9.147
  336   HD12  ILE  44          HD12      ILE  44  -0.225  -3.657  -8.820
  337   HD13  ILE  44          HD13      ILE  44   0.902  -4.348  -7.652
  338    H    VAL  45           HN       VAL  45   0.299  -9.062  -8.724
  339    HA   VAL  45           HA       VAL  45   2.900  -9.449  -7.539
  340    HB   VAL  45           HB       VAL  45   1.391 -10.989  -9.169
  341   HG11  VAL  45          HG11      VAL  45   1.589 -10.569 -11.330
  342   HG12  VAL  45          HG12      VAL  45   2.573  -9.151 -10.962
  343   HG13  VAL  45          HG13      VAL  45   3.343 -10.718 -11.214
  344   HG21  VAL  45          HG21      VAL  45   4.260 -10.945  -8.473
  345   HG22  VAL  45          HG22      VAL  45   3.022 -12.154  -8.131
  346   HG23  VAL  45          HG23      VAL  45   3.757 -12.072  -9.733
  347    HA   PRO  46           HA       PRO  46   4.989  -5.963  -9.352
  348    HB2  PRO  46           HB2      PRO  46   7.394  -7.233  -9.921
  349    HB3  PRO  46           HB3      PRO  46   6.970  -6.503  -8.371
  350    HG2  PRO  46           HG2      PRO  46   6.842  -9.365  -9.217
  351    HG3  PRO  46           HG3      PRO  46   7.325  -8.675  -7.656
  352    HD2  PRO  46           HD2      PRO  46   4.922  -9.796  -7.996
  353    HD3  PRO  46           HD3      PRO  46   5.129  -8.355  -6.977
  354    H    GLY  47           HN       GLY  47   4.027  -5.540 -11.280
  355    HA2  GLY  47           HA1      GLY  47   4.983  -5.701 -13.703
  356    HA3  GLY  47           HA2      GLY  47   4.466  -7.375 -13.523
  357    H    THR  48           HN       THR  48   2.146  -6.736 -11.908
  358    HA   THR  48           HA       THR  48   0.296  -6.048 -13.990
  359    HB   THR  48           HB       THR  48  -0.496  -6.097 -11.105
  360    HG1  THR  48           HG1      THR  48   0.517  -8.249 -12.625
  361   HG21  THR  48          HG21      THR  48  -1.767  -7.267 -13.586
  362   HG22  THR  48          HG22      THR  48  -2.164  -5.695 -12.890
  363   HG23  THR  48          HG23      THR  48  -2.493  -7.170 -11.980
  364    H    SER  49           HN       SER  49  -0.369  -4.099 -14.542
  365    HA   SER  49           HA       SER  49   0.710  -1.828 -13.210
  366    HB2  SER  49           HB2      SER  49  -1.361  -1.173 -15.121
  367    HB3  SER  49           HB3      SER  49   0.376  -0.861 -15.207
  368    HG   SER  49           HG       SER  49  -0.947  -2.510 -16.695
  369    HA   PRO  50           HA       PRO  50  -2.695  -1.324 -10.388
  370    HB2  PRO  50           HB2      PRO  50  -2.051   1.217  -9.567
  371    HB3  PRO  50           HB3      PRO  50  -1.308  -0.249  -8.918
  372    HG2  PRO  50           HG2      PRO  50  -0.281   1.643 -10.989
  373    HG3  PRO  50           HG3      PRO  50   0.599   0.818  -9.692
  374    HD2  PRO  50           HD2      PRO  50   0.684  -0.014 -12.262
  375    HD3  PRO  50           HD3      PRO  50   0.786  -1.142 -10.892
  376    H    ASP  51           HN       ASP  51  -1.890   0.833 -12.979
  377    HA   ASP  51           HA       ASP  51  -4.263   2.403 -12.925
  378    HB2  ASP  51           HB2      ASP  51  -2.571   3.403 -14.158
  379    HB3  ASP  51           HB3      ASP  51  -2.051   1.891 -14.877
  380    H    ALA  52           HN       ALA  52  -3.412  -0.731 -13.945
  381    HA   ALA  52           HA       ALA  52  -5.465  -1.027 -15.923
  382    HB1  ALA  52           HB1      ALA  52  -3.531  -2.923 -14.642
  383    HB2  ALA  52           HB2      ALA  52  -4.853  -3.525 -15.645
  384    HB3  ALA  52           HB3      ALA  52  -3.653  -2.428 -16.332
  385    H    LEU  53           HN       LEU  53  -5.102  -1.597 -12.524
  386    HA   LEU  53           HA       LEU  53  -7.492  -3.112 -12.178
  387    HB2  LEU  53           HB2      LEU  53  -6.258  -1.393 -10.050
  388    HB3  LEU  53           HB3      LEU  53  -7.116  -2.910  -9.869
  389    HG   LEU  53           HG       LEU  53  -4.489  -2.826 -11.311
  390   HD11  LEU  53          HD11      LEU  53  -3.975  -3.672  -8.710
  391   HD12  LEU  53          HD12      LEU  53  -3.428  -2.182  -9.478
  392   HD13  LEU  53          HD13      LEU  53  -4.919  -2.192  -8.539
  393   HD21  LEU  53          HD21      LEU  53  -6.354  -4.836 -10.370
  394   HD22  LEU  53          HD22      LEU  53  -5.010  -4.982 -11.505
  395   HD23  LEU  53          HD23      LEU  53  -4.717  -5.116  -9.770
  396    H    THR  54           HN       THR  54  -6.610   0.291 -11.766
  397    HA   THR  54           HA       THR  54  -9.079   1.312 -11.006
  398    HB   THR  54           HB       THR  54  -7.555   2.974 -12.909
  399    HG1  THR  54           HG1      THR  54  -6.284   2.397 -10.454
  400   HG21  THR  54          HG21      THR  54  -8.990   3.230 -10.373
  401   HG22  THR  54          HG22      THR  54  -8.763   4.406 -11.667
  402   HG23  THR  54          HG23      THR  54  -7.508   4.184 -10.447
  403    H    ALA  55           HN       ALA  55  -7.711   0.913 -14.254
  404    HA   ALA  55           HA       ALA  55  -9.996   1.841 -15.641
  405    HB1  ALA  55           HB1      ALA  55  -8.475  -0.049 -17.191
  406    HB2  ALA  55           HB2      ALA  55  -8.639   1.694 -17.396
  407    HB3  ALA  55           HB3      ALA  55  -7.404   1.046 -16.317
  408    H    ALA  56           HN       ALA  56  -9.036  -1.321 -14.462
  409    HA   ALA  56           HA       ALA  56 -10.991  -2.809 -15.850
  410    HB1  ALA  56           HB1      ALA  56  -9.678  -4.373 -14.952
  411    HB2  ALA  56           HB2      ALA  56  -9.118  -3.289 -13.677
  412    HB3  ALA  56           HB3      ALA  56 -10.632  -4.170 -13.483
  413    H    VAL  57           HN       VAL  57 -11.027  -1.279 -12.632
  414    HA   VAL  57           HA       VAL  57 -13.686  -2.116 -12.049
  415    HB   VAL  57           HB       VAL  57 -12.197   0.212 -10.856
  416   HG11  VAL  57          HG11      VAL  57 -14.714   0.045 -10.526
  417   HG12  VAL  57          HG12      VAL  57 -14.381  -1.406  -9.579
  418   HG13  VAL  57          HG13      VAL  57 -13.724   0.150  -9.070
  419   HG21  VAL  57          HG21      VAL  57 -11.300  -1.213  -9.236
  420   HG22  VAL  57          HG22      VAL  57 -12.404  -2.525  -9.651
  421   HG23  VAL  57          HG23      VAL  57 -11.091  -2.097 -10.747
  422    H    ALA  58           HN       ALA  58 -12.299   0.901 -13.331
  423    HA   ALA  58           HA       ALA  58 -14.738   2.305 -13.493
  424    HB1  ALA  58           HB1      ALA  58 -12.570   3.419 -13.577
  425    HB2  ALA  58           HB2      ALA  58 -12.241   2.671 -15.139
  426    HB3  ALA  58           HB3      ALA  58 -13.555   3.836 -14.980
  427    H    GLY  59           HN       GLY  59 -13.223  -0.019 -15.596
  428    HA2  GLY  59           HA1      GLY  59 -15.058   0.510 -17.786
  429    HA3  GLY  59           HA2      GLY  59 -13.800  -0.717 -17.744
  430    H    LEU  60           HN       LEU  60 -15.354  -1.087 -14.910
  431    HA   LEU  60           HA       LEU  60 -16.982  -3.258 -15.990
  432    HB2  LEU  60           HB2      LEU  60 -15.467  -2.809 -13.555
  433    HB3  LEU  60           HB3      LEU  60 -17.061  -3.465 -13.241
  434    HG   LEU  60           HG       LEU  60 -14.985  -4.704 -15.054
  435   HD11  LEU  60          HD11      LEU  60 -14.134  -5.113 -12.964
  436   HD12  LEU  60          HD12      LEU  60 -15.723  -5.124 -12.196
  437   HD13  LEU  60          HD13      LEU  60 -15.203  -6.500 -13.169
  438   HD21  LEU  60          HD21      LEU  60 -16.482  -6.619 -15.127
  439   HD22  LEU  60          HD22      LEU  60 -17.658  -5.758 -14.134
  440   HD23  LEU  60          HD23      LEU  60 -17.283  -5.181 -15.758
  441    H    GLY  61           HN       GLY  61 -17.599  -0.259 -15.712
  442    HA2  GLY  61           HA1      GLY  61 -19.733   0.719 -15.747
  443    HA3  GLY  61           HA2      GLY  61 -20.371  -0.696 -14.918
  444    H    TYR  62           HN       TYR  62 -17.688   0.018 -13.277
  445    HA   TYR  62           HA       TYR  62 -19.111   1.742 -11.376
  446    HB2  TYR  62           HB2      TYR  62 -16.770  -0.122 -10.895
  447    HB3  TYR  62           HB3      TYR  62 -17.606   0.824  -9.672
  448    HD1  TYR  62           HD2      TYR  62 -20.407   0.403 -10.219
  449    HD2  TYR  62           HD1      TYR  62 -17.186  -2.366 -10.490
  450    HE1  TYR  62           HE2      TYR  62 -21.980  -1.453  -9.857
  451    HE2  TYR  62           HE1      TYR  62 -18.750  -4.229 -10.132
  452    HH   TYR  62           HH       TYR  62 -20.852  -4.833  -9.814
  453    H    LYS  63           HN       LYS  63 -17.055   2.744  -9.906
  454    HA   LYS  63           HA       LYS  63 -15.200   3.922 -11.850
  455    HB2  LYS  63           HB2      LYS  63 -17.266   5.358 -10.874
  456    HB3  LYS  63           HB3      LYS  63 -16.081   5.647  -9.609
  457    HG2  LYS  63           HG2      LYS  63 -14.862   5.969 -12.181
  458    HG3  LYS  63           HG3      LYS  63 -16.321   6.957 -12.070
  459    HD2  LYS  63           HD2      LYS  63 -15.282   8.415 -10.750
  460    HD3  LYS  63           HD3      LYS  63 -14.833   7.132  -9.626
  461    HE2  LYS  63           HE2      LYS  63 -12.733   7.628 -10.216
  462    HE3  LYS  63           HE3      LYS  63 -13.089   6.701 -11.670
  463    HZ1  LYS  63           HZ1      LYS  63 -13.350   8.592 -12.924
  464    HZ2  LYS  63           HZ2      LYS  63 -12.125   9.083 -11.857
  465    HZ3  LYS  63           HZ3      LYS  63 -13.730   9.570 -11.591
  466    H    ALA  64           HN       ALA  64 -13.144   3.770 -11.235
  467    HA   ALA  64           HA       ALA  64 -12.620   3.298  -8.376
  468    HB1  ALA  64           HB1      ALA  64 -10.526   2.488 -10.260
  469    HB2  ALA  64           HB2      ALA  64 -11.187   1.639  -8.863
  470    HB3  ALA  64           HB3      ALA  64 -12.036   1.590 -10.407
  471    H    THR  65           HN       THR  65 -11.150   4.518  -7.358
  472    HA   THR  65           HA       THR  65  -9.515   6.363  -8.978
  473    HB   THR  65           HB       THR  65  -9.566   7.241  -6.278
  474    HG1  THR  65           HG1      THR  65 -12.175   6.769  -7.352
  475   HG21  THR  65          HG21      THR  65  -9.575   9.145  -7.429
  476   HG22  THR  65          HG22      THR  65 -11.256   8.861  -7.879
  477   HG23  THR  65          HG23      THR  65  -9.954   8.263  -8.907
  478    H    LEU  66           HN       LEU  66  -7.741   7.068  -6.836
  479    HA   LEU  66           HA       LEU  66  -6.666   4.570  -5.860
  480    HB2  LEU  66           HB2      LEU  66  -4.456   4.911  -6.921
  481    HB3  LEU  66           HB3      LEU  66  -5.732   4.523  -8.058
  482    HG   LEU  66           HG       LEU  66  -5.545   7.365  -7.872
  483   HD11  LEU  66          HD11      LEU  66  -3.020   6.729  -9.043
  484   HD12  LEU  66          HD12      LEU  66  -3.386   7.841  -7.722
  485   HD13  LEU  66          HD13      LEU  66  -3.057   6.142  -7.380
  486   HD21  LEU  66          HD21      LEU  66  -5.092   7.169 -10.262
  487   HD22  LEU  66          HD22      LEU  66  -4.785   5.444 -10.071
  488   HD23  LEU  66          HD23      LEU  66  -6.400   6.089  -9.776
  489    H    ALA  67           HN       ALA  67  -5.674   4.802  -4.030
  490    HA   ALA  67           HA       ALA  67  -4.491   7.402  -3.317
  491    HB1  ALA  67           HB1      ALA  67  -6.747   6.968  -2.208
  492    HB2  ALA  67           HB2      ALA  67  -5.939   5.679  -1.315
  493    HB3  ALA  67           HB3      ALA  67  -5.400   7.349  -1.138
  494    H    ASP  68           HN       ASP  68  -2.629   6.168  -4.188
  495    HA   ASP  68           HA       ASP  68  -1.807   3.708  -3.142
  496    HB2  ASP  68           HB2      ASP  68  -0.995   4.409  -5.294
  497    HB3  ASP  68           HB3      ASP  68  -0.252   5.847  -4.597
  498    H    ALA  69           HN       ALA  69  -0.744   3.159  -1.375
  499    HA   ALA  69           HA       ALA  69   0.784   5.185   0.080
  500    HB1  ALA  69           HB1      ALA  69  -0.173   3.824   2.169
  501    HB2  ALA  69           HB2      ALA  69  -0.981   5.250   1.518
  502    HB3  ALA  69           HB3      ALA  69  -1.543   3.637   1.076
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1  -0.347  -1.936   0.621
    2    H2   MET   1           H2       MET   1   0.482  -3.378   0.294
    3    H3   MET   1           H3       MET   1  -1.167  -3.245  -0.083
    4    HA   MET   1           HA       MET   1   0.709  -1.341  -1.272
    5    HB2  MET   1           HB2      MET   1   1.742  -3.568  -1.583
    6    HB3  MET   1           HB3      MET   1   0.249  -4.154  -2.298
    7    HG2  MET   1           HG2      MET   1   2.081  -3.546  -3.905
    8    HG3  MET   1           HG3      MET   1   0.510  -2.803  -4.208
    9    HE1  MET   1           HE1      MET   1   4.073  -0.838  -4.836
   10    HE2  MET   1           HE2      MET   1   3.196  -2.285  -5.338
   11    HE3  MET   1           HE3      MET   1   2.593  -0.690  -5.789
   12    H    THR   2           HN       THR   2  -0.214  -0.282  -2.982
   13    HA   THR   2           HA       THR   2  -1.805   0.552  -4.351
   14    HB   THR   2           HB       THR   2  -2.579  -2.346  -4.717
   15    HG1  THR   2           HG1      THR   2  -0.517  -0.774  -5.910
   16   HG21  THR   2          HG21      THR   2  -3.834  -0.196  -5.756
   17   HG22  THR   2          HG22      THR   2  -3.681  -1.733  -6.608
   18   HG23  THR   2          HG23      THR   2  -2.562  -0.415  -6.959
   19    H    HIS   3           HN       HIS   3  -3.068   1.696  -2.870
   20    HA   HIS   3           HA       HIS   3  -5.572   0.386  -2.057
   21    HB2  HIS   3           HB2      HIS   3  -5.104   3.212  -1.319
   22    HB3  HIS   3           HB3      HIS   3  -5.808   1.910  -0.380
   23    HD1  HIS   3           HD1      HIS   3  -2.867   3.950  -0.603
   24    HD2  HIS   3           HD2      HIS   3  -3.696   0.072   0.644
   25    HE1  HIS   3           HE1      HIS   3  -0.911   3.263   0.819
   26    HE2  HIS   3           HE2      HIS   3  -1.579   1.031   1.784
   27    H    LEU   4           HN       LEU   4  -7.211   0.567  -3.388
   28    HA   LEU   4           HA       LEU   4  -7.403   2.964  -5.090
   29    HB2  LEU   4           HB2      LEU   4  -8.604   0.224  -5.530
   30    HB3  LEU   4           HB3      LEU   4  -8.783   1.597  -6.600
   31    HG   LEU   4           HG       LEU   4  -6.258   0.049  -6.041
   32   HD11  LEU   4          HD11      LEU   4  -7.537   0.506  -8.706
   33   HD12  LEU   4          HD12      LEU   4  -6.429  -0.771  -8.199
   34   HD13  LEU   4          HD13      LEU   4  -8.103  -0.784  -7.644
   35   HD21  LEU   4          HD21      LEU   4  -6.492   2.775  -6.708
   36   HD22  LEU   4          HD22      LEU   4  -5.038   1.775  -6.704
   37   HD23  LEU   4          HD23      LEU   4  -5.999   1.930  -8.177
   38    H    LYS   5           HN       LYS   5  -9.227   4.202  -4.957
   39    HA   LYS   5           HA       LYS   5 -11.136   3.459  -2.874
   40    HB2  LYS   5           HB2      LYS   5 -11.692   6.022  -4.073
   41    HB3  LYS   5           HB3      LYS   5 -11.276   5.637  -2.411
   42    HG2  LYS   5           HG2      LYS   5  -9.085   6.169  -2.688
   43    HG3  LYS   5           HG3      LYS   5  -9.066   5.700  -4.389
   44    HD2  LYS   5           HD2      LYS   5  -9.004   7.943  -4.701
   45    HD3  LYS   5           HD3      LYS   5 -10.751   7.784  -4.514
   46    HE2  LYS   5           HE2      LYS   5 -10.599   9.264  -2.858
   47    HE3  LYS   5           HE3      LYS   5  -9.811   7.999  -1.916
   48    HZ1  LYS   5           HZ1      LYS   5  -7.949   9.253  -3.646
   49    HZ2  LYS   5           HZ2      LYS   5  -7.923   9.132  -1.954
   50    HZ3  LYS   5           HZ3      LYS   5  -8.732  10.419  -2.700
   51    H    ILE   6           HN       ILE   6 -13.085   2.693  -3.346
   52    HA   ILE   6           HA       ILE   6 -13.867   2.477  -6.129
   53    HB   ILE   6           HB       ILE   6 -15.415   1.533  -3.725
   54   HG12  ILE   6          HG12      ILE   6 -13.113   0.641  -3.619
   55   HG13  ILE   6          HG13      ILE   6 -14.296  -0.624  -3.928
   56   HG21  ILE   6          HG21      ILE   6 -16.297   1.633  -6.209
   57   HG22  ILE   6          HG22      ILE   6 -15.373   0.137  -6.352
   58   HG23  ILE   6          HG23      ILE   6 -16.666   0.263  -5.161
   59   HD11  ILE   6          HD11      ILE   6 -13.314  -1.191  -5.838
   60   HD12  ILE   6          HD12      ILE   6 -13.232   0.485  -6.383
   61   HD13  ILE   6          HD13      ILE   6 -11.969  -0.165  -5.337
   62    H    THR   7           HN       THR   7 -15.422   3.646  -7.109
   63    HA   THR   7           HA       THR   7 -16.809   5.648  -5.460
   64    HB   THR   7           HB       THR   7 -16.470   6.572  -8.157
   65    HG1  THR   7           HG1      THR   7 -14.427   5.114  -7.287
   66   HG21  THR   7          HG21      THR   7 -14.962   7.746  -5.879
   67   HG22  THR   7          HG22      THR   7 -16.722   7.724  -5.771
   68   HG23  THR   7          HG23      THR   7 -15.932   8.538  -7.121
   69    H    GLY   8           HN       GLY   8 -18.804   6.420  -6.228
   70    HA2  GLY   8           HA1      GLY   8 -20.922   6.077  -7.101
   71    HA3  GLY   8           HA2      GLY   8 -20.253   4.837  -8.164
   72    H    MET   9           HN       MET   9 -19.489   2.852  -7.030
   73    HA   MET   9           HA       MET   9 -21.575   1.972  -5.171
   74    HB2  MET   9           HB2      MET   9 -19.438   0.272  -6.474
   75    HB3  MET   9           HB3      MET   9 -20.918  -0.268  -5.698
   76    HG2  MET   9           HG2      MET   9 -21.608   1.549  -7.749
   77    HG3  MET   9           HG3      MET   9 -20.499   0.349  -8.409
   78    HE1  MET   9           HE1      MET   9 -23.522   0.625  -9.488
   79    HE2  MET   9           HE2      MET   9 -24.748  -0.205  -8.528
   80    HE3  MET   9           HE3      MET   9 -23.986   1.259  -7.910
   81    H    THR  10           HN       THR  10 -20.816   3.088  -3.323
   82    HA   THR  10           HA       THR  10 -18.007   2.880  -2.651
   83    HB   THR  10           HB       THR  10 -19.576   4.309  -0.711
   84    HG1  THR  10           HG1      THR  10 -21.089   4.560  -2.383
   85   HG21  THR  10          HG21      THR  10 -17.983   5.884  -2.582
   86   HG22  THR  10          HG22      THR  10 -17.102   4.511  -1.914
   87   HG23  THR  10          HG23      THR  10 -17.821   5.705  -0.834
   88    H    CYS  11           HN       CYS  11 -20.215   0.644  -2.111
   89    HA   CYS  11           HA       CYS  11 -19.156  -0.073   0.468
   90    HB2  CYS  11           HB2      CYS  11 -21.478  -0.201   1.487
   91    HB3  CYS  11           HB3      CYS  11 -20.727   1.382   1.378
   92    HG   CYS  11           HG       CYS  11 -22.214   2.224  -0.810
   93    H    ASP  12           HN       ASP  12 -19.324  -2.123   0.954
   94    HA   ASP  12           HA       ASP  12 -19.622  -4.389   0.588
   95    HB2  ASP  12           HB2      ASP  12 -21.045  -3.328   2.429
   96    HB3  ASP  12           HB3      ASP  12 -22.412  -3.650   1.365
   97    H    SER  13           HN       SER  13 -20.217  -6.107  -0.491
   98    HA   SER  13           HA       SER  13 -21.008  -7.422  -2.152
   99    HB2  SER  13           HB2      SER  13 -23.248  -5.417  -2.506
  100    HB3  SER  13           HB3      SER  13 -23.238  -7.107  -3.013
  101    HG   SER  13           HG       SER  13 -22.704  -7.173  -0.461
  102    H    CYS  14           HN       CYS  14 -21.470  -4.017  -3.080
  103    HA   CYS  14           HA       CYS  14 -20.674  -4.323  -5.758
  104    HB2  CYS  14           HB2      CYS  14 -20.212  -1.842  -4.113
  105    HB3  CYS  14           HB3      CYS  14 -20.597  -1.959  -5.821
  106    HG   CYS  14           HG       CYS  14 -23.006  -1.180  -5.244
  107    H    ALA  15           HN       ALA  15 -18.915  -3.455  -2.823
  108    HA   ALA  15           HA       ALA  15 -16.366  -3.234  -4.032
  109    HB1  ALA  15           HB1      ALA  15 -17.018  -2.344  -1.780
  110    HB2  ALA  15           HB2      ALA  15 -16.934  -3.999  -1.170
  111    HB3  ALA  15           HB3      ALA  15 -15.487  -3.221  -1.812
  112    H    ALA  16           HN       ALA  16 -18.258  -5.921  -2.914
  113    HA   ALA  16           HA       ALA  16 -16.081  -7.791  -2.793
  114    HB1  ALA  16           HB1      ALA  16 -18.907  -7.796  -2.181
  115    HB2  ALA  16           HB2      ALA  16 -18.429  -9.257  -3.046
  116    HB3  ALA  16           HB3      ALA  16 -17.613  -8.814  -1.547
  117    H    HIS  17           HN       HIS  17 -18.574  -6.906  -5.119
  118    HA   HIS  17           HA       HIS  17 -18.058  -8.873  -7.054
  119    HB2  HIS  17           HB2      HIS  17 -19.450  -6.284  -6.923
  120    HB3  HIS  17           HB3      HIS  17 -18.816  -6.678  -8.516
  121    HD1  HIS  17           HD1      HIS  17 -21.892  -6.615  -7.475
  122    HD2  HIS  17           HD2      HIS  17 -19.555  -9.951  -8.328
  123    HE1  HIS  17           HE1      HIS  17 -23.512  -8.474  -7.969
  124    HE2  HIS  17           HE2      HIS  17 -22.075 -10.523  -8.234
  125    H    VAL  18           HN       VAL  18 -16.764  -5.622  -6.581
  126    HA   VAL  18           HA       VAL  18 -14.974  -5.605  -8.749
  127    HB   VAL  18           HB       VAL  18 -14.936  -4.156  -6.096
  128   HG11  VAL  18          HG11      VAL  18 -12.935  -3.261  -6.483
  129   HG12  VAL  18          HG12      VAL  18 -12.709  -4.535  -7.682
  130   HG13  VAL  18          HG13      VAL  18 -13.311  -2.954  -8.179
  131   HG21  VAL  18          HG21      VAL  18 -15.942  -3.558  -8.829
  132   HG22  VAL  18          HG22      VAL  18 -16.664  -3.219  -7.257
  133   HG23  VAL  18          HG23      VAL  18 -15.330  -2.226  -7.847
  134    H    LYS  19           HN       LYS  19 -14.561  -6.495  -5.350
  135    HA   LYS  19           HA       LYS  19 -11.867  -7.135  -5.356
  136    HB2  LYS  19           HB2      LYS  19 -12.815  -7.093  -3.242
  137    HB3  LYS  19           HB3      LYS  19 -14.224  -8.010  -3.742
  138    HG2  LYS  19           HG2      LYS  19 -12.176  -9.812  -4.064
  139    HG3  LYS  19           HG3      LYS  19 -11.706  -8.921  -2.614
  140    HD2  LYS  19           HD2      LYS  19 -13.327  -9.858  -1.394
  141    HD3  LYS  19           HD3      LYS  19 -14.535  -9.604  -2.655
  142    HE2  LYS  19           HE2      LYS  19 -14.436 -11.913  -2.492
  143    HE3  LYS  19           HE3      LYS  19 -13.363 -11.571  -3.849
  144    HZ1  LYS  19           HZ1      LYS  19 -12.767 -12.860  -1.408
  145    HZ2  LYS  19           HZ2      LYS  19 -11.817 -11.463  -1.542
  146    HZ3  LYS  19           HZ3      LYS  19 -11.767 -12.638  -2.766
  147    H    GLU  20           HN       GLU  20 -14.633  -9.283  -5.973
  148    HA   GLU  20           HA       GLU  20 -13.044 -11.561  -6.467
  149    HB2  GLU  20           HB2      GLU  20 -15.060 -12.489  -6.244
  150    HB3  GLU  20           HB3      GLU  20 -15.821 -10.912  -6.355
  151    HG2  GLU  20           HG2      GLU  20 -16.720 -11.475  -8.284
  152    HG3  GLU  20           HG3      GLU  20 -15.117 -11.730  -8.976
  153    H    ALA  21           HN       ALA  21 -14.329  -9.050  -8.568
  154    HA   ALA  21           HA       ALA  21 -13.728 -10.283 -11.033
  155    HB1  ALA  21           HB1      ALA  21 -14.821  -8.473 -11.724
  156    HB2  ALA  21           HB2      ALA  21 -14.640  -7.714 -10.141
  157    HB3  ALA  21           HB3      ALA  21 -13.387  -7.511 -11.367
  158    H    LEU  22           HN       LEU  22 -11.870  -8.233  -8.866
  159    HA   LEU  22           HA       LEU  22  -9.565  -8.049 -10.519
  160    HB2  LEU  22           HB2      LEU  22  -9.889  -7.702  -7.537
  161    HB3  LEU  22           HB3      LEU  22  -8.444  -7.292  -8.439
  162    HG   LEU  22           HG       LEU  22 -11.131  -6.039  -8.982
  163   HD11  LEU  22          HD11      LEU  22  -8.917  -4.701  -7.475
  164   HD12  LEU  22          HD12      LEU  22 -10.621  -4.254  -7.588
  165   HD13  LEU  22          HD13      LEU  22 -10.138  -5.663  -6.641
  166   HD21  LEU  22          HD21      LEU  22  -8.320  -5.306  -9.793
  167   HD22  LEU  22          HD22      LEU  22  -9.599  -5.912 -10.846
  168   HD23  LEU  22          HD23      LEU  22  -9.750  -4.320 -10.100
  169    H    GLU  23           HN       GLU  23 -10.479 -10.130  -7.811
  170    HA   GLU  23           HA       GLU  23  -8.030 -11.545  -7.696
  171    HB2  GLU  23           HB2      GLU  23 -10.702 -11.760  -6.460
  172    HB3  GLU  23           HB3      GLU  23  -9.776 -13.255  -6.544
  173    HG2  GLU  23           HG2      GLU  23  -7.979 -12.301  -5.310
  174    HG3  GLU  23           HG3      GLU  23  -8.698 -10.696  -5.401
  175    H    LYS  24           HN       LYS  24 -10.648 -11.749  -9.874
  176    HA   LYS  24           HA       LYS  24 -10.254 -14.479 -10.644
  177    HB2  LYS  24           HB2      LYS  24 -12.089 -12.481 -11.282
  178    HB3  LYS  24           HB3      LYS  24 -11.212 -12.747 -12.782
  179    HG2  LYS  24           HG2      LYS  24 -12.726 -14.365 -13.109
  180    HG3  LYS  24           HG3      LYS  24 -11.703 -15.300 -12.016
  181    HD2  LYS  24           HD2      LYS  24 -13.081 -14.616 -10.126
  182    HD3  LYS  24           HD3      LYS  24 -14.089 -13.643 -11.198
  183    HE2  LYS  24           HE2      LYS  24 -14.778 -15.647 -12.395
  184    HE3  LYS  24           HE3      LYS  24 -13.729 -16.632 -11.377
  185    HZ1  LYS  24           HZ1      LYS  24 -15.058 -15.867  -9.444
  186    HZ2  LYS  24           HZ2      LYS  24 -15.947 -16.795 -10.554
  187    HZ3  LYS  24           HZ3      LYS  24 -16.130 -15.110 -10.521
  188    H    VAL  25           HN       VAL  25  -8.608 -11.542 -11.176
  189    HA   VAL  25           HA       VAL  25  -7.123 -12.469 -13.489
  190    HB   VAL  25           HB       VAL  25  -6.891  -9.997 -11.764
  191   HG11  VAL  25          HG11      VAL  25  -5.535  -9.521 -14.145
  192   HG12  VAL  25          HG12      VAL  25  -4.815  -9.752 -12.552
  193   HG13  VAL  25          HG13      VAL  25  -4.999 -11.124 -13.646
  194   HG21  VAL  25          HG21      VAL  25  -8.789 -10.518 -13.564
  195   HG22  VAL  25          HG22      VAL  25  -8.145  -8.899 -13.295
  196   HG23  VAL  25          HG23      VAL  25  -7.555  -9.870 -14.643
  197    HA   PRO  26           HA       PRO  26  -4.307 -14.828 -10.958
  198    HB2  PRO  26           HB2      PRO  26  -2.514 -14.528 -13.300
  199    HB3  PRO  26           HB3      PRO  26  -3.081 -15.994 -12.494
  200    HG2  PRO  26           HG2      PRO  26  -4.052 -15.280 -14.868
  201    HG3  PRO  26           HG3      PRO  26  -5.101 -15.994 -13.629
  202    HD2  PRO  26           HD2      PRO  26  -4.818 -13.132 -14.457
  203    HD3  PRO  26           HD3      PRO  26  -6.283 -14.044 -14.040
  204    H    GLY  27           HN       GLY  27  -3.591 -11.731 -12.311
  205    HA2  GLY  27           HA1      GLY  27  -0.979 -11.452 -11.158
  206    HA3  GLY  27           HA2      GLY  27  -1.955 -10.162 -11.838
  207    H    VAL  28           HN       VAL  28  -4.152 -11.221  -9.911
  208    HA   VAL  28           HA       VAL  28  -3.298  -9.555  -7.663
  209    HB   VAL  28           HB       VAL  28  -6.014 -10.656  -8.399
  210   HG11  VAL  28          HG11      VAL  28  -6.583 -10.312  -6.273
  211   HG12  VAL  28          HG12      VAL  28  -5.027  -9.565  -5.909
  212   HG13  VAL  28          HG13      VAL  28  -6.341  -8.589  -6.567
  213   HG21  VAL  28          HG21      VAL  28  -4.870  -8.736  -9.731
  214   HG22  VAL  28          HG22      VAL  28  -6.558  -8.583  -9.245
  215   HG23  VAL  28          HG23      VAL  28  -5.299  -7.759  -8.327
  216    H    GLN  29           HN       GLN  29  -2.682 -10.425  -5.786
  217    HA   GLN  29           HA       GLN  29  -3.004 -13.290  -5.389
  218    HB2  GLN  29           HB2      GLN  29  -1.034 -11.394  -4.657
  219    HB3  GLN  29           HB3      GLN  29  -1.753 -11.979  -3.163
  220    HG2  GLN  29           HG2      GLN  29  -1.221 -14.242  -3.716
  221    HG3  GLN  29           HG3      GLN  29  -0.680 -13.769  -5.326
  222   HE21  GLN  29          HE21      GLN  29  -0.054 -12.909  -1.935
  223   HE22  GLN  29          HE22      GLN  29   1.672 -12.840  -2.099
  224    H    SER  30           HN       SER  30  -3.863 -10.233  -3.801
  225    HA   SER  30           HA       SER  30  -6.224 -11.497  -2.706
  226    HB2  SER  30           HB2      SER  30  -5.045 -10.023  -0.542
  227    HB3  SER  30           HB3      SER  30  -5.528 -11.716  -0.585
  228    HG   SER  30           HG       SER  30  -3.238 -11.231  -0.138
  229    H    ALA  31           HN       ALA  31  -7.863 -10.128  -2.946
  230    HA   ALA  31           HA       ALA  31  -7.269  -7.256  -3.165
  231    HB1  ALA  31           HB1      ALA  31  -8.462  -8.376  -5.051
  232    HB2  ALA  31           HB2      ALA  31  -9.804  -8.688  -3.951
  233    HB3  ALA  31           HB3      ALA  31  -9.348  -7.028  -4.338
  234    H    LEU  32           HN       LEU  32  -7.145  -6.754  -0.973
  235    HA   LEU  32           HA       LEU  32  -9.309  -7.548   0.793
  236    HB2  LEU  32           HB2      LEU  32  -7.140  -5.653   1.592
  237    HB3  LEU  32           HB3      LEU  32  -7.976  -6.853   2.558
  238    HG   LEU  32           HG       LEU  32  -6.154  -7.720   0.343
  239   HD11  LEU  32          HD11      LEU  32  -4.519  -7.942   2.427
  240   HD12  LEU  32          HD12      LEU  32  -4.542  -6.520   1.384
  241   HD13  LEU  32          HD13      LEU  32  -5.397  -6.496   2.927
  242   HD21  LEU  32          HD21      LEU  32  -6.022  -9.739   1.545
  243   HD22  LEU  32          HD22      LEU  32  -6.690  -9.011   3.004
  244   HD23  LEU  32          HD23      LEU  32  -7.723  -9.275   1.599
  245    H    VAL  33           HN       VAL  33 -10.931  -6.373  -0.439
  246    HA   VAL  33           HA       VAL  33 -10.838  -3.478  -0.348
  247    HB   VAL  33           HB       VAL  33 -13.239  -5.119  -1.130
  248   HG11  VAL  33          HG11      VAL  33 -13.110  -2.508  -0.824
  249   HG12  VAL  33          HG12      VAL  33 -12.400  -2.581  -2.437
  250   HG13  VAL  33          HG13      VAL  33 -14.019  -3.226  -2.155
  251   HG21  VAL  33          HG21      VAL  33 -11.283  -5.983  -2.354
  252   HG22  VAL  33          HG22      VAL  33 -12.436  -5.175  -3.417
  253   HG23  VAL  33          HG23      VAL  33 -10.951  -4.353  -2.939
  254    H    SER  34           HN       SER  34 -11.609  -2.280   1.247
  255    HA   SER  34           HA       SER  34 -13.225  -3.610   3.308
  256    HB2  SER  34           HB2      SER  34 -12.053  -0.967   3.905
  257    HB3  SER  34           HB3      SER  34 -12.088  -2.435   4.884
  258    HG   SER  34           HG       SER  34 -10.535  -3.018   2.892
  259    H    TYR  35           HN       TYR  35 -15.334  -3.211   3.172
  260    HA   TYR  35           HA       TYR  35 -16.519  -1.219   1.635
  261    HB2  TYR  35           HB2      TYR  35 -18.051  -2.128   3.998
  262    HB3  TYR  35           HB3      TYR  35 -18.508  -2.055   2.310
  263    HD1  TYR  35           HD1      TYR  35 -17.102  -3.800   0.795
  264    HD2  TYR  35           HD2      TYR  35 -17.975  -4.233   4.935
  265    HE1  TYR  35           HE1      TYR  35 -16.770  -6.227   0.604
  266    HE2  TYR  35           HE2      TYR  35 -17.653  -6.663   4.754
  267    HH   TYR  35           HH       TYR  35 -16.059  -8.135   2.439
  268    HA   PRO  36           HA       PRO  36 -17.273   1.311   5.735
  269    HB2  PRO  36           HB2      PRO  36 -15.441   0.921   7.728
  270    HB3  PRO  36           HB3      PRO  36 -17.000   0.093   7.650
  271    HG2  PRO  36           HG2      PRO  36 -14.295  -0.877   6.800
  272    HG3  PRO  36           HG3      PRO  36 -15.560  -1.735   7.705
  273    HD2  PRO  36           HD2      PRO  36 -15.195  -2.156   5.087
  274    HD3  PRO  36           HD3      PRO  36 -16.820  -2.144   5.803
  275    H    LYS  37           HN       LYS  37 -14.258   0.583   4.274
  276    HA   LYS  37           HA       LYS  37 -13.202   3.237   4.937
  277    HB2  LYS  37           HB2      LYS  37 -11.992   0.608   4.374
  278    HB3  LYS  37           HB3      LYS  37 -11.174   1.977   3.631
  279    HG2  LYS  37           HG2      LYS  37 -11.883   2.181   6.509
  280    HG3  LYS  37           HG3      LYS  37 -10.558   1.108   6.051
  281    HD2  LYS  37           HD2      LYS  37 -10.026   3.359   4.587
  282    HD3  LYS  37           HD3      LYS  37 -10.693   4.026   6.079
  283    HE2  LYS  37           HE2      LYS  37  -8.729   1.859   6.423
  284    HE3  LYS  37           HE3      LYS  37  -8.093   3.357   5.747
  285    HZ1  LYS  37           HZ1      LYS  37  -9.832   3.562   8.090
  286    HZ2  LYS  37           HZ2      LYS  37  -8.484   4.495   7.651
  287    HZ3  LYS  37           HZ3      LYS  37  -8.267   2.958   8.334
  288    H    GLY  38           HN       GLY  38 -14.715   1.468   2.494
  289    HA2  GLY  38           HA1      GLY  38 -15.209   1.910   0.306
  290    HA3  GLY  38           HA2      GLY  38 -14.751   3.575   0.643
  291    H    THR  39           HN       THR  39 -12.454   1.014   1.135
  292    HA   THR  39           HA       THR  39 -11.049   1.835  -1.314
  293    HB   THR  39           HB       THR  39  -9.023   1.369   0.530
  294    HG1  THR  39           HG1      THR  39 -11.057   3.019   1.677
  295   HG21  THR  39          HG21      THR  39  -9.037   4.037   0.425
  296   HG22  THR  39          HG22      THR  39 -10.180   3.708  -0.876
  297   HG23  THR  39          HG23      THR  39  -8.550   3.040  -0.943
  298    H    ALA  40           HN       ALA  40  -9.596   0.355  -2.160
  299    HA   ALA  40           HA       ALA  40  -9.917  -2.403  -1.179
  300    HB1  ALA  40           HB1      ALA  40 -10.858  -2.394  -3.299
  301    HB2  ALA  40           HB2      ALA  40  -9.668  -1.253  -3.930
  302    HB3  ALA  40           HB3      ALA  40  -9.205  -2.926  -3.614
  303    H    GLN  41           HN       GLN  41  -8.154  -3.197  -0.235
  304    HA   GLN  41           HA       GLN  41  -5.531  -2.088  -0.888
  305    HB2  GLN  41           HB2      GLN  41  -6.673  -3.667   1.360
  306    HB3  GLN  41           HB3      GLN  41  -4.976  -3.931   0.985
  307    HG2  GLN  41           HG2      GLN  41  -5.256  -2.262   2.729
  308    HG3  GLN  41           HG3      GLN  41  -4.519  -1.564   1.289
  309   HE21  GLN  41          HE21      GLN  41  -7.561  -1.897   3.039
  310   HE22  GLN  41          HE22      GLN  41  -8.266  -0.430   2.454
  311    H    LEU  42           HN       LEU  42  -4.815  -2.947  -2.767
  312    HA   LEU  42           HA       LEU  42  -5.453  -5.744  -3.342
  313    HB2  LEU  42           HB2      LEU  42  -4.836  -3.347  -4.974
  314    HB3  LEU  42           HB3      LEU  42  -4.364  -4.905  -5.626
  315    HG   LEU  42           HG       LEU  42  -7.110  -4.862  -4.632
  316   HD11  LEU  42          HD11      LEU  42  -6.185  -2.671  -6.291
  317   HD12  LEU  42          HD12      LEU  42  -7.451  -3.615  -7.075
  318   HD13  LEU  42          HD13      LEU  42  -7.737  -2.906  -5.487
  319   HD21  LEU  42          HD21      LEU  42  -5.652  -6.441  -6.254
  320   HD22  LEU  42          HD22      LEU  42  -7.413  -6.357  -6.291
  321   HD23  LEU  42          HD23      LEU  42  -6.463  -5.428  -7.449
  322    H    ALA  43           HN       ALA  43  -4.003  -7.206  -2.790
  323    HA   ALA  43           HA       ALA  43  -1.159  -6.580  -2.876
  324    HB1  ALA  43           HB1      ALA  43  -2.200  -7.956  -1.034
  325    HB2  ALA  43           HB2      ALA  43  -2.437  -9.230  -2.229
  326    HB3  ALA  43           HB3      ALA  43  -0.807  -8.688  -1.831
  327    H    ILE  44           HN       ILE  44  -0.797  -6.287  -5.057
  328    HA   ILE  44           HA       ILE  44  -1.550  -8.441  -6.885
  329    HB   ILE  44           HB       ILE  44  -0.457  -6.664  -8.547
  330   HG12  ILE  44          HG12      ILE  44  -1.752  -4.696  -6.754
  331   HG13  ILE  44          HG13      ILE  44  -0.162  -5.259  -6.250
  332   HG21  ILE  44          HG21      ILE  44  -2.888  -7.598  -8.207
  333   HG22  ILE  44          HG22      ILE  44  -3.184  -5.974  -7.581
  334   HG23  ILE  44          HG23      ILE  44  -2.588  -6.191  -9.228
  335   HD11  ILE  44          HD11      ILE  44  -0.866  -3.362  -8.276
  336   HD12  ILE  44          HD12      ILE  44   0.719  -3.764  -7.612
  337   HD13  ILE  44          HD13      ILE  44   0.073  -4.685  -8.970
  338    H    VAL  45           HN       VAL  45  -0.031  -9.247  -8.420
  339    HA   VAL  45           HA       VAL  45   2.593  -9.674  -7.257
  340    HB   VAL  45           HB       VAL  45   1.398 -10.752  -9.824
  341   HG11  VAL  45          HG11      VAL  45   4.051 -10.758  -8.994
  342   HG12  VAL  45          HG12      VAL  45   3.450 -12.369  -8.593
  343   HG13  VAL  45          HG13      VAL  45   3.330 -11.768 -10.248
  344   HG21  VAL  45          HG21      VAL  45   1.565 -12.848  -8.076
  345   HG22  VAL  45          HG22      VAL  45   1.073 -11.518  -7.028
  346   HG23  VAL  45          HG23      VAL  45   0.100 -11.935  -8.438
  347    HA   PRO  46           HA       PRO  46   4.729  -6.354  -9.322
  348    HB2  PRO  46           HB2      PRO  46   6.969  -8.040  -9.879
  349    HB3  PRO  46           HB3      PRO  46   6.804  -6.850  -8.586
  350    HG2  PRO  46           HG2      PRO  46   6.421  -9.783  -8.516
  351    HG3  PRO  46           HG3      PRO  46   6.888  -8.677  -7.214
  352    HD2  PRO  46           HD2      PRO  46   4.444  -9.782  -7.310
  353    HD3  PRO  46           HD3      PRO  46   4.686  -8.118  -6.732
  354    H    GLY  47           HN       GLY  47   4.717  -5.674 -11.370
  355    HA2  GLY  47           HA1      GLY  47   5.164  -6.131 -13.743
  356    HA3  GLY  47           HA2      GLY  47   4.458  -7.722 -13.485
  357    H    THR  48           HN       THR  48   2.241  -7.042 -11.965
  358    HA   THR  48           HA       THR  48   0.456  -5.968 -13.933
  359    HB   THR  48           HB       THR  48  -0.469  -6.249 -11.133
  360    HG1  THR  48           HG1      THR  48   0.792  -8.045 -11.079
  361   HG21  THR  48          HG21      THR  48  -1.704  -6.026 -13.537
  362   HG22  THR  48          HG22      THR  48  -2.444  -6.755 -12.113
  363   HG23  THR  48          HG23      THR  48  -1.691  -7.777 -13.337
  364    H    SER  49           HN       SER  49   0.097  -3.904 -14.285
  365    HA   SER  49           HA       SER  49   1.086  -1.909 -12.519
  366    HB2  SER  49           HB2      SER  49  -0.593  -0.657 -14.365
  367    HB3  SER  49           HB3      SER  49   1.146  -0.893 -14.527
  368    HG   SER  49           HG       SER  49  -0.534  -1.782 -16.179
  369    HA   PRO  50           HA       PRO  50  -2.497  -1.608  -9.911
  370    HB2  PRO  50           HB2      PRO  50  -1.590   1.173  -9.451
  371    HB3  PRO  50           HB3      PRO  50  -1.868  -0.123  -8.283
  372    HG2  PRO  50           HG2      PRO  50   0.609   0.653  -8.928
  373    HG3  PRO  50           HG3      PRO  50   0.227  -1.051  -8.619
  374    HD2  PRO  50           HD2      PRO  50   0.625   0.360 -11.230
  375    HD3  PRO  50           HD3      PRO  50   1.153  -1.261 -10.735
  376    H    ASP  51           HN       ASP  51  -1.756   0.658 -12.429
  377    HA   ASP  51           HA       ASP  51  -4.205   2.110 -12.382
  378    HB2  ASP  51           HB2      ASP  51  -2.814   3.324 -13.661
  379    HB3  ASP  51           HB3      ASP  51  -1.794   1.948 -14.024
  380    H    ALA  52           HN       ALA  52  -3.223  -0.948 -13.454
  381    HA   ALA  52           HA       ALA  52  -5.133  -1.264 -15.553
  382    HB1  ALA  52           HB1      ALA  52  -4.002  -3.638 -14.160
  383    HB2  ALA  52           HB2      ALA  52  -4.257  -3.356 -15.884
  384    HB3  ALA  52           HB3      ALA  52  -2.905  -2.583 -15.054
  385    H    LEU  53           HN       LEU  53  -5.038  -1.894 -12.142
  386    HA   LEU  53           HA       LEU  53  -7.446  -3.427 -12.038
  387    HB2  LEU  53           HB2      LEU  53  -6.260  -1.851  -9.766
  388    HB3  LEU  53           HB3      LEU  53  -7.238  -3.304  -9.681
  389    HG   LEU  53           HG       LEU  53  -4.612  -3.481 -11.072
  390   HD11  LEU  53          HD11      LEU  53  -4.459  -3.998  -8.204
  391   HD12  LEU  53          HD12      LEU  53  -3.307  -3.209  -9.282
  392   HD13  LEU  53          HD13      LEU  53  -4.662  -2.295  -8.617
  393   HD21  LEU  53          HD21      LEU  53  -6.605  -5.241  -9.934
  394   HD22  LEU  53          HD22      LEU  53  -5.294  -5.598 -11.058
  395   HD23  LEU  53          HD23      LEU  53  -4.990  -5.599  -9.320
  396    H    THR  54           HN       THR  54  -6.564  -0.060 -11.476
  397    HA   THR  54           HA       THR  54  -9.062   0.917 -10.705
  398    HB   THR  54           HB       THR  54  -7.510   2.742 -12.395
  399    HG1  THR  54           HG1      THR  54  -6.259   1.663 -10.076
  400   HG21  THR  54          HG21      THR  54  -9.260   3.088 -10.420
  401   HG22  THR  54          HG22      THR  54  -7.978   4.253 -10.752
  402   HG23  THR  54          HG23      THR  54  -7.781   3.070  -9.457
  403    H    ALA  55           HN       ALA  55  -7.563   0.743 -13.916
  404    HA   ALA  55           HA       ALA  55  -9.792   1.815 -15.302
  405    HB1  ALA  55           HB1      ALA  55  -8.498   1.662 -17.134
  406    HB2  ALA  55           HB2      ALA  55  -7.218   1.274 -15.981
  407    HB3  ALA  55           HB3      ALA  55  -8.077  -0.022 -16.815
  408    H    ALA  56           HN       ALA  56  -8.851  -1.450 -14.392
  409    HA   ALA  56           HA       ALA  56 -10.777  -2.822 -15.914
  410    HB1  ALA  56           HB1      ALA  56  -8.844  -3.857 -14.684
  411    HB2  ALA  56           HB2      ALA  56  -9.784  -3.679 -13.204
  412    HB3  ALA  56           HB3      ALA  56 -10.382  -4.701 -14.510
  413    H    VAL  57           HN       VAL  57 -10.908  -1.518 -12.610
  414    HA   VAL  57           HA       VAL  57 -13.567  -2.350 -12.103
  415    HB   VAL  57           HB       VAL  57 -12.073  -0.055 -10.852
  416   HG11  VAL  57          HG11      VAL  57 -14.749  -0.691 -10.623
  417   HG12  VAL  57          HG12      VAL  57 -14.015  -1.440  -9.205
  418   HG13  VAL  57          HG13      VAL  57 -13.808   0.288  -9.497
  419   HG21  VAL  57          HG21      VAL  57 -10.916  -1.502  -9.609
  420   HG22  VAL  57          HG22      VAL  57 -12.349  -2.474  -9.276
  421   HG23  VAL  57          HG23      VAL  57 -11.432  -2.737 -10.757
  422    H    ALA  58           HN       ALA  58 -12.218   0.784 -13.163
  423    HA   ALA  58           HA       ALA  58 -14.718   2.081 -13.362
  424    HB1  ALA  58           HB1      ALA  58 -13.577   3.884 -14.240
  425    HB2  ALA  58           HB2      ALA  58 -12.319   3.065 -13.315
  426    HB3  ALA  58           HB3      ALA  58 -12.396   2.868 -15.066
  427    H    GLY  59           HN       GLY  59 -13.144  -0.170 -15.440
  428    HA2  GLY  59           HA1      GLY  59 -14.917   0.504 -17.677
  429    HA3  GLY  59           HA2      GLY  59 -13.584  -0.643 -17.718
  430    H    LEU  60           HN       LEU  60 -15.299  -1.125 -14.919
  431    HA   LEU  60           HA       LEU  60 -16.738  -3.369 -16.140
  432    HB2  LEU  60           HB2      LEU  60 -15.172  -3.053 -13.725
  433    HB3  LEU  60           HB3      LEU  60 -16.735  -3.773 -13.402
  434    HG   LEU  60           HG       LEU  60 -14.822  -4.833 -15.476
  435   HD11  LEU  60          HD11      LEU  60 -15.185  -5.618 -12.592
  436   HD12  LEU  60          HD12      LEU  60 -14.338  -6.598 -13.789
  437   HD13  LEU  60          HD13      LEU  60 -13.720  -5.002 -13.357
  438   HD21  LEU  60          HD21      LEU  60 -17.527  -5.487 -14.619
  439   HD22  LEU  60          HD22      LEU  60 -16.650  -5.972 -16.070
  440   HD23  LEU  60          HD23      LEU  60 -16.432  -6.868 -14.566
  441    H    GLY  61           HN       GLY  61 -17.541  -0.453 -15.664
  442    HA2  GLY  61           HA1      GLY  61 -19.755   0.349 -15.583
  443    HA3  GLY  61           HA2      GLY  61 -20.239  -1.132 -14.770
  444    H    TYR  62           HN       TYR  62 -17.594  -0.344 -13.153
  445    HA   TYR  62           HA       TYR  62 -19.029   1.329 -11.212
  446    HB2  TYR  62           HB2      TYR  62 -16.498  -0.250 -10.715
  447    HB3  TYR  62           HB3      TYR  62 -17.582   0.452  -9.526
  448    HD1  TYR  62           HD2      TYR  62 -19.944  -0.548  -9.344
  449    HD2  TYR  62           HD1      TYR  62 -16.748  -2.476 -11.380
  450    HE1  TYR  62           HE2      TYR  62 -21.141  -2.690  -9.180
  451    HE2  TYR  62           HE1      TYR  62 -17.937  -4.623 -11.227
  452    HH   TYR  62           HH       TYR  62 -19.759  -5.619  -9.596
  453    H    LYS  63           HN       LYS  63 -17.276   2.707  -9.903
  454    HA   LYS  63           HA       LYS  63 -15.333   3.769 -11.844
  455    HB2  LYS  63           HB2      LYS  63 -17.260   5.317 -11.221
  456    HB3  LYS  63           HB3      LYS  63 -16.577   5.364  -9.601
  457    HG2  LYS  63           HG2      LYS  63 -15.798   7.295 -10.703
  458    HG3  LYS  63           HG3      LYS  63 -14.434   6.178 -10.662
  459    HD2  LYS  63           HD2      LYS  63 -14.945   5.498 -12.970
  460    HD3  LYS  63           HD3      LYS  63 -16.278   6.653 -13.002
  461    HE2  LYS  63           HE2      LYS  63 -13.455   7.489 -12.406
  462    HE3  LYS  63           HE3      LYS  63 -14.063   7.369 -14.057
  463    HZ1  LYS  63           HZ1      LYS  63 -14.413   9.454 -12.195
  464    HZ2  LYS  63           HZ2      LYS  63 -15.935   8.825 -12.601
  465    HZ3  LYS  63           HZ3      LYS  63 -14.896   9.390 -13.820
  466    H    ALA  64           HN       ALA  64 -13.236   3.731 -11.201
  467    HA   ALA  64           HA       ALA  64 -12.741   3.364  -8.318
  468    HB1  ALA  64           HB1      ALA  64 -11.177   2.141 -10.584
  469    HB2  ALA  64           HB2      ALA  64 -10.839   1.952  -8.865
  470    HB3  ALA  64           HB3      ALA  64 -12.325   1.293  -9.549
  471    H    THR  65           HN       THR  65 -11.258   4.624  -7.383
  472    HA   THR  65           HA       THR  65  -9.479   6.207  -9.125
  473    HB   THR  65           HB       THR  65  -9.894   7.264  -6.414
  474    HG1  THR  65           HG1      THR  65 -12.058   6.498  -7.761
  475   HG21  THR  65          HG21      THR  65 -10.294   8.661  -9.047
  476   HG22  THR  65          HG22      THR  65  -8.683   8.311  -8.416
  477   HG23  THR  65          HG23      THR  65  -9.785   9.344  -7.502
  478    H    LEU  66           HN       LEU  66  -7.918   7.110  -6.771
  479    HA   LEU  66           HA       LEU  66  -6.823   4.616  -5.761
  480    HB2  LEU  66           HB2      LEU  66  -4.530   5.824  -6.722
  481    HB3  LEU  66           HB3      LEU  66  -5.303   4.392  -7.372
  482    HG   LEU  66           HG       LEU  66  -6.704   6.254  -8.695
  483   HD11  LEU  66          HD11      LEU  66  -4.039   7.513  -8.090
  484   HD12  LEU  66          HD12      LEU  66  -5.070   8.000  -9.435
  485   HD13  LEU  66          HD13      LEU  66  -5.644   8.175  -7.776
  486   HD21  LEU  66          HD21      LEU  66  -4.079   4.959  -9.319
  487   HD22  LEU  66          HD22      LEU  66  -5.687   4.563  -9.923
  488   HD23  LEU  66          HD23      LEU  66  -4.864   6.016 -10.491
  489    H    ALA  67           HN       ALA  67  -5.946   4.827  -3.861
  490    HA   ALA  67           HA       ALA  67  -5.277   7.524  -2.877
  491    HB1  ALA  67           HB1      ALA  67  -5.677   5.525  -0.812
  492    HB2  ALA  67           HB2      ALA  67  -6.432   7.106  -1.008
  493    HB3  ALA  67           HB3      ALA  67  -7.101   5.703  -1.838
  494    H    ASP  68           HN       ASP  68  -3.225   7.025  -4.002
  495    HA   ASP  68           HA       ASP  68  -1.623   4.835  -3.392
  496    HB2  ASP  68           HB2      ASP  68  -0.191   5.703  -4.909
  497    HB3  ASP  68           HB3      ASP  68  -1.520   6.804  -5.243
  498    H    ALA  69           HN       ALA  69  -2.086   7.820  -1.700
  499    HA   ALA  69           HA       ALA  69   0.125   7.137   0.110
  500    HB1  ALA  69           HB1      ALA  69   0.064   9.432  -0.919
  501    HB2  ALA  69           HB2      ALA  69  -1.393   9.739   0.028
  502    HB3  ALA  69           HB3      ALA  69   0.134   9.400   0.843
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1  -1.591  -3.164   0.557
    2    H2   MET   1           H2       MET   1  -0.092  -3.931   0.733
    3    H3   MET   1           H3       MET   1  -0.737  -3.678  -0.814
    4    HA   MET   1           HA       MET   1  -0.109  -1.472   1.035
    5    HB2  MET   1           HB2      MET   1   2.033  -1.189   0.037
    6    HB3  MET   1           HB3      MET   1   1.919  -2.872   0.523
    7    HG2  MET   1           HG2      MET   1   1.429  -1.904  -2.283
    8    HG3  MET   1           HG3      MET   1   2.987  -2.473  -1.690
    9    HE1  MET   1           HE1      MET   1   3.613  -4.050  -2.877
   10    HE2  MET   1           HE2      MET   1   3.376  -5.627  -2.120
   11    HE3  MET   1           HE3      MET   1   2.668  -5.293  -3.700
   12    H    THR   2           HN       THR   2  -0.714  -2.616  -2.264
   13    HA   THR   2           HA       THR   2  -1.017  -0.036  -3.387
   14    HB   THR   2           HB       THR   2  -2.471  -2.374  -4.523
   15    HG1  THR   2           HG1      THR   2   0.379  -2.150  -4.555
   16   HG21  THR   2          HG21      THR   2  -1.952   0.061  -5.502
   17   HG22  THR   2          HG22      THR   2  -2.081  -1.365  -6.529
   18   HG23  THR   2          HG23      THR   2  -0.495  -0.769  -6.044
   19    H    HIS   3           HN       HIS   3  -2.586   1.356  -2.908
   20    HA   HIS   3           HA       HIS   3  -5.163   0.300  -1.985
   21    HB2  HIS   3           HB2      HIS   3  -3.871   2.992  -1.698
   22    HB3  HIS   3           HB3      HIS   3  -5.577   2.759  -1.396
   23    HD1  HIS   3           HD1      HIS   3  -2.195   2.022   0.045
   24    HD2  HIS   3           HD2      HIS   3  -6.220   1.445   0.965
   25    HE1  HIS   3           HE1      HIS   3  -2.250   1.270   2.446
   26    HE2  HIS   3           HE2      HIS   3  -4.695   1.099   3.032
   27    H    LEU   4           HN       LEU   4  -6.957   0.643  -3.042
   28    HA   LEU   4           HA       LEU   4  -6.975   2.385  -5.409
   29    HB2  LEU   4           HB2      LEU   4  -8.289  -0.321  -5.092
   30    HB3  LEU   4           HB3      LEU   4  -8.607   0.778  -6.417
   31    HG   LEU   4           HG       LEU   4  -5.995  -0.612  -5.818
   32   HD11  LEU   4          HD11      LEU   4  -7.880  -1.932  -6.841
   33   HD12  LEU   4          HD12      LEU   4  -7.770  -0.854  -8.233
   34   HD13  LEU   4          HD13      LEU   4  -6.393  -1.861  -7.786
   35   HD21  LEU   4          HD21      LEU   4  -6.275   1.857  -7.001
   36   HD22  LEU   4          HD22      LEU   4  -4.918   0.750  -7.217
   37   HD23  LEU   4          HD23      LEU   4  -6.247   0.752  -8.376
   38    H    LYS   5           HN       LYS   5  -8.703   3.760  -5.499
   39    HA   LYS   5           HA       LYS   5 -10.484   3.681  -3.173
   40    HB2  LYS   5           HB2      LYS   5  -9.239   5.795  -4.689
   41    HB3  LYS   5           HB3      LYS   5 -10.974   6.041  -4.596
   42    HG2  LYS   5           HG2      LYS   5  -9.668   5.299  -2.066
   43    HG3  LYS   5           HG3      LYS   5  -9.224   6.874  -2.727
   44    HD2  LYS   5           HD2      LYS   5 -11.071   7.594  -1.661
   45    HD3  LYS   5           HD3      LYS   5 -11.925   6.906  -3.045
   46    HE2  LYS   5           HE2      LYS   5 -12.477   4.952  -1.868
   47    HE3  LYS   5           HE3      LYS   5 -11.276   5.261  -0.616
   48    HZ1  LYS   5           HZ1      LYS   5 -12.599   7.131   0.146
   49    HZ2  LYS   5           HZ2      LYS   5 -13.519   5.710   0.162
   50    HZ3  LYS   5           HZ3      LYS   5 -13.749   6.849  -1.071
   51    H    ILE   6           HN       ILE   6 -12.611   3.418  -3.313
   52    HA   ILE   6           HA       ILE   6 -13.704   2.738  -5.930
   53    HB   ILE   6           HB       ILE   6 -14.315   1.978  -3.139
   54   HG12  ILE   6          HG12      ILE   6 -15.020  -0.138  -4.399
   55   HG13  ILE   6          HG13      ILE   6 -14.400   0.655  -5.843
   56   HG21  ILE   6          HG21      ILE   6 -16.656   1.265  -3.812
   57   HG22  ILE   6          HG22      ILE   6 -16.417   2.982  -3.487
   58   HG23  ILE   6          HG23      ILE   6 -16.508   2.403  -5.151
   59   HD11  ILE   6          HD11      ILE   6 -12.348   0.021  -5.343
   60   HD12  ILE   6          HD12      ILE   6 -12.449   0.809  -3.766
   61   HD13  ILE   6          HD13      ILE   6 -12.990  -0.858  -3.954
   62    H    THR   7           HN       THR   7 -15.148   3.997  -6.968
   63    HA   THR   7           HA       THR   7 -16.344   6.230  -5.475
   64    HB   THR   7           HB       THR   7 -16.101   7.088  -8.127
   65    HG1  THR   7           HG1      THR   7 -14.402   5.335  -8.134
   66   HG21  THR   7          HG21      THR   7 -15.865   8.245  -5.792
   67   HG22  THR   7          HG22      THR   7 -15.025   8.909  -7.191
   68   HG23  THR   7          HG23      THR   7 -14.146   7.923  -6.024
   69    H    GLY   8           HN       GLY   8 -18.449   6.482  -5.723
   70    HA2  GLY   8           HA1      GLY   8 -20.442   6.615  -7.009
   71    HA3  GLY   8           HA2      GLY   8 -19.787   5.410  -8.106
   72    H    MET   9           HN       MET   9 -18.942   3.680  -5.856
   73    HA   MET   9           HA       MET   9 -21.491   2.318  -5.612
   74    HB2  MET   9           HB2      MET   9 -18.862   1.294  -4.565
   75    HB3  MET   9           HB3      MET   9 -20.293   0.386  -5.008
   76    HG2  MET   9           HG2      MET   9 -19.956   0.884  -7.330
   77    HG3  MET   9           HG3      MET   9 -18.584   1.922  -6.945
   78    HE1  MET   9           HE1      MET   9 -16.751   1.436  -7.600
   79    HE2  MET   9           HE2      MET   9 -15.746   0.303  -6.695
   80    HE3  MET   9           HE3      MET   9 -16.272  -0.096  -8.332
   81    H    THR  10           HN       THR  10 -21.484   0.970  -3.324
   82    HA   THR  10           HA       THR  10 -21.591   3.132  -1.337
   83    HB   THR  10           HB       THR  10 -23.379   0.722  -1.253
   84    HG1  THR  10           HG1      THR  10 -24.188   1.469  -3.083
   85   HG21  THR  10          HG21      THR  10 -24.788   2.136   0.080
   86   HG22  THR  10          HG22      THR  10 -23.791   3.547  -0.271
   87   HG23  THR  10          HG23      THR  10 -23.150   2.238   0.723
   88    H    CYS  11           HN       CYS  11 -21.370  -0.478  -1.461
   89    HA   CYS  11           HA       CYS  11 -19.621  -0.423   0.856
   90    HB2  CYS  11           HB2      CYS  11 -21.246  -1.861   2.156
   91    HB3  CYS  11           HB3      CYS  11 -21.633  -0.151   2.029
   92    HG   CYS  11           HG       CYS  11 -23.742  -2.363   1.632
   93    H    ASP  12           HN       ASP  12 -20.301  -3.047   1.747
   94    HA   ASP  12           HA       ASP  12 -18.565  -4.683   0.464
   95    HB2  ASP  12           HB2      ASP  12 -19.555  -5.220   2.625
   96    HB3  ASP  12           HB3      ASP  12 -21.112  -5.524   1.858
   97    H    SER  13           HN       SER  13 -22.063  -4.533  -0.257
   98    HA   SER  13           HA       SER  13 -22.154  -6.600  -2.120
   99    HB2  SER  13           HB2      SER  13 -23.862  -4.267  -2.705
  100    HB3  SER  13           HB3      SER  13 -24.307  -5.948  -2.400
  101    HG   SER  13           HG       SER  13 -24.680  -5.451  -0.404
  102    H    CYS  14           HN       CYS  14 -20.975  -3.371  -2.405
  103    HA   CYS  14           HA       CYS  14 -20.749  -3.448  -5.297
  104    HB2  CYS  14           HB2      CYS  14 -19.602  -1.421  -3.385
  105    HB3  CYS  14           HB3      CYS  14 -19.980  -1.181  -5.087
  106    HG   CYS  14           HG       CYS  14 -22.822  -1.638  -4.492
  107    H    ALA  15           HN       ALA  15 -18.665  -3.446  -2.456
  108    HA   ALA  15           HA       ALA  15 -16.182  -3.546  -3.751
  109    HB1  ALA  15           HB1      ALA  15 -16.019  -3.003  -1.521
  110    HB2  ALA  15           HB2      ALA  15 -17.163  -4.251  -1.026
  111    HB3  ALA  15           HB3      ALA  15 -15.523  -4.697  -1.496
  112    H    ALA  16           HN       ALA  16 -18.548  -6.000  -3.103
  113    HA   ALA  16           HA       ALA  16 -16.971  -8.304  -3.290
  114    HB1  ALA  16           HB1      ALA  16 -18.924  -9.326  -2.991
  115    HB2  ALA  16           HB2      ALA  16 -19.679  -7.734  -3.013
  116    HB3  ALA  16           HB3      ALA  16 -19.564  -8.676  -4.498
  117    H    HIS  17           HN       HIS  17 -18.655  -6.452  -5.797
  118    HA   HIS  17           HA       HIS  17 -17.969  -8.138  -7.954
  119    HB2  HIS  17           HB2      HIS  17 -19.586  -5.944  -7.650
  120    HB3  HIS  17           HB3      HIS  17 -18.261  -5.278  -8.598
  121    HD1  HIS  17           HD1      HIS  17 -20.773  -5.271 -10.076
  122    HD2  HIS  17           HD2      HIS  17 -18.385  -8.678  -9.939
  123    HE1  HIS  17           HE1      HIS  17 -21.433  -6.645 -12.075
  124    HE2  HIS  17           HE2      HIS  17 -19.875  -8.625 -12.061
  125    H    VAL  18           HN       VAL  18 -16.424  -5.309  -6.540
  126    HA   VAL  18           HA       VAL  18 -14.317  -5.038  -8.394
  127    HB   VAL  18           HB       VAL  18 -14.285  -4.373  -5.442
  128   HG11  VAL  18          HG11      VAL  18 -12.563  -2.778  -5.991
  129   HG12  VAL  18          HG12      VAL  18 -12.075  -4.378  -6.547
  130   HG13  VAL  18          HG13      VAL  18 -12.677  -3.188  -7.703
  131   HG21  VAL  18          HG21      VAL  18 -15.481  -2.503  -5.817
  132   HG22  VAL  18          HG22      VAL  18 -14.770  -2.239  -7.409
  133   HG23  VAL  18          HG23      VAL  18 -16.081  -3.400  -7.211
  134    H    LYS  19           HN       LYS  19 -14.578  -6.764  -5.312
  135    HA   LYS  19           HA       LYS  19 -11.975  -7.814  -5.276
  136    HB2  LYS  19           HB2      LYS  19 -13.523  -7.723  -3.324
  137    HB3  LYS  19           HB3      LYS  19 -14.469  -9.011  -4.057
  138    HG2  LYS  19           HG2      LYS  19 -11.989 -10.120  -4.044
  139    HG3  LYS  19           HG3      LYS  19 -11.943  -9.132  -2.580
  140    HD2  LYS  19           HD2      LYS  19 -12.752 -11.322  -2.000
  141    HD3  LYS  19           HD3      LYS  19 -14.094 -10.181  -1.882
  142    HE2  LYS  19           HE2      LYS  19 -14.713 -10.877  -4.237
  143    HE3  LYS  19           HE3      LYS  19 -13.543 -12.182  -4.065
  144    HZ1  LYS  19           HZ1      LYS  19 -14.902 -13.332  -2.733
  145    HZ2  LYS  19           HZ2      LYS  19 -16.130 -12.355  -3.387
  146    HZ3  LYS  19           HZ3      LYS  19 -15.437 -11.960  -1.892
  147    H    GLU  20           HN       GLU  20 -14.999  -9.064  -6.618
  148    HA   GLU  20           HA       GLU  20 -14.003 -11.565  -7.432
  149    HB2  GLU  20           HB2      GLU  20 -16.298  -9.849  -8.291
  150    HB3  GLU  20           HB3      GLU  20 -15.878 -11.261  -9.250
  151    HG2  GLU  20           HG2      GLU  20 -16.426 -12.736  -7.555
  152    HG3  GLU  20           HG3      GLU  20 -16.289 -11.502  -6.302
  153    H    ALA  21           HN       ALA  21 -14.196  -8.458  -9.111
  154    HA   ALA  21           HA       ALA  21 -13.109  -9.297 -11.558
  155    HB1  ALA  21           HB1      ALA  21 -14.036  -7.191 -11.679
  156    HB2  ALA  21           HB2      ALA  21 -13.316  -6.669 -10.157
  157    HB3  ALA  21           HB3      ALA  21 -12.318  -6.801 -11.605
  158    H    LEU  22           HN       LEU  22 -11.644  -8.217  -8.562
  159    HA   LEU  22           HA       LEU  22  -8.962  -8.169  -9.490
  160    HB2  LEU  22           HB2      LEU  22 -10.247  -8.265  -6.782
  161    HB3  LEU  22           HB3      LEU  22  -8.510  -8.447  -6.948
  162    HG   LEU  22           HG       LEU  22  -9.874  -6.092  -8.193
  163   HD11  LEU  22          HD11      LEU  22 -10.513  -5.258  -6.244
  164   HD12  LEU  22          HD12      LEU  22  -9.910  -6.688  -5.404
  165   HD13  LEU  22          HD13      LEU  22  -8.840  -5.316  -5.688
  166   HD21  LEU  22          HD21      LEU  22  -7.506  -5.263  -7.170
  167   HD22  LEU  22          HD22      LEU  22  -7.145  -6.950  -7.529
  168   HD23  LEU  22          HD23      LEU  22  -7.723  -5.883  -8.807
  169    H    GLU  23           HN       GLU  23 -10.947 -10.608  -7.885
  170    HA   GLU  23           HA       GLU  23  -8.871 -12.501  -7.558
  171    HB2  GLU  23           HB2      GLU  23 -11.839 -12.555  -7.372
  172    HB3  GLU  23           HB3      GLU  23 -10.991 -14.092  -7.499
  173    HG2  GLU  23           HG2      GLU  23  -9.521 -13.115  -5.589
  174    HG3  GLU  23           HG3      GLU  23 -10.903 -12.056  -5.335
  175    H    LYS  24           HN       LYS  24 -10.865 -11.634 -10.250
  176    HA   LYS  24           HA       LYS  24 -10.298 -14.032 -11.739
  177    HB2  LYS  24           HB2      LYS  24 -11.513 -11.373 -12.486
  178    HB3  LYS  24           HB3      LYS  24 -11.295 -12.687 -13.627
  179    HG2  LYS  24           HG2      LYS  24 -12.588 -13.825 -11.432
  180    HG3  LYS  24           HG3      LYS  24 -13.375 -12.269 -11.698
  181    HD2  LYS  24           HD2      LYS  24 -13.290 -13.087 -14.220
  182    HD3  LYS  24           HD3      LYS  24 -13.263 -14.669 -13.441
  183    HE2  LYS  24           HE2      LYS  24 -15.276 -14.011 -12.150
  184    HE3  LYS  24           HE3      LYS  24 -15.332 -12.509 -13.070
  185    HZ1  LYS  24           HZ1      LYS  24 -15.269 -14.220 -15.063
  186    HZ2  LYS  24           HZ2      LYS  24 -16.724 -13.759 -14.323
  187    HZ3  LYS  24           HZ3      LYS  24 -15.984 -15.230 -13.905
  188    H    VAL  25           HN       VAL  25  -8.624 -11.199 -10.991
  189    HA   VAL  25           HA       VAL  25  -6.941 -11.188 -13.355
  190    HB   VAL  25           HB       VAL  25  -6.876  -9.577 -10.798
  191   HG11  VAL  25          HG11      VAL  25  -5.215  -8.180 -12.278
  192   HG12  VAL  25          HG12      VAL  25  -4.638  -9.537 -11.307
  193   HG13  VAL  25          HG13      VAL  25  -4.914  -9.743 -13.036
  194   HG21  VAL  25          HG21      VAL  25  -7.151  -7.822 -12.852
  195   HG22  VAL  25          HG22      VAL  25  -8.039  -9.216 -13.467
  196   HG23  VAL  25          HG23      VAL  25  -8.490  -8.495 -11.922
  197    HA   PRO  26           HA       PRO  26  -4.318 -14.344 -11.636
  198    HB2  PRO  26           HB2      PRO  26  -2.422 -13.595 -13.749
  199    HB3  PRO  26           HB3      PRO  26  -3.282 -15.117 -13.503
  200    HG2  PRO  26           HG2      PRO  26  -3.893 -13.439 -15.519
  201    HG3  PRO  26           HG3      PRO  26  -5.124 -14.421 -14.706
  202    HD2  PRO  26           HD2      PRO  26  -4.466 -11.520 -14.347
  203    HD3  PRO  26           HD3      PRO  26  -6.053 -12.316 -14.416
  204    H    GLY  27           HN       GLY  27  -3.444 -11.032 -12.000
  205    HA2  GLY  27           HA1      GLY  27  -0.783 -11.358 -10.889
  206    HA3  GLY  27           HA2      GLY  27  -1.532  -9.847 -11.374
  207    H    VAL  28           HN       VAL  28  -3.750 -11.396  -9.497
  208    HA   VAL  28           HA       VAL  28  -3.131  -9.673  -7.247
  209    HB   VAL  28           HB       VAL  28  -5.531 -11.327  -7.998
  210   HG11  VAL  28          HG11      VAL  28  -6.238  -9.938  -5.700
  211   HG12  VAL  28          HG12      VAL  28  -6.023 -11.682  -5.853
  212   HG13  VAL  28          HG13      VAL  28  -4.682 -10.672  -5.309
  213   HG21  VAL  28          HG21      VAL  28  -5.947  -8.598  -7.137
  214   HG22  VAL  28          HG22      VAL  28  -4.766  -8.698  -8.443
  215   HG23  VAL  28          HG23      VAL  28  -6.379  -9.380  -8.660
  216    H    GLN  29           HN       GLN  29  -2.151 -10.311  -5.453
  217    HA   GLN  29           HA       GLN  29  -1.748 -13.170  -4.983
  218    HB2  GLN  29           HB2      GLN  29   0.079 -11.271  -4.894
  219    HB3  GLN  29           HB3      GLN  29  -0.547 -11.029  -3.270
  220    HG2  GLN  29           HG2      GLN  29  -0.202 -13.708  -3.281
  221    HG3  GLN  29           HG3      GLN  29   1.094 -13.199  -4.363
  222   HE21  GLN  29          HE21      GLN  29   0.925 -14.244  -1.509
  223   HE22  GLN  29          HE22      GLN  29   1.924 -13.147  -0.618
  224    H    SER  30           HN       SER  30  -2.853 -10.244  -3.306
  225    HA   SER  30           HA       SER  30  -4.922 -11.783  -1.987
  226    HB2  SER  30           HB2      SER  30  -3.212 -10.087  -0.189
  227    HB3  SER  30           HB3      SER  30  -4.300 -11.408   0.234
  228    HG   SER  30           HG       SER  30  -2.653 -12.675  -1.123
  229    H    ALA  31           HN       ALA  31  -6.719 -10.605  -2.225
  230    HA   ALA  31           HA       ALA  31  -6.426  -7.669  -2.353
  231    HB1  ALA  31           HB1      ALA  31  -7.510  -7.663  -4.288
  232    HB2  ALA  31           HB2      ALA  31  -7.484  -9.426  -4.272
  233    HB3  ALA  31           HB3      ALA  31  -8.858  -8.559  -3.586
  234    H    LEU  32           HN       LEU  32  -7.156  -6.759  -0.551
  235    HA   LEU  32           HA       LEU  32  -9.569  -7.894   0.704
  236    HB2  LEU  32           HB2      LEU  32  -7.253  -6.420   1.962
  237    HB3  LEU  32           HB3      LEU  32  -8.736  -6.817   2.808
  238    HG   LEU  32           HG       LEU  32  -6.963  -8.912   1.564
  239   HD11  LEU  32          HD11      LEU  32  -6.341  -9.267   4.055
  240   HD12  LEU  32          HD12      LEU  32  -5.516  -8.015   3.127
  241   HD13  LEU  32          HD13      LEU  32  -6.816  -7.578   4.234
  242   HD21  LEU  32          HD21      LEU  32  -8.663  -9.473   3.902
  243   HD22  LEU  32          HD22      LEU  32  -9.521  -9.121   2.403
  244   HD23  LEU  32          HD23      LEU  32  -8.354 -10.441   2.461
  245    H    VAL  33           HN       VAL  33 -11.156  -6.688  -0.190
  246    HA   VAL  33           HA       VAL  33 -10.859  -3.784  -0.345
  247    HB   VAL  33           HB       VAL  33 -13.400  -5.218  -1.034
  248   HG11  VAL  33          HG11      VAL  33 -12.166  -2.621  -1.540
  249   HG12  VAL  33          HG12      VAL  33 -12.871  -3.366  -2.975
  250   HG13  VAL  33          HG13      VAL  33 -13.866  -3.090  -1.545
  251   HG21  VAL  33          HG21      VAL  33 -12.576  -5.667  -3.285
  252   HG22  VAL  33          HG22      VAL  33 -10.976  -5.083  -2.824
  253   HG23  VAL  33          HG23      VAL  33 -11.629  -6.542  -2.082
  254    H    SER  34           HN       SER  34 -11.842  -2.366   1.004
  255    HA   SER  34           HA       SER  34 -13.146  -3.554   3.339
  256    HB2  SER  34           HB2      SER  34 -11.650  -0.986   2.886
  257    HB3  SER  34           HB3      SER  34 -12.689  -1.197   4.296
  258    HG   SER  34           HG       SER  34 -11.337  -3.331   4.363
  259    H    TYR  35           HN       TYR  35 -15.220  -3.571   3.361
  260    HA   TYR  35           HA       TYR  35 -16.922  -2.066   1.701
  261    HB2  TYR  35           HB2      TYR  35 -18.365  -3.636   2.320
  262    HB3  TYR  35           HB3      TYR  35 -17.144  -4.284   3.397
  263    HD1  TYR  35           HD1      TYR  35 -19.966  -1.882   3.234
  264    HD2  TYR  35           HD2      TYR  35 -17.532  -4.323   5.727
  265    HE1  TYR  35           HE1      TYR  35 -21.447  -1.405   5.132
  266    HE2  TYR  35           HE2      TYR  35 -19.018  -3.863   7.635
  267    HH   TYR  35           HH       TYR  35 -21.857  -1.735   7.278
  268    HA   PRO  36           HA       PRO  36 -17.935   0.677   5.500
  269    HB2  PRO  36           HB2      PRO  36 -16.197   0.874   7.545
  270    HB3  PRO  36           HB3      PRO  36 -17.419  -0.399   7.476
  271    HG2  PRO  36           HG2      PRO  36 -14.515  -0.526   6.779
  272    HG3  PRO  36           HG3      PRO  36 -15.495  -1.687   7.694
  273    HD2  PRO  36           HD2      PRO  36 -14.866  -2.002   5.059
  274    HD3  PRO  36           HD3      PRO  36 -16.345  -2.653   5.795
  275    H    LYS  37           HN       LYS  37 -14.814   0.422   4.092
  276    HA   LYS  37           HA       LYS  37 -14.180   3.222   4.642
  277    HB2  LYS  37           HB2      LYS  37 -12.636   0.801   4.303
  278    HB3  LYS  37           HB3      LYS  37 -12.087   2.048   3.193
  279    HG2  LYS  37           HG2      LYS  37 -12.519   3.077   5.867
  280    HG3  LYS  37           HG3      LYS  37 -11.346   1.757   5.831
  281    HD2  LYS  37           HD2      LYS  37 -10.066   2.902   4.123
  282    HD3  LYS  37           HD3      LYS  37 -11.275   4.188   4.054
  283    HE2  LYS  37           HE2      LYS  37 -10.619   5.098   6.057
  284    HE3  LYS  37           HE3      LYS  37 -10.004   3.565   6.674
  285    HZ1  LYS  37           HZ1      LYS  37  -8.713   5.335   4.670
  286    HZ2  LYS  37           HZ2      LYS  37  -8.161   3.776   5.044
  287    HZ3  LYS  37           HZ3      LYS  37  -8.165   4.984   6.237
  288    H    GLY  38           HN       GLY  38 -15.131   1.034   2.132
  289    HA2  GLY  38           HA1      GLY  38 -15.703   1.411  -0.066
  290    HA3  GLY  38           HA2      GLY  38 -15.537   3.136   0.244
  291    H    THR  39           HN       THR  39 -13.017   0.809   0.873
  292    HA   THR  39           HA       THR  39 -11.536   1.770  -1.477
  293    HB   THR  39           HB       THR  39  -9.758   1.425   0.779
  294    HG1  THR  39           HG1      THR  39 -10.478   3.505   1.746
  295   HG21  THR  39          HG21      THR  39 -10.289   3.903  -0.843
  296   HG22  THR  39          HG22      THR  39  -9.333   2.550  -1.441
  297   HG23  THR  39          HG23      THR  39  -8.799   3.443  -0.018
  298    H    ALA  40           HN       ALA  40  -9.693   0.448  -2.030
  299    HA   ALA  40           HA       ALA  40 -10.017  -2.335  -1.114
  300    HB1  ALA  40           HB1      ALA  40  -8.632  -2.347  -3.550
  301    HB2  ALA  40           HB2      ALA  40 -10.295  -2.855  -3.257
  302    HB3  ALA  40           HB3      ALA  40  -9.952  -1.196  -3.752
  303    H    GLN  41           HN       GLN  41  -8.354  -3.215  -0.095
  304    HA   GLN  41           HA       GLN  41  -5.701  -1.952  -0.356
  305    HB2  GLN  41           HB2      GLN  41  -6.943  -3.490   1.934
  306    HB3  GLN  41           HB3      GLN  41  -5.234  -3.079   1.860
  307    HG2  GLN  41           HG2      GLN  41  -5.752  -1.199   2.903
  308    HG3  GLN  41           HG3      GLN  41  -6.516  -0.676   1.404
  309   HE21  GLN  41          HE21      GLN  41  -8.302  -3.222   2.288
  310   HE22  GLN  41          HE22      GLN  41  -9.511  -2.437   3.248
  311    H    LEU  42           HN       LEU  42  -4.753  -3.120  -1.964
  312    HA   LEU  42           HA       LEU  42  -4.975  -6.051  -1.742
  313    HB2  LEU  42           HB2      LEU  42  -4.272  -5.782  -4.300
  314    HB3  LEU  42           HB3      LEU  42  -5.939  -5.802  -3.763
  315    HG   LEU  42           HG       LEU  42  -4.939  -3.112  -3.676
  316   HD11  LEU  42          HD11      LEU  42  -5.039  -3.505  -6.459
  317   HD12  LEU  42          HD12      LEU  42  -3.677  -2.951  -5.486
  318   HD13  LEU  42          HD13      LEU  42  -3.880  -4.671  -5.820
  319   HD21  LEU  42          HD21      LEU  42  -6.820  -2.848  -5.362
  320   HD22  LEU  42          HD22      LEU  42  -7.098  -4.578  -5.161
  321   HD23  LEU  42          HD23      LEU  42  -7.255  -3.494  -3.778
  322    H    ALA  43           HN       ALA  43  -3.246  -7.332  -2.237
  323    HA   ALA  43           HA       ALA  43  -0.633  -6.014  -2.578
  324    HB1  ALA  43           HB1      ALA  43  -1.453  -7.876  -0.590
  325    HB2  ALA  43           HB2      ALA  43  -0.322  -8.701  -1.663
  326    HB3  ALA  43           HB3      ALA  43   0.154  -7.205  -0.857
  327    H    ILE  44           HN       ILE  44  -0.049  -6.243  -4.644
  328    HA   ILE  44           HA       ILE  44  -0.915  -8.678  -6.057
  329    HB   ILE  44           HB       ILE  44  -0.782  -7.213  -8.149
  330   HG12  ILE  44          HG12      ILE  44  -1.545  -4.811  -6.734
  331   HG13  ILE  44          HG13      ILE  44   0.076  -5.312  -6.262
  332   HG21  ILE  44          HG21      ILE  44  -3.076  -6.348  -7.792
  333   HG22  ILE  44          HG22      ILE  44  -2.878  -8.031  -7.304
  334   HG23  ILE  44          HG23      ILE  44  -2.930  -6.760  -6.082
  335   HD11  ILE  44          HD11      ILE  44  -0.940  -4.534  -8.963
  336   HD12  ILE  44          HD12      ILE  44   0.435  -3.896  -8.059
  337   HD13  ILE  44          HD13      ILE  44   0.524  -5.503  -8.781
  338    H    VAL  45           HN       VAL  45   0.422  -9.229  -7.950
  339    HA   VAL  45           HA       VAL  45   3.208  -9.252  -7.294
  340    HB   VAL  45           HB       VAL  45   1.940 -10.040  -9.929
  341   HG11  VAL  45          HG11      VAL  45   4.031 -11.761  -9.362
  342   HG12  VAL  45          HG12      VAL  45   4.061 -10.414 -10.501
  343   HG13  VAL  45          HG13      VAL  45   4.629 -10.183  -8.848
  344   HG21  VAL  45          HG21      VAL  45   1.497 -11.176  -7.361
  345   HG22  VAL  45          HG22      VAL  45   0.915 -11.734  -8.929
  346   HG23  VAL  45          HG23      VAL  45   2.463 -12.310  -8.308
  347    HA   PRO  46           HA       PRO  46   4.150  -5.325  -9.157
  348    HB2  PRO  46           HB2      PRO  46   6.857  -5.541  -9.177
  349    HB3  PRO  46           HB3      PRO  46   5.926  -5.240  -7.705
  350    HG2  PRO  46           HG2      PRO  46   7.041  -7.818  -8.742
  351    HG3  PRO  46           HG3      PRO  46   7.072  -7.169  -7.092
  352    HD2  PRO  46           HD2      PRO  46   5.292  -9.043  -7.863
  353    HD3  PRO  46           HD3      PRO  46   4.892  -7.794  -6.669
  354    H    GLY  47           HN       GLY  47   3.386  -7.359 -10.988
  355    HA2  GLY  47           HA1      GLY  47   5.065  -6.531 -13.268
  356    HA3  GLY  47           HA2      GLY  47   4.369  -8.148 -13.167
  357    H    THR  48           HN       THR  48   1.921  -7.352 -12.001
  358    HA   THR  48           HA       THR  48   0.425  -6.404 -14.243
  359    HB   THR  48           HB       THR  48  -1.133  -6.261 -11.880
  360    HG1  THR  48           HG1      THR  48   0.376  -7.452 -10.739
  361   HG21  THR  48          HG21      THR  48  -0.900  -8.094 -14.225
  362   HG22  THR  48          HG22      THR  48  -2.235  -7.044 -13.747
  363   HG23  THR  48          HG23      THR  48  -1.945  -8.552 -12.880
  364    H    SER  49           HN       SER  49  -0.167  -4.368 -14.691
  365    HA   SER  49           HA       SER  49   0.704  -2.249 -12.984
  366    HB2  SER  49           HB2      SER  49  -1.120  -1.604 -15.216
  367    HB3  SER  49           HB3      SER  49   0.454  -0.915 -14.813
  368    HG   SER  49           HG       SER  49   1.455  -2.676 -15.767
  369    HA   PRO  50           HA       PRO  50  -3.095  -2.331 -10.649
  370    HB2  PRO  50           HB2      PRO  50  -2.635  -0.097  -9.152
  371    HB3  PRO  50           HB3      PRO  50  -1.897  -1.665  -8.812
  372    HG2  PRO  50           HG2      PRO  50  -0.744   0.708 -10.223
  373    HG3  PRO  50           HG3      PRO  50   0.020  -0.377  -9.047
  374    HD2  PRO  50           HD2      PRO  50   0.443  -0.576 -11.719
  375    HD3  PRO  50           HD3      PRO  50   0.470  -1.985 -10.638
  376    H    ASP  51           HN       ASP  51  -2.059   0.067 -12.788
  377    HA   ASP  51           HA       ASP  51  -4.305   1.816 -12.621
  378    HB2  ASP  51           HB2      ASP  51  -2.309   2.711 -13.561
  379    HB3  ASP  51           HB3      ASP  51  -2.126   1.350 -14.658
  380    H    ALA  52           HN       ALA  52  -3.554  -1.201 -14.067
  381    HA   ALA  52           HA       ALA  52  -5.610  -1.113 -16.068
  382    HB1  ALA  52           HB1      ALA  52  -4.900  -3.789 -15.633
  383    HB2  ALA  52           HB2      ALA  52  -4.329  -2.720 -16.914
  384    HB3  ALA  52           HB3      ALA  52  -3.424  -2.849 -15.406
  385    H    LEU  53           HN       LEU  53  -5.246  -2.277 -12.820
  386    HA   LEU  53           HA       LEU  53  -7.704  -3.710 -12.679
  387    HB2  LEU  53           HB2      LEU  53  -6.294  -2.404 -10.358
  388    HB3  LEU  53           HB3      LEU  53  -7.334  -3.815 -10.334
  389    HG   LEU  53           HG       LEU  53  -4.652  -3.782 -11.714
  390   HD11  LEU  53          HD11      LEU  53  -4.220  -5.293  -9.541
  391   HD12  LEU  53          HD12      LEU  53  -3.842  -3.572  -9.619
  392   HD13  LEU  53          HD13      LEU  53  -5.342  -4.111  -8.864
  393   HD21  LEU  53          HD21      LEU  53  -4.903  -6.050 -11.990
  394   HD22  LEU  53          HD22      LEU  53  -6.055  -6.195 -10.661
  395   HD23  LEU  53          HD23      LEU  53  -6.563  -5.492 -12.196
  396    H    THR  54           HN       THR  54  -6.641  -0.463 -11.851
  397    HA   THR  54           HA       THR  54  -9.014   0.609 -10.894
  398    HB   THR  54           HB       THR  54  -6.980   2.039 -12.613
  399    HG1  THR  54           HG1      THR  54  -5.877   1.054 -10.923
  400   HG21  THR  54          HG21      THR  54  -8.921   3.401 -12.235
  401   HG22  THR  54          HG22      THR  54  -7.626   3.990 -11.193
  402   HG23  THR  54          HG23      THR  54  -8.921   3.005 -10.516
  403    H    ALA  55           HN       ALA  55  -7.772   0.550 -14.233
  404    HA   ALA  55           HA       ALA  55 -10.060   1.742 -15.392
  405    HB1  ALA  55           HB1      ALA  55  -9.154   0.985 -17.525
  406    HB2  ALA  55           HB2      ALA  55  -7.886   1.680 -16.516
  407    HB3  ALA  55           HB3      ALA  55  -8.021  -0.070 -16.682
  408    H    ALA  56           HN       ALA  56  -9.223  -1.581 -14.644
  409    HA   ALA  56           HA       ALA  56 -11.311  -2.830 -16.072
  410    HB1  ALA  56           HB1      ALA  56  -9.448  -4.119 -15.234
  411    HB2  ALA  56           HB2      ALA  56  -9.887  -3.732 -13.572
  412    HB3  ALA  56           HB3      ALA  56 -10.950  -4.743 -14.550
  413    H    VAL  57           HN       VAL  57 -11.143  -1.621 -12.731
  414    HA   VAL  57           HA       VAL  57 -13.791  -2.420 -12.066
  415    HB   VAL  57           HB       VAL  57 -12.084  -0.315 -10.757
  416   HG11  VAL  57          HG11      VAL  57 -13.972  -1.670  -9.049
  417   HG12  VAL  57          HG12      VAL  57 -13.729   0.058  -9.305
  418   HG13  VAL  57          HG13      VAL  57 -14.789  -0.852 -10.383
  419   HG21  VAL  57          HG21      VAL  57 -12.042  -2.402  -9.065
  420   HG22  VAL  57          HG22      VAL  57 -12.139  -3.257 -10.604
  421   HG23  VAL  57          HG23      VAL  57 -10.818  -2.128 -10.305
  422    H    ALA  58           HN       ALA  58 -12.378   0.633 -13.230
  423    HA   ALA  58           HA       ALA  58 -14.779   2.116 -13.164
  424    HB1  ALA  58           HB1      ALA  58 -13.199   3.010 -15.343
  425    HB2  ALA  58           HB2      ALA  58 -13.359   3.729 -13.741
  426    HB3  ALA  58           HB3      ALA  58 -12.107   2.526 -14.046
  427    H    GLY  59           HN       GLY  59 -13.508  -0.211 -15.410
  428    HA2  GLY  59           HA1      GLY  59 -15.514   0.388 -17.428
  429    HA3  GLY  59           HA2      GLY  59 -14.279  -0.858 -17.522
  430    H    LEU  60           HN       LEU  60 -15.873  -0.949 -14.558
  431    HA   LEU  60           HA       LEU  60 -17.467  -3.225 -15.451
  432    HB2  LEU  60           HB2      LEU  60 -16.052  -2.523 -13.026
  433    HB3  LEU  60           HB3      LEU  60 -17.683  -3.066 -12.693
  434    HG   LEU  60           HG       LEU  60 -16.057  -4.734 -14.529
  435   HD11  LEU  60          HD11      LEU  60 -15.659  -5.186 -11.624
  436   HD12  LEU  60          HD12      LEU  60 -14.613  -5.578 -12.989
  437   HD13  LEU  60          HD13      LEU  60 -14.713  -3.919 -12.402
  438   HD21  LEU  60          HD21      LEU  60 -17.315  -6.498 -13.606
  439   HD22  LEU  60          HD22      LEU  60 -17.778  -5.540 -12.201
  440   HD23  LEU  60          HD23      LEU  60 -18.450  -5.161 -13.786
  441    H    GLY  61           HN       GLY  61 -17.931  -0.114 -15.302
  442    HA2  GLY  61           HA1      GLY  61 -20.103   0.843 -15.633
  443    HA3  GLY  61           HA2      GLY  61 -20.767  -0.385 -14.565
  444    H    TYR  62           HN       TYR  62 -18.113   0.394 -12.992
  445    HA   TYR  62           HA       TYR  62 -19.414   2.527 -11.450
  446    HB2  TYR  62           HB2      TYR  62 -17.078   0.880 -10.507
  447    HB3  TYR  62           HB3      TYR  62 -18.245   1.769  -9.546
  448    HD1  TYR  62           HD2      TYR  62 -20.711   0.890  -9.682
  449    HD2  TYR  62           HD1      TYR  62 -17.292  -1.424 -10.718
  450    HE1  TYR  62           HE2      TYR  62 -22.020  -1.170  -9.378
  451    HE2  TYR  62           HE1      TYR  62 -18.597  -3.490 -10.428
  452    HH   TYR  62           HH       TYR  62 -20.811  -4.274 -10.359
  453    H    LYS  63           HN       LYS  63 -17.037   3.294 -10.058
  454    HA   LYS  63           HA       LYS  63 -15.122   4.002 -12.145
  455    HB2  LYS  63           HB2      LYS  63 -16.766   5.914 -11.720
  456    HB3  LYS  63           HB3      LYS  63 -16.035   6.046 -10.125
  457    HG2  LYS  63           HG2      LYS  63 -13.832   6.076 -11.682
  458    HG3  LYS  63           HG3      LYS  63 -15.000   6.855 -12.753
  459    HD2  LYS  63           HD2      LYS  63 -15.404   8.590 -11.230
  460    HD3  LYS  63           HD3      LYS  63 -14.691   7.695  -9.886
  461    HE2  LYS  63           HE2      LYS  63 -12.545   8.190 -10.521
  462    HE3  LYS  63           HE3      LYS  63 -12.976   8.354 -12.222
  463    HZ1  LYS  63           HZ1      LYS  63 -13.359  10.520 -11.983
  464    HZ2  LYS  63           HZ2      LYS  63 -12.537  10.403 -10.503
  465    HZ3  LYS  63           HZ3      LYS  63 -14.229  10.313 -10.541
  466    H    ALA  64           HN       ALA  64 -13.067   3.759 -11.482
  467    HA   ALA  64           HA       ALA  64 -12.638   3.401  -8.590
  468    HB1  ALA  64           HB1      ALA  64 -12.144   1.298  -9.238
  469    HB2  ALA  64           HB2      ALA  64 -11.787   1.772 -10.898
  470    HB3  ALA  64           HB3      ALA  64 -10.586   2.023  -9.631
  471    H    THR  65           HN       THR  65 -10.790   4.245  -7.698
  472    HA   THR  65           HA       THR  65  -9.030   5.801  -9.469
  473    HB   THR  65           HB       THR  65  -8.933   6.995  -6.908
  474    HG1  THR  65           HG1      THR  65 -11.480   6.129  -7.622
  475   HG21  THR  65          HG21      THR  65  -8.548   8.453  -8.621
  476   HG22  THR  65          HG22      THR  65 -10.248   8.822  -8.333
  477   HG23  THR  65          HG23      THR  65  -9.791   7.745  -9.651
  478    H    LEU  66           HN       LEU  66  -7.005   6.424  -7.759
  479    HA   LEU  66           HA       LEU  66  -6.306   4.036  -6.265
  480    HB2  LEU  66           HB2      LEU  66  -4.280   3.576  -7.526
  481    HB3  LEU  66           HB3      LEU  66  -5.693   3.423  -8.550
  482    HG   LEU  66           HG       LEU  66  -4.480   6.083  -8.658
  483   HD11  LEU  66          HD11      LEU  66  -2.891   4.007 -10.066
  484   HD12  LEU  66          HD12      LEU  66  -2.417   5.608  -9.497
  485   HD13  LEU  66          HD13      LEU  66  -2.574   4.275  -8.352
  486   HD21  LEU  66          HD21      LEU  66  -5.998   4.310 -10.286
  487   HD22  LEU  66          HD22      LEU  66  -5.601   6.005 -10.569
  488   HD23  LEU  66          HD23      LEU  66  -4.520   4.737 -11.149
  489    H    ALA  67           HN       ALA  67  -4.992   4.477  -4.617
  490    HA   ALA  67           HA       ALA  67  -3.250   6.805  -4.684
  491    HB1  ALA  67           HB1      ALA  67  -4.430   7.318  -2.297
  492    HB2  ALA  67           HB2      ALA  67  -4.833   8.146  -3.801
  493    HB3  ALA  67           HB3      ALA  67  -5.818   6.791  -3.248
  494    H    ASP  68           HN       ASP  68  -2.403   7.006  -2.191
  495    HA   ASP  68           HA       ASP  68  -2.308   4.516  -0.815
  496    HB2  ASP  68           HB2      ASP  68  -0.465   4.550  -2.722
  497    HB3  ASP  68           HB3      ASP  68   0.416   5.491  -1.520
  498    H    ALA  69           HN       ALA  69  -1.601   4.710   1.286
  499    HA   ALA  69           HA       ALA  69  -0.416   7.046   2.364
  500    HB1  ALA  69           HB1      ALA  69  -2.486   7.688   3.728
  501    HB2  ALA  69           HB2      ALA  69  -2.443   8.195   2.039
  502    HB3  ALA  69           HB3      ALA  69  -3.411   6.800   2.517
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1   2.572  -1.661  -1.265
    2    H2   MET   1           H2       MET   1   3.631  -0.732  -0.331
    3    H3   MET   1           H3       MET   1   3.122  -0.171  -1.850
    4    HA   MET   1           HA       MET   1   1.689  -0.239   0.698
    5    HB2  MET   1           HB2      MET   1   2.819   1.752  -0.743
    6    HB3  MET   1           HB3      MET   1   1.192   1.788  -1.409
    7    HG2  MET   1           HG2      MET   1   0.535   2.980   0.322
    8    HG3  MET   1           HG3      MET   1   0.921   1.628   1.386
    9    HE1  MET   1           HE1      MET   1   3.352   5.372   0.508
   10    HE2  MET   1           HE2      MET   1   3.725   4.036  -0.583
   11    HE3  MET   1           HE3      MET   1   2.074   4.645  -0.471
   12    H    THR   2           HN       THR   2   0.898   0.203  -2.744
   13    HA   THR   2           HA       THR   2  -0.844  -0.459  -4.026
   14    HB   THR   2           HB       THR   2  -1.407  -2.961  -2.647
   15    HG1  THR   2           HG1      THR   2   0.634  -3.055  -1.892
   16   HG21  THR   2          HG21      THR   2  -0.875  -1.921  -5.314
   17   HG22  THR   2          HG22      THR   2  -1.842  -3.309  -4.816
   18   HG23  THR   2          HG23      THR   2  -0.100  -3.480  -5.027
   19    H    HIS   3           HN       HIS   3  -2.264   1.210  -3.134
   20    HA   HIS   3           HA       HIS   3  -4.580  -0.078  -1.846
   21    HB2  HIS   3           HB2      HIS   3  -3.387   2.609  -1.284
   22    HB3  HIS   3           HB3      HIS   3  -5.091   2.328  -1.014
   23    HD1  HIS   3           HD1      HIS   3  -3.097  -0.635  -0.202
   24    HD2  HIS   3           HD2      HIS   3  -4.300   2.845   1.743
   25    HE1  HIS   3           HE1      HIS   3  -2.784  -1.082   2.255
   26    HE2  HIS   3           HE2      HIS   3  -3.560   1.019   3.419
   27    H    LEU   4           HN       LEU   4  -6.553   0.430  -2.661
   28    HA   LEU   4           HA       LEU   4  -6.595   2.092  -5.097
   29    HB2  LEU   4           HB2      LEU   4  -6.679  -0.458  -5.424
   30    HB3  LEU   4           HB3      LEU   4  -8.283  -0.375  -4.721
   31    HG   LEU   4           HG       LEU   4  -8.309   1.555  -6.731
   32   HD11  LEU   4          HD11      LEU   4  -6.507   0.937  -7.975
   33   HD12  LEU   4          HD12      LEU   4  -6.562  -0.738  -7.425
   34   HD13  LEU   4          HD13      LEU   4  -7.705  -0.173  -8.643
   35   HD21  LEU   4          HD21      LEU   4 -10.264   0.428  -6.553
   36   HD22  LEU   4          HD22      LEU   4  -9.571  -0.501  -7.884
   37   HD23  LEU   4          HD23      LEU   4  -9.471  -1.116  -6.235
   38    H    LYS   5           HN       LYS   5  -8.638   3.125  -5.543
   39    HA   LYS   5           HA       LYS   5 -10.236   3.455  -3.090
   40    HB2  LYS   5           HB2      LYS   5  -8.842   5.424  -3.948
   41    HB3  LYS   5           HB3      LYS   5  -9.995   5.516  -5.272
   42    HG2  LYS   5           HG2      LYS   5 -11.802   5.731  -3.544
   43    HG3  LYS   5           HG3      LYS   5 -10.521   5.897  -2.340
   44    HD2  LYS   5           HD2      LYS   5 -10.071   8.009  -2.946
   45    HD3  LYS   5           HD3      LYS   5 -10.190   7.637  -4.668
   46    HE2  LYS   5           HE2      LYS   5 -12.459   8.050  -4.734
   47    HE3  LYS   5           HE3      LYS   5 -12.671   7.735  -3.013
   48    HZ1  LYS   5           HZ1      LYS   5 -12.864  10.003  -3.126
   49    HZ2  LYS   5           HZ2      LYS   5 -11.707  10.171  -4.352
   50    HZ3  LYS   5           HZ3      LYS   5 -11.216   9.844  -2.757
   51    H    ILE   6           HN       ILE   6 -12.342   3.084  -3.172
   52    HA   ILE   6           HA       ILE   6 -13.514   2.267  -5.731
   53    HB   ILE   6           HB       ILE   6 -14.405   1.844  -2.872
   54   HG12  ILE   6          HG12      ILE   6 -12.548   0.417  -3.510
   55   HG13  ILE   6          HG13      ILE   6 -14.016  -0.550  -3.408
   56   HG21  ILE   6          HG21      ILE   6 -15.771   0.444  -5.097
   57   HG22  ILE   6          HG22      ILE   6 -16.389   0.964  -3.528
   58   HG23  ILE   6          HG23      ILE   6 -16.175   2.140  -4.825
   59   HD11  ILE   6          HD11      ILE   6 -12.805  -1.256  -5.322
   60   HD12  ILE   6          HD12      ILE   6 -14.208  -0.355  -5.895
   61   HD13  ILE   6          HD13      ILE   6 -12.615   0.402  -5.893
   62    H    THR   7           HN       THR   7 -15.171   3.416  -6.671
   63    HA   THR   7           HA       THR   7 -16.452   5.527  -5.102
   64    HB   THR   7           HB       THR   7 -16.048   6.612  -7.674
   65    HG1  THR   7           HG1      THR   7 -14.202   4.968  -7.503
   66   HG21  THR   7          HG21      THR   7 -16.288   7.883  -5.600
   67   HG22  THR   7          HG22      THR   7 -14.808   8.342  -6.444
   68   HG23  THR   7          HG23      THR   7 -14.730   7.278  -5.039
   69    H    GLY   8           HN       GLY   8 -18.542   5.957  -5.688
   70    HA2  GLY   8           HA1      GLY   8 -20.299   6.090  -7.304
   71    HA3  GLY   8           HA2      GLY   8 -19.545   4.769  -8.181
   72    H    MET   9           HN       MET   9 -19.153   2.943  -6.144
   73    HA   MET   9           HA       MET   9 -21.843   1.938  -5.886
   74    HB2  MET   9           HB2      MET   9 -19.368   0.654  -4.744
   75    HB3  MET   9           HB3      MET   9 -20.890  -0.104  -5.189
   76    HG2  MET   9           HG2      MET   9 -20.468   0.084  -7.457
   77    HG3  MET   9           HG3      MET   9 -19.190   1.273  -7.221
   78    HE1  MET   9           HE1      MET   9 -17.232   0.507  -8.296
   79    HE2  MET   9           HE2      MET   9 -16.646   0.644  -6.639
   80    HE3  MET   9           HE3      MET   9 -16.183  -0.742  -7.627
   81    H    THR  10           HN       THR  10 -22.931   1.491  -3.969
   82    HA   THR  10           HA       THR  10 -22.541   3.385  -1.902
   83    HB   THR  10           HB       THR  10 -24.240   1.111  -1.206
   84    HG1  THR  10           HG1      THR  10 -25.095   0.832  -3.114
   85   HG21  THR  10          HG21      THR  10 -25.731   3.460  -1.642
   86   HG22  THR  10          HG22      THR  10 -24.180   3.971  -0.976
   87   HG23  THR  10          HG23      THR  10 -25.173   2.807  -0.100
   88    H    CYS  11           HN       CYS  11 -22.484  -0.195  -1.758
   89    HA   CYS  11           HA       CYS  11 -20.206  -0.391  -0.114
   90    HB2  CYS  11           HB2      CYS  11 -21.399  -1.017   1.998
   91    HB3  CYS  11           HB3      CYS  11 -21.469   0.692   1.599
   92    HG   CYS  11           HG       CYS  11 -24.048  -1.382   0.744
   93    H    ASP  12           HN       ASP  12 -20.156  -2.589   1.000
   94    HA   ASP  12           HA       ASP  12 -20.186  -4.895   0.653
   95    HB2  ASP  12           HB2      ASP  12 -21.452  -4.479   2.628
   96    HB3  ASP  12           HB3      ASP  12 -22.898  -4.103   1.696
   97    H    SER  13           HN       SER  13 -20.327  -6.411  -0.754
   98    HA   SER  13           HA       SER  13 -21.027  -7.757  -2.443
   99    HB2  SER  13           HB2      SER  13 -23.496  -6.018  -2.693
  100    HB3  SER  13           HB3      SER  13 -23.224  -7.562  -3.500
  101    HG   SER  13           HG       SER  13 -23.383  -7.139  -0.690
  102    H    CYS  14           HN       CYS  14 -21.584  -4.291  -2.961
  103    HA   CYS  14           HA       CYS  14 -20.723  -4.241  -5.638
  104    HB2  CYS  14           HB2      CYS  14 -20.518  -2.110  -3.493
  105    HB3  CYS  14           HB3      CYS  14 -20.283  -1.821  -5.215
  106    HG   CYS  14           HG       CYS  14 -22.915  -2.409  -5.921
  107    H    ALA  15           HN       ALA  15 -19.004  -3.962  -2.568
  108    HA   ALA  15           HA       ALA  15 -16.427  -3.664  -3.786
  109    HB1  ALA  15           HB1      ALA  15 -15.697  -4.305  -1.372
  110    HB2  ALA  15           HB2      ALA  15 -16.495  -2.758  -1.652
  111    HB3  ALA  15           HB3      ALA  15 -17.409  -4.116  -0.995
  112    H    ALA  16           HN       ALA  16 -18.488  -6.294  -2.939
  113    HA   ALA  16           HA       ALA  16 -16.448  -8.289  -2.699
  114    HB1  ALA  16           HB1      ALA  16 -19.118  -8.171  -2.053
  115    HB2  ALA  16           HB2      ALA  16 -19.091  -9.270  -3.432
  116    HB3  ALA  16           HB3      ALA  16 -18.110  -9.619  -2.009
  117    H    HIS  17           HN       HIS  17 -18.767  -7.355  -5.211
  118    HA   HIS  17           HA       HIS  17 -17.928  -9.240  -7.134
  119    HB2  HIS  17           HB2      HIS  17 -19.857  -7.198  -6.977
  120    HB3  HIS  17           HB3      HIS  17 -18.846  -6.795  -8.362
  121    HD1  HIS  17           HD1      HIS  17 -21.867  -8.371  -7.801
  122    HD2  HIS  17           HD2      HIS  17 -18.437  -9.546  -9.843
  123    HE1  HIS  17           HE1      HIS  17 -22.603 -10.182  -9.385
  124    HE2  HIS  17           HE2      HIS  17 -20.481 -11.000 -10.478
  125    H    VAL  18           HN       VAL  18 -16.884  -5.946  -6.415
  126    HA   VAL  18           HA       VAL  18 -15.080  -5.714  -8.578
  127    HB   VAL  18           HB       VAL  18 -15.316  -4.296  -5.936
  128   HG11  VAL  18          HG11      VAL  18 -13.247  -3.491  -6.013
  129   HG12  VAL  18          HG12      VAL  18 -12.900  -4.547  -7.383
  130   HG13  VAL  18          HG13      VAL  18 -13.509  -2.914  -7.659
  131   HG21  VAL  18          HG21      VAL  18 -16.896  -3.412  -7.323
  132   HG22  VAL  18          HG22      VAL  18 -15.525  -2.384  -7.741
  133   HG23  VAL  18          HG23      VAL  18 -15.960  -3.739  -8.782
  134    H    LYS  19           HN       LYS  19 -14.665  -6.789  -5.209
  135    HA   LYS  19           HA       LYS  19 -11.925  -7.339  -5.329
  136    HB2  LYS  19           HB2      LYS  19 -13.109  -7.328  -3.212
  137    HB3  LYS  19           HB3      LYS  19 -14.108  -8.682  -3.724
  138    HG2  LYS  19           HG2      LYS  19 -11.619  -9.727  -4.006
  139    HG3  LYS  19           HG3      LYS  19 -11.390  -8.647  -2.631
  140    HD2  LYS  19           HD2      LYS  19 -12.014 -10.822  -1.819
  141    HD3  LYS  19           HD3      LYS  19 -13.346  -9.699  -1.537
  142    HE2  LYS  19           HE2      LYS  19 -14.654 -11.199  -2.537
  143    HE3  LYS  19           HE3      LYS  19 -13.876 -10.720  -4.047
  144    HZ1  LYS  19           HZ1      LYS  19 -12.156 -12.465  -3.507
  145    HZ2  LYS  19           HZ2      LYS  19 -13.697 -13.042  -3.925
  146    HZ3  LYS  19           HZ3      LYS  19 -13.212 -13.016  -2.297
  147    H    GLU  20           HN       GLU  20 -14.723  -9.327  -6.171
  148    HA   GLU  20           HA       GLU  20 -13.307 -11.670  -6.808
  149    HB2  GLU  20           HB2      GLU  20 -15.980 -10.845  -6.815
  150    HB3  GLU  20           HB3      GLU  20 -15.642 -11.276  -8.486
  151    HG2  GLU  20           HG2      GLU  20 -16.541 -13.163  -7.270
  152    HG3  GLU  20           HG3      GLU  20 -14.882 -13.476  -7.772
  153    H    ALA  21           HN       ALA  21 -14.293  -8.916  -8.782
  154    HA   ALA  21           HA       ALA  21 -13.330  -9.923 -11.238
  155    HB1  ALA  21           HB1      ALA  21 -14.405  -7.422 -10.243
  156    HB2  ALA  21           HB2      ALA  21 -13.121  -7.169 -11.426
  157    HB3  ALA  21           HB3      ALA  21 -14.530  -8.145 -11.846
  158    H    LEU  22           HN       LEU  22 -11.859  -8.124  -8.626
  159    HA   LEU  22           HA       LEU  22  -9.379  -7.602  -9.910
  160    HB2  LEU  22           HB2      LEU  22 -10.342  -7.618  -7.079
  161    HB3  LEU  22           HB3      LEU  22  -8.619  -7.551  -7.391
  162    HG   LEU  22           HG       LEU  22 -10.490  -5.570  -8.655
  163   HD11  LEU  22          HD11      LEU  22 -11.032  -4.914  -6.572
  164   HD12  LEU  22          HD12      LEU  22  -9.680  -5.775  -5.836
  165   HD13  LEU  22          HD13      LEU  22  -9.420  -4.199  -6.582
  166   HD21  LEU  22          HD21      LEU  22  -8.585  -4.865  -9.560
  167   HD22  LEU  22          HD22      LEU  22  -8.004  -4.471  -7.941
  168   HD23  LEU  22          HD23      LEU  22  -7.665  -6.055  -8.639
  169    H    GLU  23           HN       GLU  23 -10.494 -10.141  -7.713
  170    HA   GLU  23           HA       GLU  23  -7.966 -11.466  -7.666
  171    HB2  GLU  23           HB2      GLU  23 -10.706 -12.124  -6.654
  172    HB3  GLU  23           HB3      GLU  23  -9.428 -13.336  -6.625
  173    HG2  GLU  23           HG2      GLU  23  -8.030 -11.608  -5.402
  174    HG3  GLU  23           HG3      GLU  23  -9.526 -10.697  -5.210
  175    H    LYS  24           HN       LYS  24 -10.511 -11.400  -9.891
  176    HA   LYS  24           HA       LYS  24 -10.118 -13.996 -11.031
  177    HB2  LYS  24           HB2      LYS  24 -11.766 -11.678 -11.545
  178    HB3  LYS  24           HB3      LYS  24 -11.043 -12.252 -13.041
  179    HG2  LYS  24           HG2      LYS  24 -13.241 -13.243 -12.639
  180    HG3  LYS  24           HG3      LYS  24 -11.964 -14.460 -12.684
  181    HD2  LYS  24           HD2      LYS  24 -12.071 -14.848 -10.405
  182    HD3  LYS  24           HD3      LYS  24 -12.803 -13.277 -10.069
  183    HE2  LYS  24           HE2      LYS  24 -14.884 -14.060 -10.370
  184    HE3  LYS  24           HE3      LYS  24 -14.425 -14.997 -11.794
  185    HZ1  LYS  24           HZ1      LYS  24 -13.362 -16.590 -10.155
  186    HZ2  LYS  24           HZ2      LYS  24 -15.056 -16.565 -10.194
  187    HZ3  LYS  24           HZ3      LYS  24 -14.224 -15.777  -8.941
  188    H    VAL  25           HN       VAL  25  -8.461 -11.010 -11.110
  189    HA   VAL  25           HA       VAL  25  -6.851 -11.672 -13.429
  190    HB   VAL  25           HB       VAL  25  -6.674  -9.460 -11.373
  191   HG11  VAL  25          HG11      VAL  25  -4.433  -9.830 -12.054
  192   HG12  VAL  25          HG12      VAL  25  -4.906 -10.041 -13.739
  193   HG13  VAL  25          HG13      VAL  25  -5.010  -8.448 -12.986
  194   HG21  VAL  25          HG21      VAL  25  -8.321  -9.766 -13.577
  195   HG22  VAL  25          HG22      VAL  25  -7.981  -8.263 -12.719
  196   HG23  VAL  25          HG23      VAL  25  -7.036  -8.698 -14.142
  197    HA   PRO  26           HA       PRO  26  -4.384 -14.458 -10.968
  198    HB2  PRO  26           HB2      PRO  26  -2.348 -14.755 -12.785
  199    HB3  PRO  26           HB3      PRO  26  -3.883 -15.625 -12.855
  200    HG2  PRO  26           HG2      PRO  26  -3.030 -13.169 -14.336
  201    HG3  PRO  26           HG3      PRO  26  -3.926 -14.581 -14.929
  202    HD2  PRO  26           HD2      PRO  26  -5.164 -12.276 -14.331
  203    HD3  PRO  26           HD3      PRO  26  -5.927 -13.847 -14.011
  204    H    GLY  27           HN       GLY  27  -3.227 -11.434 -12.237
  205    HA2  GLY  27           HA1      GLY  27  -0.682 -11.460 -10.955
  206    HA3  GLY  27           HA2      GLY  27  -1.505 -10.043 -11.596
  207    H    VAL  28           HN       VAL  28  -3.864 -10.922  -9.805
  208    HA   VAL  28           HA       VAL  28  -3.014  -9.317  -7.537
  209    HB   VAL  28           HB       VAL  28  -5.723 -10.445  -8.269
  210   HG11  VAL  28          HG11      VAL  28  -5.185  -8.319  -6.210
  211   HG12  VAL  28          HG12      VAL  28  -6.677  -9.213  -6.504
  212   HG13  VAL  28          HG13      VAL  28  -5.283 -10.030  -5.797
  213   HG21  VAL  28          HG21      VAL  28  -4.415  -8.447  -9.532
  214   HG22  VAL  28          HG22      VAL  28  -6.171  -8.541  -9.390
  215   HG23  VAL  28          HG23      VAL  28  -5.248  -7.538  -8.270
  216    H    GLN  29           HN       GLN  29  -2.386 -10.149  -5.666
  217    HA   GLN  29           HA       GLN  29  -2.678 -13.020  -5.225
  218    HB2  GLN  29           HB2      GLN  29  -1.058 -10.911  -3.788
  219    HB3  GLN  29           HB3      GLN  29  -1.109 -12.603  -3.313
  220    HG2  GLN  29           HG2      GLN  29  -0.076 -11.483  -5.905
  221    HG3  GLN  29           HG3      GLN  29   0.873 -12.187  -4.597
  222   HE21  GLN  29          HE21      GLN  29  -0.685 -12.775  -7.506
  223   HE22  GLN  29          HE22      GLN  29  -0.628 -14.502  -7.483
  224    H    SER  30           HN       SER  30  -3.659  -9.950  -3.876
  225    HA   SER  30           HA       SER  30  -5.792 -11.248  -2.423
  226    HB2  SER  30           HB2      SER  30  -4.220  -9.335  -0.762
  227    HB3  SER  30           HB3      SER  30  -5.177 -10.728  -0.265
  228    HG   SER  30           HG       SER  30  -3.433 -12.014  -1.273
  229    H    ALA  31           HN       ALA  31  -7.450  -9.769  -1.815
  230    HA   ALA  31           HA       ALA  31  -7.117  -6.982  -2.620
  231    HB1  ALA  31           HB1      ALA  31  -9.493  -7.305  -3.742
  232    HB2  ALA  31           HB2      ALA  31  -8.000  -7.576  -4.640
  233    HB3  ALA  31           HB3      ALA  31  -8.890  -8.947  -3.975
  234    H    LEU  32           HN       LEU  32  -7.234  -6.677  -0.328
  235    HA   LEU  32           HA       LEU  32  -9.640  -7.481   1.056
  236    HB2  LEU  32           HB2      LEU  32  -7.145  -6.020   1.843
  237    HB3  LEU  32           HB3      LEU  32  -8.543  -6.018   2.900
  238    HG   LEU  32           HG       LEU  32  -8.080  -8.714   2.176
  239   HD11  LEU  32          HD11      LEU  32  -5.591  -7.737   3.456
  240   HD12  LEU  32          HD12      LEU  32  -5.866  -9.150   2.437
  241   HD13  LEU  32          HD13      LEU  32  -5.739  -7.549   1.708
  242   HD21  LEU  32          HD21      LEU  32  -7.123  -7.942   4.804
  243   HD22  LEU  32          HD22      LEU  32  -8.685  -7.219   4.422
  244   HD23  LEU  32          HD23      LEU  32  -8.480  -8.971   4.352
  245    H    VAL  33           HN       VAL  33 -10.917  -6.259  -0.607
  246    HA   VAL  33           HA       VAL  33 -10.997  -3.405  -0.442
  247    HB   VAL  33           HB       VAL  33 -13.293  -5.105  -1.388
  248   HG11  VAL  33          HG11      VAL  33 -13.474  -2.595  -1.159
  249   HG12  VAL  33          HG12      VAL  33 -12.282  -2.480  -2.455
  250   HG13  VAL  33          HG13      VAL  33 -13.840  -3.251  -2.756
  251   HG21  VAL  33          HG21      VAL  33 -12.018  -4.652  -3.685
  252   HG22  VAL  33          HG22      VAL  33 -10.620  -4.757  -2.616
  253   HG23  VAL  33          HG23      VAL  33 -11.749  -6.107  -2.726
  254    H    SER  34           HN       SER  34 -11.812  -2.256   1.155
  255    HA   SER  34           HA       SER  34 -13.454  -3.651   3.134
  256    HB2  SER  34           HB2      SER  34 -12.102  -0.976   3.481
  257    HB3  SER  34           HB3      SER  34 -12.689  -2.067   4.738
  258    HG   SER  34           HG       SER  34 -10.678  -2.853   2.905
  259    H    TYR  35           HN       TYR  35 -15.521  -3.439   2.896
  260    HA   TYR  35           HA       TYR  35 -16.877  -1.466   1.450
  261    HB2  TYR  35           HB2      TYR  35 -18.519  -2.942   1.681
  262    HB3  TYR  35           HB3      TYR  35 -17.507  -3.862   2.779
  263    HD1  TYR  35           HD1      TYR  35 -19.933  -1.018   2.765
  264    HD2  TYR  35           HD2      TYR  35 -18.254  -4.269   4.930
  265    HE1  TYR  35           HE1      TYR  35 -21.582  -0.671   4.553
  266    HE2  TYR  35           HE2      TYR  35 -19.894  -3.928   6.726
  267    HH   TYR  35           HH       TYR  35 -22.450  -2.762   6.685
  268    HA   PRO  36           HA       PRO  36 -17.850   0.770   5.607
  269    HB2  PRO  36           HB2      PRO  36 -15.687   0.132   7.455
  270    HB3  PRO  36           HB3      PRO  36 -17.430   0.004   7.696
  271    HG2  PRO  36           HG2      PRO  36 -15.807  -2.158   7.499
  272    HG3  PRO  36           HG3      PRO  36 -17.501  -2.172   6.972
  273    HD2  PRO  36           HD2      PRO  36 -15.006  -1.900   5.338
  274    HD3  PRO  36           HD3      PRO  36 -16.481  -2.833   4.999
  275    H    LYS  37           HN       LYS  37 -14.869   0.381   4.084
  276    HA   LYS  37           HA       LYS  37 -13.868   2.980   5.020
  277    HB2  LYS  37           HB2      LYS  37 -12.607   0.498   4.552
  278    HB3  LYS  37           HB3      LYS  37 -12.050   1.580   3.283
  279    HG2  LYS  37           HG2      LYS  37 -10.800   2.784   4.685
  280    HG3  LYS  37           HG3      LYS  37 -12.027   2.768   5.954
  281    HD2  LYS  37           HD2      LYS  37 -11.373   0.338   6.335
  282    HD3  LYS  37           HD3      LYS  37  -9.969   0.670   5.319
  283    HE2  LYS  37           HE2      LYS  37  -9.099   1.089   7.396
  284    HE3  LYS  37           HE3      LYS  37  -9.665   2.699   6.950
  285    HZ1  LYS  37           HZ1      LYS  37 -10.428   2.350   9.115
  286    HZ2  LYS  37           HZ2      LYS  37 -10.924   0.758   8.798
  287    HZ3  LYS  37           HZ3      LYS  37 -11.791   2.065   8.145
  288    H    GLY  38           HN       GLY  38 -14.871   1.161   2.203
  289    HA2  GLY  38           HA1      GLY  38 -15.484   1.923   0.100
  290    HA3  GLY  38           HA2      GLY  38 -15.063   3.556   0.603
  291    H    THR  39           HN       THR  39 -12.778   1.049   1.155
  292    HA   THR  39           HA       THR  39 -11.170   1.990  -1.125
  293    HB   THR  39           HB       THR  39  -9.443   1.440   1.096
  294    HG1  THR  39           HG1      THR  39 -10.183   2.862   2.603
  295   HG21  THR  39          HG21      THR  39  -8.357   2.982  -0.092
  296   HG22  THR  39          HG22      THR  39  -9.470   4.196   0.540
  297   HG23  THR  39          HG23      THR  39  -9.824   3.383  -0.985
  298    H    ALA  40           HN       ALA  40  -9.359   0.544  -1.668
  299    HA   ALA  40           HA       ALA  40  -9.974  -2.242  -0.927
  300    HB1  ALA  40           HB1      ALA  40  -8.850  -1.344  -3.572
  301    HB2  ALA  40           HB2      ALA  40  -9.448  -2.945  -3.137
  302    HB3  ALA  40           HB3      ALA  40 -10.570  -1.592  -3.272
  303    H    GLN  41           HN       GLN  41  -8.424  -3.121   0.242
  304    HA   GLN  41           HA       GLN  41  -5.672  -2.178  -0.038
  305    HB2  GLN  41           HB2      GLN  41  -7.078  -3.904   1.997
  306    HB3  GLN  41           HB3      GLN  41  -5.325  -3.781   1.941
  307    HG2  GLN  41           HG2      GLN  41  -5.706  -2.147   3.446
  308    HG3  GLN  41           HG3      GLN  41  -5.918  -1.182   1.983
  309   HE21  GLN  41          HE21      GLN  41  -7.578  -2.927   4.523
  310   HE22  GLN  41          HE22      GLN  41  -9.091  -2.094   4.364
  311    H    LEU  42           HN       LEU  42  -5.657  -3.135  -2.209
  312    HA   LEU  42           HA       LEU  42  -5.594  -6.040  -2.277
  313    HB2  LEU  42           HB2      LEU  42  -5.727  -5.922  -4.635
  314    HB3  LEU  42           HB3      LEU  42  -6.879  -4.777  -3.997
  315    HG   LEU  42           HG       LEU  42  -6.012  -3.659  -5.818
  316   HD11  LEU  42          HD11      LEU  42  -4.394  -2.802  -3.450
  317   HD12  LEU  42          HD12      LEU  42  -4.340  -1.955  -4.996
  318   HD13  LEU  42          HD13      LEU  42  -5.861  -2.076  -4.107
  319   HD21  LEU  42          HD21      LEU  42  -3.170  -3.819  -5.542
  320   HD22  LEU  42          HD22      LEU  42  -3.868  -5.439  -5.573
  321   HD23  LEU  42          HD23      LEU  42  -4.198  -4.311  -6.887
  322    H    ALA  43           HN       ALA  43  -3.861  -7.129  -3.448
  323    HA   ALA  43           HA       ALA  43  -1.297  -5.720  -3.441
  324    HB1  ALA  43           HB1      ALA  43  -0.505  -6.814  -1.677
  325    HB2  ALA  43           HB2      ALA  43  -2.064  -7.611  -1.464
  326    HB3  ALA  43           HB3      ALA  43  -0.824  -8.352  -2.479
  327    H    ILE  44           HN       ILE  44  -0.256  -6.096  -5.277
  328    HA   ILE  44           HA       ILE  44  -1.086  -8.413  -6.897
  329    HB   ILE  44           HB       ILE  44  -0.036  -6.884  -8.783
  330   HG12  ILE  44          HG12      ILE  44  -1.130  -4.501  -7.983
  331   HG13  ILE  44          HG13      ILE  44  -0.392  -5.074  -6.491
  332   HG21  ILE  44          HG21      ILE  44  -2.234  -6.195  -9.390
  333   HG22  ILE  44          HG22      ILE  44  -2.372  -7.762  -8.589
  334   HG23  ILE  44          HG23      ILE  44  -2.786  -6.284  -7.718
  335   HD11  ILE  44          HD11      ILE  44   1.499  -5.473  -8.536
  336   HD12  ILE  44          HD12      ILE  44   0.830  -3.855  -8.752
  337   HD13  ILE  44          HD13      ILE  44   1.548  -4.312  -7.209
  338    H    VAL  45           HN       VAL  45   0.611  -9.136  -8.466
  339    HA   VAL  45           HA       VAL  45   3.199  -9.340  -7.167
  340    HB   VAL  45           HB       VAL  45   2.445 -10.378  -9.905
  341   HG11  VAL  45          HG11      VAL  45   4.886 -10.252  -8.850
  342   HG12  VAL  45          HG12      VAL  45   4.357 -11.770  -8.124
  343   HG13  VAL  45          HG13      VAL  45   4.365 -11.587  -9.880
  344   HG21  VAL  45          HG21      VAL  45   0.846 -11.193  -8.209
  345   HG22  VAL  45          HG22      VAL  45   1.841 -12.481  -8.887
  346   HG23  VAL  45          HG23      VAL  45   2.199 -11.843  -7.282
  347    HA   PRO  46           HA       PRO  46   5.007  -5.697  -9.040
  348    HB2  PRO  46           HB2      PRO  46   7.347  -7.566  -9.077
  349    HB3  PRO  46           HB3      PRO  46   7.271  -5.874  -8.569
  350    HG2  PRO  46           HG2      PRO  46   7.307  -7.819  -6.761
  351    HG3  PRO  46           HG3      PRO  46   6.284  -6.391  -6.533
  352    HD2  PRO  46           HD2      PRO  46   5.522  -9.166  -7.273
  353    HD3  PRO  46           HD3      PRO  46   4.605  -7.940  -6.375
  354    H    GLY  47           HN       GLY  47   4.284  -5.426 -11.062
  355    HA2  GLY  47           HA1      GLY  47   5.294  -5.767 -13.414
  356    HA3  GLY  47           HA2      GLY  47   4.895  -7.454 -13.095
  357    H    THR  48           HN       THR  48   2.501  -7.059 -11.689
  358    HA   THR  48           HA       THR  48   0.662  -6.446 -13.806
  359    HB   THR  48           HB       THR  48  -0.222  -6.725 -10.964
  360    HG1  THR  48           HG1      THR  48   1.028  -8.691 -12.564
  361   HG21  THR  48          HG21      THR  48  -1.946  -6.399 -12.608
  362   HG22  THR  48          HG22      THR  48  -2.009  -8.079 -12.079
  363   HG23  THR  48          HG23      THR  48  -1.277  -7.671 -13.631
  364    H    SER  49           HN       SER  49  -0.041  -4.519 -14.310
  365    HA   SER  49           HA       SER  49   0.711  -2.299 -12.651
  366    HB2  SER  49           HB2      SER  49  -0.787  -1.877 -15.178
  367    HB3  SER  49           HB3      SER  49   0.639  -1.043 -14.559
  368    HG   SER  49           HG       SER  49   1.800  -3.045 -15.026
  369    HA   PRO  50           HA       PRO  50  -3.298  -2.057 -10.727
  370    HB2  PRO  50           HB2      PRO  50  -2.361   0.594  -9.831
  371    HB3  PRO  50           HB3      PRO  50  -2.852  -0.802  -8.867
  372    HG2  PRO  50           HG2      PRO  50  -0.286  -0.063  -9.036
  373    HG3  PRO  50           HG3      PRO  50  -0.750  -1.776  -8.971
  374    HD2  PRO  50           HD2      PRO  50   0.039  -0.112 -11.341
  375    HD3  PRO  50           HD3      PRO  50   0.516  -1.773 -10.924
  376    H    ASP  51           HN       ASP  51  -2.073  -0.029 -13.112
  377    HA   ASP  51           HA       ASP  51  -4.233   1.826 -13.294
  378    HB2  ASP  51           HB2      ASP  51  -2.360   2.639 -14.378
  379    HB3  ASP  51           HB3      ASP  51  -1.873   1.053 -14.955
  380    H    ALA  52           HN       ALA  52  -3.531  -1.377 -14.304
  381    HA   ALA  52           HA       ALA  52  -5.624  -1.578 -16.249
  382    HB1  ALA  52           HB1      ALA  52  -4.918  -3.726 -16.618
  383    HB2  ALA  52           HB2      ALA  52  -3.445  -3.029 -15.945
  384    HB3  ALA  52           HB3      ALA  52  -4.510  -3.997 -14.924
  385    H    LEU  53           HN       LEU  53  -5.216  -2.259 -12.854
  386    HA   LEU  53           HA       LEU  53  -7.708  -3.574 -12.479
  387    HB2  LEU  53           HB2      LEU  53  -6.240  -2.021 -10.362
  388    HB3  LEU  53           HB3      LEU  53  -7.267  -3.427 -10.162
  389    HG   LEU  53           HG       LEU  53  -4.593  -3.492 -11.550
  390   HD11  LEU  53          HD11      LEU  53  -4.118  -2.929  -9.310
  391   HD12  LEU  53          HD12      LEU  53  -5.338  -4.044  -8.692
  392   HD13  LEU  53          HD13      LEU  53  -3.868  -4.670  -9.442
  393   HD21  LEU  53          HD21      LEU  53  -6.189  -5.259 -12.184
  394   HD22  LEU  53          HD22      LEU  53  -4.780  -5.887 -11.332
  395   HD23  LEU  53          HD23      LEU  53  -6.319  -5.722 -10.488
  396    H    THR  54           HN       THR  54  -6.571  -0.252 -12.045
  397    HA   THR  54           HA       THR  54  -8.950   0.934 -11.213
  398    HB   THR  54           HB       THR  54  -6.902   2.164 -13.078
  399    HG1  THR  54           HG1      THR  54  -5.866   1.365 -11.222
  400   HG21  THR  54          HG21      THR  54  -7.797   4.075 -11.289
  401   HG22  THR  54          HG22      THR  54  -9.258   3.180 -11.708
  402   HG23  THR  54          HG23      THR  54  -8.284   3.923 -12.978
  403    H    ALA  55           HN       ALA  55  -7.716   0.403 -14.505
  404    HA   ALA  55           HA       ALA  55  -9.983   1.436 -15.837
  405    HB1  ALA  55           HB1      ALA  55  -9.055   0.499 -17.826
  406    HB2  ALA  55           HB2      ALA  55  -7.711   1.079 -16.840
  407    HB3  ALA  55           HB3      ALA  55  -8.082  -0.646 -16.901
  408    H    ALA  56           HN       ALA  56  -9.185  -1.753 -14.603
  409    HA   ALA  56           HA       ALA  56 -11.290  -3.182 -15.808
  410    HB1  ALA  56           HB1      ALA  56 -10.948  -4.510 -13.468
  411    HB2  ALA  56           HB2      ALA  56  -9.922  -4.711 -14.888
  412    HB3  ALA  56           HB3      ALA  56  -9.425  -3.630 -13.587
  413    H    VAL  57           HN       VAL  57 -11.125  -1.513 -12.664
  414    HA   VAL  57           HA       VAL  57 -13.820  -2.146 -11.977
  415    HB   VAL  57           HB       VAL  57 -12.122   0.069 -10.858
  416   HG11  VAL  57          HG11      VAL  57 -13.909   0.589  -9.654
  417   HG12  VAL  57          HG12      VAL  57 -14.816  -0.749 -10.360
  418   HG13  VAL  57          HG13      VAL  57 -13.835  -1.012  -8.918
  419   HG21  VAL  57          HG21      VAL  57 -12.169  -2.013  -9.030
  420   HG22  VAL  57          HG22      VAL  57 -11.915  -2.807 -10.584
  421   HG23  VAL  57          HG23      VAL  57 -10.810  -1.542 -10.049
  422    H    ALA  58           HN       ALA  58 -12.254   0.733 -13.395
  423    HA   ALA  58           HA       ALA  58 -14.613   2.272 -13.602
  424    HB1  ALA  58           HB1      ALA  58 -13.320   3.799 -14.642
  425    HB2  ALA  58           HB2      ALA  58 -12.008   2.765 -14.075
  426    HB3  ALA  58           HB3      ALA  58 -12.601   2.611 -15.729
  427    H    GLY  59           HN       GLY  59 -13.393  -0.388 -15.438
  428    HA2  GLY  59           HA1      GLY  59 -15.265   0.040 -17.634
  429    HA3  GLY  59           HA2      GLY  59 -14.073  -1.248 -17.515
  430    H    LEU  60           HN       LEU  60 -15.738  -0.896 -14.637
  431    HA   LEU  60           HA       LEU  60 -17.545  -3.103 -15.284
  432    HB2  LEU  60           HB2      LEU  60 -16.073  -2.262 -12.929
  433    HB3  LEU  60           HB3      LEU  60 -17.752  -2.598 -12.567
  434    HG   LEU  60           HG       LEU  60 -16.252  -4.616 -14.149
  435   HD11  LEU  60          HD11      LEU  60 -14.582  -4.463 -12.604
  436   HD12  LEU  60          HD12      LEU  60 -15.650  -3.855 -11.340
  437   HD13  LEU  60          HD13      LEU  60 -15.669  -5.568 -11.764
  438   HD21  LEU  60          HD21      LEU  60 -17.629  -5.949 -12.265
  439   HD22  LEU  60          HD22      LEU  60 -18.597  -4.476 -12.362
  440   HD23  LEU  60          HD23      LEU  60 -18.324  -5.450 -13.808
  441    H    GLY  61           HN       GLY  61 -17.691  -0.043 -15.688
  442    HA2  GLY  61           HA1      GLY  61 -19.562   1.329 -15.984
  443    HA3  GLY  61           HA2      GLY  61 -20.504   0.216 -15.000
  444    H    TYR  62           HN       TYR  62 -17.904   0.536 -13.215
  445    HA   TYR  62           HA       TYR  62 -19.095   2.661 -11.591
  446    HB2  TYR  62           HB2      TYR  62 -17.090   0.524 -10.835
  447    HB3  TYR  62           HB3      TYR  62 -17.846   1.667  -9.732
  448    HD1  TYR  62           HD2      TYR  62 -20.617   1.639 -10.286
  449    HD2  TYR  62           HD1      TYR  62 -17.878  -1.611 -10.486
  450    HE1  TYR  62           HE2      TYR  62 -22.467   0.066  -9.903
  451    HE2  TYR  62           HE1      TYR  62 -19.722  -3.192 -10.104
  452    HH   TYR  62           HH       TYR  62 -22.362  -3.093 -10.547
  453    H    LYS  63           HN       LYS  63 -16.886   3.269  -9.989
  454    HA   LYS  63           HA       LYS  63 -14.970   4.382 -11.925
  455    HB2  LYS  63           HB2      LYS  63 -15.297   6.083  -9.607
  456    HB3  LYS  63           HB3      LYS  63 -15.401   6.493 -11.312
  457    HG2  LYS  63           HG2      LYS  63 -17.729   5.860 -11.365
  458    HG3  LYS  63           HG3      LYS  63 -17.644   5.306  -9.692
  459    HD2  LYS  63           HD2      LYS  63 -17.544   7.448  -8.846
  460    HD3  LYS  63           HD3      LYS  63 -16.879   8.117 -10.338
  461    HE2  LYS  63           HE2      LYS  63 -19.641   6.981 -10.311
  462    HE3  LYS  63           HE3      LYS  63 -19.354   8.602  -9.678
  463    HZ1  LYS  63           HZ1      LYS  63 -19.878   8.089 -12.233
  464    HZ2  LYS  63           HZ2      LYS  63 -18.185   8.030 -12.278
  465    HZ3  LYS  63           HZ3      LYS  63 -18.967   9.426 -11.722
  466    H    ALA  64           HN       ALA  64 -12.952   3.786 -11.477
  467    HA   ALA  64           HA       ALA  64 -12.301   3.082  -8.701
  468    HB1  ALA  64           HB1      ALA  64 -11.082   2.244 -11.314
  469    HB2  ALA  64           HB2      ALA  64 -10.286   1.973  -9.764
  470    HB3  ALA  64           HB3      ALA  64 -11.855   1.237 -10.090
  471    H    THR  65           HN       THR  65 -10.504   3.927  -7.704
  472    HA   THR  65           HA       THR  65  -8.882   5.885  -9.158
  473    HB   THR  65           HB       THR  65  -9.154   6.949  -6.569
  474    HG1  THR  65           HG1      THR  65 -11.452   5.713  -7.401
  475   HG21  THR  65          HG21      THR  65  -8.800   8.140  -8.734
  476   HG22  THR  65          HG22      THR  65 -10.036   8.873  -7.710
  477   HG23  THR  65          HG23      THR  65 -10.508   7.888  -9.095
  478    H    LEU  66           HN       LEU  66  -7.382   6.668  -6.805
  479    HA   LEU  66           HA       LEU  66  -6.370   4.167  -5.718
  480    HB2  LEU  66           HB2      LEU  66  -4.817   5.894  -7.632
  481    HB3  LEU  66           HB3      LEU  66  -4.008   4.879  -6.455
  482    HG   LEU  66           HG       LEU  66  -6.010   3.501  -8.118
  483   HD11  LEU  66          HD11      LEU  66  -4.814   5.210  -9.622
  484   HD12  LEU  66          HD12      LEU  66  -3.390   4.196  -9.395
  485   HD13  LEU  66          HD13      LEU  66  -4.843   3.522 -10.131
  486   HD21  LEU  66          HD21      LEU  66  -3.878   1.992  -8.293
  487   HD22  LEU  66          HD22      LEU  66  -3.317   2.987  -6.949
  488   HD23  LEU  66          HD23      LEU  66  -4.808   2.060  -6.795
  489    H    ALA  67           HN       ALA  67  -5.892   4.476  -3.699
  490    HA   ALA  67           HA       ALA  67  -4.944   7.119  -2.813
  491    HB1  ALA  67           HB1      ALA  67  -7.105   5.396  -1.737
  492    HB2  ALA  67           HB2      ALA  67  -6.064   6.200  -0.563
  493    HB3  ALA  67           HB3      ALA  67  -6.957   7.154  -1.745
  494    H    ASP  68           HN       ASP  68  -3.076   5.541  -3.616
  495    HA   ASP  68           HA       ASP  68  -2.200   3.412  -2.086
  496    HB2  ASP  68           HB2      ASP  68  -1.310   4.071  -4.317
  497    HB3  ASP  68           HB3      ASP  68  -0.468   5.409  -3.544
  498    H    ALA  69           HN       ALA  69  -1.310   6.815  -1.843
  499    HA   ALA  69           HA       ALA  69  -0.556   6.329   0.953
  500    HB1  ALA  69           HB1      ALA  69   1.524   6.905   0.336
  501    HB2  ALA  69           HB2      ALA  69   0.981   7.601  -1.190
  502    HB3  ALA  69           HB3      ALA  69   0.888   8.549   0.295
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1   0.865  -4.300  -0.417
    2    H2   MET   1           H2       MET   1   0.363  -3.496  -1.821
    3    H3   MET   1           H3       MET   1  -0.708  -3.679  -0.519
    4    HA   MET   1           HA       MET   1   0.572  -2.245   0.854
    5    HB2  MET   1           HB2      MET   1   2.726  -3.010  -0.473
    6    HB3  MET   1           HB3      MET   1   2.383  -1.569  -1.423
    7    HG2  MET   1           HG2      MET   1   3.752  -0.654   0.125
    8    HG3  MET   1           HG3      MET   1   2.220  -0.471   0.976
    9    HE1  MET   1           HE1      MET   1   5.763  -1.192   2.120
   10    HE2  MET   1           HE2      MET   1   4.499  -0.003   2.435
   11    HE3  MET   1           HE3      MET   1   4.930  -1.180   3.675
   12    H    THR   2           HN       THR   2   0.286  -1.784  -2.661
   13    HA   THR   2           HA       THR   2  -0.539   0.922  -2.504
   14    HB   THR   2           HB       THR   2  -1.137  -1.017  -4.739
   15    HG1  THR   2           HG1      THR   2   1.223   0.560  -4.417
   16   HG21  THR   2          HG21      THR   2  -0.472   1.910  -4.963
   17   HG22  THR   2          HG22      THR   2  -2.126   1.351  -4.710
   18   HG23  THR   2          HG23      THR   2  -1.240   0.863  -6.155
   19    H    HIS   3           HN       HIS   3  -2.525   1.805  -2.265
   20    HA   HIS   3           HA       HIS   3  -4.764  -0.037  -1.798
   21    HB2  HIS   3           HB2      HIS   3  -4.738   2.855  -0.972
   22    HB3  HIS   3           HB3      HIS   3  -5.699   1.539  -0.324
   23    HD1  HIS   3           HD1      HIS   3  -2.857   3.561   0.488
   24    HD2  HIS   3           HD2      HIS   3  -3.912  -0.421   1.108
   25    HE1  HIS   3           HE1      HIS   3  -1.418   2.761   2.385
   26    HE2  HIS   3           HE2      HIS   3  -1.928   0.305   2.606
   27    H    LEU   4           HN       LEU   4  -6.501   0.027  -3.089
   28    HA   LEU   4           HA       LEU   4  -6.600   2.136  -5.134
   29    HB2  LEU   4           HB2      LEU   4  -7.068  -0.663  -5.216
   30    HB3  LEU   4           HB3      LEU   4  -8.610   0.122  -5.500
   31    HG   LEU   4           HG       LEU   4  -7.212   1.541  -7.229
   32   HD11  LEU   4          HD11      LEU   4  -5.200  -0.050  -6.333
   33   HD12  LEU   4          HD12      LEU   4  -5.740  -0.941  -7.756
   34   HD13  LEU   4          HD13      LEU   4  -5.233   0.741  -7.909
   35   HD21  LEU   4          HD21      LEU   4  -9.127  -0.157  -7.539
   36   HD22  LEU   4          HD22      LEU   4  -8.096   0.219  -8.919
   37   HD23  LEU   4          HD23      LEU   4  -7.850  -1.277  -8.015
   38    H    LYS   5           HN       LYS   5  -8.836   2.968  -5.658
   39    HA   LYS   5           HA       LYS   5 -10.349   3.212  -3.139
   40    HB2  LYS   5           HB2      LYS   5  -9.206   5.245  -4.848
   41    HB3  LYS   5           HB3      LYS   5 -10.935   5.476  -4.655
   42    HG2  LYS   5           HG2      LYS   5  -9.175   5.010  -2.283
   43    HG3  LYS   5           HG3      LYS   5  -9.337   6.615  -2.997
   44    HD2  LYS   5           HD2      LYS   5 -11.939   5.835  -2.811
   45    HD3  LYS   5           HD3      LYS   5 -11.235   5.055  -1.394
   46    HE2  LYS   5           HE2      LYS   5 -11.544   7.022  -0.381
   47    HE3  LYS   5           HE3      LYS   5 -10.120   7.543  -1.284
   48    HZ1  LYS   5           HZ1      LYS   5 -11.568   8.383  -3.019
   49    HZ2  LYS   5           HZ2      LYS   5 -11.953   9.091  -1.528
   50    HZ3  LYS   5           HZ3      LYS   5 -12.943   7.870  -2.166
   51    H    ILE   6           HN       ILE   6 -12.444   2.863  -3.183
   52    HA   ILE   6           HA       ILE   6 -13.643   2.089  -5.736
   53    HB   ILE   6           HB       ILE   6 -14.026   1.260  -2.941
   54   HG12  ILE   6          HG12      ILE   6 -14.667  -0.845  -4.001
   55   HG13  ILE   6          HG13      ILE   6 -14.760  -0.049  -5.568
   56   HG21  ILE   6          HG21      ILE   6 -16.517   1.179  -4.586
   57   HG22  ILE   6          HG22      ILE   6 -16.317   0.977  -2.846
   58   HG23  ILE   6          HG23      ILE   6 -16.165   2.578  -3.573
   59   HD11  ILE   6          HD11      ILE   6 -12.670  -0.719  -5.873
   60   HD12  ILE   6          HD12      ILE   6 -12.201   0.514  -4.703
   61   HD13  ILE   6          HD13      ILE   6 -12.476  -1.146  -4.173
   62    H    THR   7           HN       THR   7 -15.116   3.337  -6.720
   63    HA   THR   7           HA       THR   7 -16.262   5.566  -5.193
   64    HB   THR   7           HB       THR   7 -15.782   6.518  -7.808
   65    HG1  THR   7           HG1      THR   7 -14.141   4.730  -7.697
   66   HG21  THR   7          HG21      THR   7 -14.106   7.980  -6.506
   67   HG22  THR   7          HG22      THR   7 -14.657   7.096  -5.081
   68   HG23  THR   7          HG23      THR   7 -15.803   8.043  -6.029
   69    H    GLY   8           HN       GLY   8 -18.223   6.376  -5.972
   70    HA2  GLY   8           HA1      GLY   8 -20.094   6.436  -7.388
   71    HA3  GLY   8           HA2      GLY   8 -19.460   5.049  -8.264
   72    H    MET   9           HN       MET   9 -19.045   3.275  -6.179
   73    HA   MET   9           HA       MET   9 -21.783   2.448  -5.740
   74    HB2  MET   9           HB2      MET   9 -19.200   1.060  -5.032
   75    HB3  MET   9           HB3      MET   9 -20.808   0.369  -4.879
   76    HG2  MET   9           HG2      MET   9 -21.095   0.214  -7.166
   77    HG3  MET   9           HG3      MET   9 -19.846   1.410  -7.509
   78    HE1  MET   9           HE1      MET   9 -17.015   0.481  -7.860
   79    HE2  MET   9           HE2      MET   9 -17.571   1.060  -6.289
   80    HE3  MET   9           HE3      MET   9 -16.648  -0.439  -6.400
   81    H    THR  10           HN       THR  10 -22.275   1.395  -3.577
   82    HA   THR  10           HA       THR  10 -21.862   3.353  -1.511
   83    HB   THR  10           HB       THR  10 -23.225   1.123  -0.495
   84    HG1  THR  10           HG1      THR  10 -24.538   1.728  -2.888
   85   HG21  THR  10          HG21      THR  10 -25.166   2.597  -0.562
   86   HG22  THR  10          HG22      THR  10 -24.338   3.649  -1.710
   87   HG23  THR  10          HG23      THR  10 -23.730   3.491  -0.061
   88    H    CYS  11           HN       CYS  11 -21.896  -0.160  -1.172
   89    HA   CYS  11           HA       CYS  11 -19.379  -0.703  -0.221
   90    HB2  CYS  11           HB2      CYS  11 -19.788  -0.622   2.252
   91    HB3  CYS  11           HB3      CYS  11 -19.590   0.944   1.482
   92    HG   CYS  11           HG       CYS  11 -22.779  -0.036   1.699
   93    H    ASP  12           HN       ASP  12 -19.234  -2.850   0.219
   94    HA   ASP  12           HA       ASP  12 -19.806  -5.038   0.346
   95    HB2  ASP  12           HB2      ASP  12 -21.047  -4.373   2.413
   96    HB3  ASP  12           HB3      ASP  12 -22.486  -4.133   1.425
   97    H    SER  13           HN       SER  13 -20.637  -6.570  -1.012
   98    HA   SER  13           HA       SER  13 -21.488  -7.412  -2.938
   99    HB2  SER  13           HB2      SER  13 -23.511  -5.173  -3.016
  100    HB3  SER  13           HB3      SER  13 -23.656  -6.803  -3.676
  101    HG   SER  13           HG       SER  13 -23.929  -7.617  -1.662
  102    H    CYS  14           HN       CYS  14 -21.736  -3.865  -3.182
  103    HA   CYS  14           HA       CYS  14 -20.852  -3.614  -5.820
  104    HB2  CYS  14           HB2      CYS  14 -20.265  -1.657  -3.591
  105    HB3  CYS  14           HB3      CYS  14 -20.507  -1.293  -5.297
  106    HG   CYS  14           HG       CYS  14 -22.977  -0.668  -4.990
  107    H    ALA  15           HN       ALA  15 -19.107  -3.578  -2.760
  108    HA   ALA  15           HA       ALA  15 -16.530  -3.326  -3.987
  109    HB1  ALA  15           HB1      ALA  15 -15.654  -3.274  -1.848
  110    HB2  ALA  15           HB2      ALA  15 -17.280  -2.641  -1.592
  111    HB3  ALA  15           HB3      ALA  15 -16.914  -4.319  -1.193
  112    H    ALA  16           HN       ALA  16 -18.659  -5.919  -3.320
  113    HA   ALA  16           HA       ALA  16 -16.679  -7.966  -3.018
  114    HB1  ALA  16           HB1      ALA  16 -18.400  -9.313  -2.513
  115    HB2  ALA  16           HB2      ALA  16 -19.347  -7.826  -2.478
  116    HB3  ALA  16           HB3      ALA  16 -19.324  -8.823  -3.933
  117    H    HIS  17           HN       HIS  17 -18.881  -7.005  -5.649
  118    HA   HIS  17           HA       HIS  17 -17.918  -8.820  -7.560
  119    HB2  HIS  17           HB2      HIS  17 -19.977  -7.136  -7.587
  120    HB3  HIS  17           HB3      HIS  17 -18.827  -6.123  -8.454
  121    HD1  HIS  17           HD1      HIS  17 -20.067  -6.301 -10.693
  122    HD2  HIS  17           HD2      HIS  17 -18.921  -9.981  -9.115
  123    HE1  HIS  17           HE1      HIS  17 -20.399  -7.970 -12.546
  124    HE2  HIS  17           HE2      HIS  17 -19.921 -10.212 -11.495
  125    H    VAL  18           HN       VAL  18 -16.898  -5.552  -6.698
  126    HA   VAL  18           HA       VAL  18 -14.908  -5.279  -8.684
  127    HB   VAL  18           HB       VAL  18 -15.220  -3.998  -5.967
  128   HG11  VAL  18          HG11      VAL  18 -13.525  -2.330  -6.847
  129   HG12  VAL  18          HG12      VAL  18 -12.892  -3.894  -6.336
  130   HG13  VAL  18          HG13      VAL  18 -13.100  -3.546  -8.051
  131   HG21  VAL  18          HG21      VAL  18 -15.329  -2.220  -8.208
  132   HG22  VAL  18          HG22      VAL  18 -16.443  -3.562  -8.464
  133   HG23  VAL  18          HG23      VAL  18 -16.570  -2.576  -7.007
  134    H    LYS  19           HN       LYS  19 -14.781  -6.422  -5.324
  135    HA   LYS  19           HA       LYS  19 -12.052  -6.914  -5.135
  136    HB2  LYS  19           HB2      LYS  19 -13.748  -7.018  -3.278
  137    HB3  LYS  19           HB3      LYS  19 -14.230  -8.595  -3.885
  138    HG2  LYS  19           HG2      LYS  19 -11.450  -8.715  -3.597
  139    HG3  LYS  19           HG3      LYS  19 -12.054  -7.897  -2.156
  140    HD2  LYS  19           HD2      LYS  19 -12.378  -9.990  -1.398
  141    HD3  LYS  19           HD3      LYS  19 -13.845  -9.917  -2.380
  142    HE2  LYS  19           HE2      LYS  19 -13.056 -11.398  -3.872
  143    HE3  LYS  19           HE3      LYS  19 -11.440 -10.701  -3.859
  144    HZ1  LYS  19           HZ1      LYS  19 -10.899 -12.580  -2.812
  145    HZ2  LYS  19           HZ2      LYS  19 -12.499 -12.925  -2.362
  146    HZ3  LYS  19           HZ3      LYS  19 -11.574 -11.849  -1.432
  147    H    GLU  20           HN       GLU  20 -14.642  -9.127  -6.149
  148    HA   GLU  20           HA       GLU  20 -12.919 -11.288  -6.713
  149    HB2  GLU  20           HB2      GLU  20 -15.687 -10.679  -7.745
  150    HB3  GLU  20           HB3      GLU  20 -14.861 -12.216  -7.962
  151    HG2  GLU  20           HG2      GLU  20 -14.764 -11.593  -5.211
  152    HG3  GLU  20           HG3      GLU  20 -16.415 -11.310  -5.761
  153    H    ALA  21           HN       ALA  21 -14.123  -8.629  -8.676
  154    HA   ALA  21           HA       ALA  21 -13.205  -9.573 -11.173
  155    HB1  ALA  21           HB1      ALA  21 -14.357  -7.764 -11.772
  156    HB2  ALA  21           HB2      ALA  21 -14.307  -7.119 -10.131
  157    HB3  ALA  21           HB3      ALA  21 -12.984  -6.788 -11.250
  158    H    LEU  22           HN       LEU  22 -11.702  -7.723  -8.597
  159    HA   LEU  22           HA       LEU  22  -9.236  -7.225  -9.899
  160    HB2  LEU  22           HB2      LEU  22  -9.932  -7.406  -6.965
  161    HB3  LEU  22           HB3      LEU  22  -8.392  -6.846  -7.579
  162    HG   LEU  22           HG       LEU  22 -11.019  -5.511  -8.209
  163   HD11  LEU  22          HD11      LEU  22  -9.539  -5.506  -5.775
  164   HD12  LEU  22          HD12      LEU  22  -9.395  -3.919  -6.529
  165   HD13  LEU  22          HD13      LEU  22 -10.990  -4.594  -6.190
  166   HD21  LEU  22          HD21      LEU  22  -9.774  -3.801  -9.171
  167   HD22  LEU  22          HD22      LEU  22  -8.282  -4.311  -8.383
  168   HD23  LEU  22          HD23      LEU  22  -8.944  -5.260  -9.715
  169    H    GLU  23           HN       GLU  23 -10.306  -9.717  -7.609
  170    HA   GLU  23           HA       GLU  23  -7.794 -11.043  -7.565
  171    HB2  GLU  23           HB2      GLU  23 -10.401 -11.366  -6.318
  172    HB3  GLU  23           HB3      GLU  23  -9.652 -12.907  -6.717
  173    HG2  GLU  23           HG2      GLU  23  -7.616 -12.174  -5.531
  174    HG3  GLU  23           HG3      GLU  23  -8.461 -10.706  -5.053
  175    H    LYS  24           HN       LYS  24 -10.322 -11.042  -9.829
  176    HA   LYS  24           HA       LYS  24  -9.814 -13.636 -10.931
  177    HB2  LYS  24           HB2      LYS  24 -11.695 -11.618 -11.370
  178    HB3  LYS  24           HB3      LYS  24 -10.774 -11.692 -12.864
  179    HG2  LYS  24           HG2      LYS  24 -11.581 -14.297 -11.784
  180    HG3  LYS  24           HG3      LYS  24 -12.911 -13.254 -12.296
  181    HD2  LYS  24           HD2      LYS  24 -12.511 -14.095 -14.343
  182    HD3  LYS  24           HD3      LYS  24 -11.144 -12.978 -14.365
  183    HE2  LYS  24           HE2      LYS  24  -9.934 -14.826 -14.785
  184    HE3  LYS  24           HE3      LYS  24 -10.070 -15.096 -13.048
  185    HZ1  LYS  24           HZ1      LYS  24 -12.130 -16.398 -13.561
  186    HZ2  LYS  24           HZ2      LYS  24 -10.686 -17.098 -14.115
  187    HZ3  LYS  24           HZ3      LYS  24 -11.716 -16.302 -15.203
  188    H    VAL  25           HN       VAL  25  -8.220 -10.644 -10.952
  189    HA   VAL  25           HA       VAL  25  -6.653 -11.180 -13.332
  190    HB   VAL  25           HB       VAL  25  -6.487  -9.033 -11.209
  191   HG11  VAL  25          HG11      VAL  25  -4.881  -7.936 -12.851
  192   HG12  VAL  25          HG12      VAL  25  -4.250  -9.288 -11.912
  193   HG13  VAL  25          HG13      VAL  25  -4.722  -9.527 -13.595
  194   HG21  VAL  25          HG21      VAL  25  -8.246  -9.254 -13.249
  195   HG22  VAL  25          HG22      VAL  25  -7.706  -7.720 -12.567
  196   HG23  VAL  25          HG23      VAL  25  -6.949  -8.349 -14.031
  197    HA   PRO  26           HA       PRO  26  -4.033 -14.002 -11.135
  198    HB2  PRO  26           HB2      PRO  26  -2.118 -13.443 -13.318
  199    HB3  PRO  26           HB3      PRO  26  -2.824 -14.978 -12.804
  200    HG2  PRO  26           HG2      PRO  26  -3.610 -13.804 -15.061
  201    HG3  PRO  26           HG3      PRO  26  -4.773 -14.637 -14.010
  202    HD2  PRO  26           HD2      PRO  26  -4.241 -11.702 -14.302
  203    HD3  PRO  26           HD3      PRO  26  -5.793 -12.554 -14.149
  204    H    GLY  27           HN       GLY  27  -3.121 -10.763 -11.908
  205    HA2  GLY  27           HA1      GLY  27  -0.539 -10.855 -10.642
  206    HA3  GLY  27           HA2      GLY  27  -1.393  -9.411 -11.167
  207    H    VAL  28           HN       VAL  28  -3.726 -10.680  -9.503
  208    HA   VAL  28           HA       VAL  28  -2.970  -9.322  -7.031
  209    HB   VAL  28           HB       VAL  28  -5.658 -10.348  -7.954
  210   HG11  VAL  28          HG11      VAL  28  -5.139 -10.100  -5.430
  211   HG12  VAL  28          HG12      VAL  28  -5.229  -8.369  -5.751
  212   HG13  VAL  28          HG13      VAL  28  -6.624  -9.399  -6.072
  213   HG21  VAL  28          HG21      VAL  28  -4.307  -7.689  -8.170
  214   HG22  VAL  28          HG22      VAL  28  -5.236  -8.576  -9.380
  215   HG23  VAL  28          HG23      VAL  28  -6.065  -7.782  -8.041
  216    H    GLN  29           HN       GLN  29  -2.311 -10.477  -5.326
  217    HA   GLN  29           HA       GLN  29  -2.803 -13.350  -5.321
  218    HB2  GLN  29           HB2      GLN  29  -0.584 -11.841  -4.645
  219    HB3  GLN  29           HB3      GLN  29  -1.240 -12.327  -3.087
  220    HG2  GLN  29           HG2      GLN  29   0.186 -14.057  -3.556
  221    HG3  GLN  29           HG3      GLN  29  -1.347 -14.685  -4.160
  222   HE21  GLN  29          HE21      GLN  29  -1.689 -14.797  -6.408
  223   HE22  GLN  29          HE22      GLN  29  -0.362 -14.735  -7.527
  224    H    SER  30           HN       SER  30  -3.519 -10.471  -3.426
  225    HA   SER  30           HA       SER  30  -5.762 -11.885  -2.264
  226    HB2  SER  30           HB2      SER  30  -4.423 -10.409  -0.143
  227    HB3  SER  30           HB3      SER  30  -5.034 -12.061  -0.138
  228    HG   SER  30           HG       SER  30  -3.108 -12.814  -0.655
  229    H    ALA  31           HN       ALA  31  -7.408 -10.568  -2.675
  230    HA   ALA  31           HA       ALA  31  -6.937  -7.663  -2.477
  231    HB1  ALA  31           HB1      ALA  31  -8.874  -9.201  -4.200
  232    HB2  ALA  31           HB2      ALA  31  -8.903  -7.448  -4.008
  233    HB3  ALA  31           HB3      ALA  31  -7.499  -8.232  -4.729
  234    H    LEU  32           HN       LEU  32  -7.717  -6.896  -0.623
  235    HA   LEU  32           HA       LEU  32 -10.349  -7.895   0.229
  236    HB2  LEU  32           HB2      LEU  32  -9.638  -7.147   2.555
  237    HB3  LEU  32           HB3      LEU  32  -8.917  -8.616   1.929
  238    HG   LEU  32           HG       LEU  32  -7.332  -6.207   1.397
  239   HD11  LEU  32          HD11      LEU  32  -6.926  -6.995   4.154
  240   HD12  LEU  32          HD12      LEU  32  -7.088  -5.385   3.453
  241   HD13  LEU  32          HD13      LEU  32  -8.528  -6.304   3.894
  242   HD21  LEU  32          HD21      LEU  32  -6.212  -8.162   0.945
  243   HD22  LEU  32          HD22      LEU  32  -5.660  -7.837   2.588
  244   HD23  LEU  32          HD23      LEU  32  -6.937  -9.019   2.305
  245    H    VAL  33           HN       VAL  33 -11.465  -6.352  -0.912
  246    HA   VAL  33           HA       VAL  33 -10.937  -3.556  -0.567
  247    HB   VAL  33           HB       VAL  33 -13.502  -4.771  -1.573
  248   HG11  VAL  33          HG11      VAL  33 -13.886  -2.510  -1.285
  249   HG12  VAL  33          HG12      VAL  33 -12.233  -2.071  -1.719
  250   HG13  VAL  33          HG13      VAL  33 -13.366  -2.589  -2.968
  251   HG21  VAL  33          HG21      VAL  33 -12.424  -5.581  -3.342
  252   HG22  VAL  33          HG22      VAL  33 -11.921  -3.941  -3.747
  253   HG23  VAL  33          HG23      VAL  33 -10.892  -4.952  -2.733
  254    H    SER  34           HN       SER  34 -11.417  -2.461   1.175
  255    HA   SER  34           HA       SER  34 -13.159  -3.600   3.185
  256    HB2  SER  34           HB2      SER  34 -12.182  -0.931   3.761
  257    HB3  SER  34           HB3      SER  34 -11.862  -2.444   4.612
  258    HG   SER  34           HG       SER  34 -10.263  -2.887   2.998
  259    H    TYR  35           HN       TYR  35 -15.244  -3.382   2.769
  260    HA   TYR  35           HA       TYR  35 -16.393  -1.326   1.280
  261    HB2  TYR  35           HB2      TYR  35 -18.343  -2.455   1.508
  262    HB3  TYR  35           HB3      TYR  35 -17.222  -3.729   1.916
  263    HD1  TYR  35           HD1      TYR  35 -19.515  -1.215   3.395
  264    HD2  TYR  35           HD2      TYR  35 -17.424  -4.876   3.968
  265    HE1  TYR  35           HE1      TYR  35 -20.715  -1.563   5.509
  266    HE2  TYR  35           HE2      TYR  35 -18.628  -5.239   6.077
  267    HH   TYR  35           HH       TYR  35 -19.768  -3.795   7.807
  268    HA   PRO  36           HA       PRO  36 -17.638   0.837   5.369
  269    HB2  PRO  36           HB2      PRO  36 -15.693   0.112   7.402
  270    HB3  PRO  36           HB3      PRO  36 -17.451  -0.023   7.455
  271    HG2  PRO  36           HG2      PRO  36 -15.802  -2.178   7.362
  272    HG3  PRO  36           HG3      PRO  36 -17.442  -2.178   6.687
  273    HD2  PRO  36           HD2      PRO  36 -14.814  -1.848   5.284
  274    HD3  PRO  36           HD3      PRO  36 -16.241  -2.792   4.800
  275    H    LYS  37           HN       LYS  37 -14.579   0.392   4.040
  276    HA   LYS  37           HA       LYS  37 -13.615   2.982   5.038
  277    HB2  LYS  37           HB2      LYS  37 -12.319   0.467   4.394
  278    HB3  LYS  37           HB3      LYS  37 -11.595   1.800   3.507
  279    HG2  LYS  37           HG2      LYS  37 -11.478   2.988   5.776
  280    HG3  LYS  37           HG3      LYS  37 -11.773   1.391   6.465
  281    HD2  LYS  37           HD2      LYS  37  -9.788   0.512   5.531
  282    HD3  LYS  37           HD3      LYS  37  -9.580   1.912   4.475
  283    HE2  LYS  37           HE2      LYS  37  -9.601   2.262   7.447
  284    HE3  LYS  37           HE3      LYS  37  -8.143   1.684   6.641
  285    HZ1  LYS  37           HZ1      LYS  37  -7.828   3.935   6.650
  286    HZ2  LYS  37           HZ2      LYS  37  -9.469   4.296   6.434
  287    HZ3  LYS  37           HZ3      LYS  37  -8.551   3.730   5.127
  288    H    GLY  38           HN       GLY  38 -14.305   1.097   2.160
  289    HA2  GLY  38           HA1      GLY  38 -14.995   1.915   0.081
  290    HA3  GLY  38           HA2      GLY  38 -14.508   3.532   0.576
  291    H    THR  39           HN       THR  39 -12.311   0.957   1.149
  292    HA   THR  39           HA       THR  39 -10.709   1.846  -1.163
  293    HB   THR  39           HB       THR  39  -8.819   1.152   0.722
  294    HG1  THR  39           HG1      THR  39 -10.190   1.215   2.462
  295   HG21  THR  39          HG21      THR  39  -8.246   2.987  -0.492
  296   HG22  THR  39          HG22      THR  39  -8.811   3.817   0.957
  297   HG23  THR  39          HG23      THR  39  -9.874   3.662  -0.442
  298    H    ALA  40           HN       ALA  40  -9.243   0.335  -2.034
  299    HA   ALA  40           HA       ALA  40  -9.892  -2.456  -1.358
  300    HB1  ALA  40           HB1      ALA  40  -8.542  -2.310  -3.844
  301    HB2  ALA  40           HB2      ALA  40 -10.224  -2.747  -3.537
  302    HB3  ALA  40           HB3      ALA  40  -9.791  -1.064  -3.840
  303    H    GLN  41           HN       GLN  41  -8.399  -3.232  -0.022
  304    HA   GLN  41           HA       GLN  41  -5.636  -2.363  -0.224
  305    HB2  GLN  41           HB2      GLN  41  -7.303  -3.501   1.819
  306    HB3  GLN  41           HB3      GLN  41  -5.869  -4.498   1.617
  307    HG2  GLN  41           HG2      GLN  41  -5.355  -2.918   3.280
  308    HG3  GLN  41           HG3      GLN  41  -4.507  -2.401   1.827
  309   HE21  GLN  41          HE21      GLN  41  -6.313  -1.364   4.354
  310   HE22  GLN  41          HE22      GLN  41  -6.910   0.126   3.689
  311    H    LEU  42           HN       LEU  42  -4.747  -3.195  -2.046
  312    HA   LEU  42           HA       LEU  42  -5.274  -5.996  -2.693
  313    HB2  LEU  42           HB2      LEU  42  -4.320  -3.644  -4.284
  314    HB3  LEU  42           HB3      LEU  42  -4.097  -5.279  -4.878
  315    HG   LEU  42           HG       LEU  42  -6.820  -4.959  -4.067
  316   HD11  LEU  42          HD11      LEU  42  -5.695  -2.780  -5.795
  317   HD12  LEU  42          HD12      LEU  42  -7.386  -3.271  -5.879
  318   HD13  LEU  42          HD13      LEU  42  -6.727  -2.636  -4.372
  319   HD21  LEU  42          HD21      LEU  42  -6.176  -6.603  -5.653
  320   HD22  LEU  42          HD22      LEU  42  -7.184  -5.431  -6.503
  321   HD23  LEU  42          HD23      LEU  42  -5.431  -5.395  -6.700
  322    H    ALA  43           HN       ALA  43  -3.833  -7.497  -2.239
  323    HA   ALA  43           HA       ALA  43  -1.009  -6.791  -1.945
  324    HB1  ALA  43           HB1      ALA  43  -1.930  -9.604  -1.705
  325    HB2  ALA  43           HB2      ALA  43  -0.748  -8.714  -0.743
  326    HB3  ALA  43           HB3      ALA  43  -2.473  -8.468  -0.470
  327    H    ILE  44           HN       ILE  44  -0.730  -6.242  -4.138
  328    HA   ILE  44           HA       ILE  44  -1.198  -8.319  -6.137
  329    HB   ILE  44           HB       ILE  44  -0.411  -6.379  -7.697
  330   HG12  ILE  44          HG12      ILE  44  -1.591  -4.411  -5.952
  331   HG13  ILE  44          HG13      ILE  44  -0.172  -5.122  -5.189
  332   HG21  ILE  44          HG21      ILE  44  -2.681  -7.331  -7.582
  333   HG22  ILE  44          HG22      ILE  44  -3.061  -6.203  -6.278
  334   HG23  ILE  44          HG23      ILE  44  -2.686  -5.593  -7.889
  335   HD11  ILE  44          HD11      ILE  44   0.319  -4.474  -7.962
  336   HD12  ILE  44          HD12      ILE  44  -0.215  -3.070  -7.038
  337   HD13  ILE  44          HD13      ILE  44   1.198  -3.985  -6.513
  338    H    VAL  45           HN       VAL  45   0.410  -8.773  -7.736
  339    HA   VAL  45           HA       VAL  45   3.102  -8.887  -6.667
  340    HB   VAL  45           HB       VAL  45   1.872  -9.915  -9.229
  341   HG11  VAL  45          HG11      VAL  45   3.881 -10.214 -10.123
  342   HG12  VAL  45          HG12      VAL  45   4.599  -9.351  -8.761
  343   HG13  VAL  45          HG13      VAL  45   4.410 -11.104  -8.696
  344   HG21  VAL  45          HG21      VAL  45   1.273 -11.053  -7.102
  345   HG22  VAL  45          HG22      VAL  45   2.114 -12.088  -8.256
  346   HG23  VAL  45          HG23      VAL  45   2.982 -11.423  -6.871
  347    HA   PRO  46           HA       PRO  46   4.355  -5.060  -8.644
  348    HB2  PRO  46           HB2      PRO  46   7.060  -6.201  -8.262
  349    HB3  PRO  46           HB3      PRO  46   6.394  -4.666  -7.691
  350    HG2  PRO  46           HG2      PRO  46   6.818  -6.676  -5.997
  351    HG3  PRO  46           HG3      PRO  46   5.384  -5.643  -5.841
  352    HD2  PRO  46           HD2      PRO  46   5.622  -8.390  -7.019
  353    HD3  PRO  46           HD3      PRO  46   4.365  -7.732  -5.948
  354    H    GLY  47           HN       GLY  47   3.430  -6.191 -10.599
  355    HA2  GLY  47           HA1      GLY  47   5.359  -6.059 -12.703
  356    HA3  GLY  47           HA2      GLY  47   4.762  -7.700 -12.446
  357    H    THR  48           HN       THR  48   2.170  -7.160 -11.679
  358    HA   THR  48           HA       THR  48   0.859  -6.463 -14.113
  359    HB   THR  48           HB       THR  48  -0.968  -6.378 -11.934
  360    HG1  THR  48           HG1      THR  48   0.470  -7.398 -10.591
  361   HG21  THR  48          HG21      THR  48  -0.962  -7.430 -14.382
  362   HG22  THR  48          HG22      THR  48  -2.057  -7.996 -13.120
  363   HG23  THR  48          HG23      THR  48  -0.576  -8.890 -13.470
  364    H    SER  49           HN       SER  49   0.126  -4.537 -14.758
  365    HA   SER  49           HA       SER  49   0.771  -2.229 -13.229
  366    HB2  SER  49           HB2      SER  49  -0.999  -1.628 -15.410
  367    HB3  SER  49           HB3      SER  49   0.727  -1.290 -15.264
  368    HG   SER  49           HG       SER  49  -0.245  -2.849 -16.995
  369    HA   PRO  50           HA       PRO  50  -3.031  -2.263 -10.874
  370    HB2  PRO  50           HB2      PRO  50  -2.144   0.442 -10.088
  371    HB3  PRO  50           HB3      PRO  50  -2.509  -0.958  -9.075
  372    HG2  PRO  50           HG2      PRO  50   0.009  -0.136  -9.454
  373    HG3  PRO  50           HG3      PRO  50  -0.392  -1.859  -9.333
  374    HD2  PRO  50           HD2      PRO  50   0.185  -0.213 -11.769
  375    HD3  PRO  50           HD3      PRO  50   0.703  -1.867 -11.380
  376    H    ASP  51           HN       ASP  51  -2.102  -0.048 -13.308
  377    HA   ASP  51           HA       ASP  51  -4.361   1.659 -13.317
  378    HB2  ASP  51           HB2      ASP  51  -2.402   2.329 -14.538
  379    HB3  ASP  51           HB3      ASP  51  -2.384   0.831 -15.455
  380    H    ALA  52           HN       ALA  52  -3.716  -1.559 -14.320
  381    HA   ALA  52           HA       ALA  52  -5.837  -1.768 -16.206
  382    HB1  ALA  52           HB1      ALA  52  -3.654  -3.330 -15.517
  383    HB2  ALA  52           HB2      ALA  52  -5.051  -4.291 -15.032
  384    HB3  ALA  52           HB3      ALA  52  -4.901  -3.733 -16.698
  385    H    LEU  53           HN       LEU  53  -5.453  -2.239 -12.796
  386    HA   LEU  53           HA       LEU  53  -7.911  -3.613 -12.348
  387    HB2  LEU  53           HB2      LEU  53  -6.455  -1.934 -10.320
  388    HB3  LEU  53           HB3      LEU  53  -7.477  -3.329 -10.037
  389    HG   LEU  53           HG       LEU  53  -4.824  -3.499 -11.457
  390   HD11  LEU  53          HD11      LEU  53  -4.312  -4.622  -9.094
  391   HD12  LEU  53          HD12      LEU  53  -4.012  -2.916  -9.428
  392   HD13  LEU  53          HD13      LEU  53  -5.476  -3.403  -8.575
  393   HD21  LEU  53          HD21      LEU  53  -5.128  -5.907 -10.517
  394   HD22  LEU  53          HD22      LEU  53  -6.834  -5.466 -10.460
  395   HD23  LEU  53          HD23      LEU  53  -5.962  -5.424 -11.993
  396    H    THR  54           HN       THR  54  -6.827  -0.257 -12.036
  397    HA   THR  54           HA       THR  54  -9.220   0.885 -11.172
  398    HB   THR  54           HB       THR  54  -7.381   2.325 -13.059
  399    HG1  THR  54           HG1      THR  54  -6.722   2.089 -10.325
  400   HG21  THR  54          HG21      THR  54  -9.468   3.072 -11.337
  401   HG22  THR  54          HG22      THR  54  -8.382   4.130 -12.238
  402   HG23  THR  54          HG23      THR  54  -7.980   3.653 -10.587
  403    H    ALA  55           HN       ALA  55  -7.938   0.466 -14.464
  404    HA   ALA  55           HA       ALA  55 -10.182   1.589 -15.767
  405    HB1  ALA  55           HB1      ALA  55  -8.013   1.387 -16.862
  406    HB2  ALA  55           HB2      ALA  55  -8.147  -0.371 -16.825
  407    HB3  ALA  55           HB3      ALA  55  -9.267   0.577 -17.802
  408    H    ALA  56           HN       ALA  56  -9.416  -1.675 -14.713
  409    HA   ALA  56           HA       ALA  56 -11.514  -2.995 -16.067
  410    HB1  ALA  56           HB1      ALA  56 -11.083  -4.857 -14.692
  411    HB2  ALA  56           HB2      ALA  56  -9.524  -4.051 -14.874
  412    HB3  ALA  56           HB3      ALA  56 -10.452  -3.850 -13.388
  413    H    VAL  57           HN       VAL  57 -11.336  -1.569 -12.806
  414    HA   VAL  57           HA       VAL  57 -14.009  -2.262 -12.134
  415    HB   VAL  57           HB       VAL  57 -12.290  -0.092 -10.956
  416   HG11  VAL  57          HG11      VAL  57 -15.021  -0.725 -10.536
  417   HG12  VAL  57          HG12      VAL  57 -14.125  -1.205  -9.096
  418   HG13  VAL  57          HG13      VAL  57 -14.025   0.455  -9.682
  419   HG21  VAL  57          HG21      VAL  57 -11.738  -1.716  -9.226
  420   HG22  VAL  57          HG22      VAL  57 -12.719  -2.932 -10.047
  421   HG23  VAL  57          HG23      VAL  57 -11.262  -2.309 -10.817
  422    H    ALA  58           HN       ALA  58 -12.510   0.693 -13.438
  423    HA   ALA  58           HA       ALA  58 -14.877   2.235 -13.457
  424    HB1  ALA  58           HB1      ALA  58 -12.480   2.508 -15.262
  425    HB2  ALA  58           HB2      ALA  58 -13.696   3.743 -14.935
  426    HB3  ALA  58           HB3      ALA  58 -12.621   3.201 -13.646
  427    H    GLY  59           HN       GLY  59 -13.631  -0.161 -15.645
  428    HA2  GLY  59           HA1      GLY  59 -15.450   0.556 -17.781
  429    HA3  GLY  59           HA2      GLY  59 -14.356  -0.820 -17.757
  430    H    LEU  60           HN       LEU  60 -15.649  -1.278 -14.944
  431    HA   LEU  60           HA       LEU  60 -17.585  -3.166 -15.983
  432    HB2  LEU  60           HB2      LEU  60 -15.913  -2.948 -13.637
  433    HB3  LEU  60           HB3      LEU  60 -17.549  -3.415 -13.221
  434    HG   LEU  60           HG       LEU  60 -16.223  -4.892 -15.435
  435   HD11  LEU  60          HD11      LEU  60 -15.360  -6.452 -13.540
  436   HD12  LEU  60          HD12      LEU  60 -14.395  -5.064 -14.041
  437   HD13  LEU  60          HD13      LEU  60 -15.373  -4.976 -12.574
  438   HD21  LEU  60          HD21      LEU  60 -17.582  -6.337 -13.303
  439   HD22  LEU  60          HD22      LEU  60 -18.594  -5.109 -14.064
  440   HD23  LEU  60          HD23      LEU  60 -17.851  -6.373 -15.045
  441    H    GLY  61           HN       GLY  61 -17.944  -0.123 -15.557
  442    HA2  GLY  61           HA1      GLY  61 -20.048   0.949 -15.565
  443    HA3  GLY  61           HA2      GLY  61 -20.718  -0.414 -14.681
  444    H    TYR  62           HN       TYR  62 -17.966   0.159 -13.129
  445    HA   TYR  62           HA       TYR  62 -19.219   2.012 -11.229
  446    HB2  TYR  62           HB2      TYR  62 -16.812   0.344 -10.586
  447    HB3  TYR  62           HB3      TYR  62 -18.050   0.967  -9.509
  448    HD1  TYR  62           HD2      TYR  62 -20.515   0.014 -10.238
  449    HD2  TYR  62           HD1      TYR  62 -16.783  -1.958 -10.775
  450    HE1  TYR  62           HE2      TYR  62 -21.678  -2.149 -10.320
  451    HE2  TYR  62           HE1      TYR  62 -17.939  -4.130 -10.861
  452    HH   TYR  62           HH       TYR  62 -20.149  -5.025 -11.362
  453    H    LYS  63           HN       LYS  63 -17.069   2.928  -9.845
  454    HA   LYS  63           HA       LYS  63 -15.192   3.948 -11.864
  455    HB2  LYS  63           HB2      LYS  63 -17.010   5.603 -10.961
  456    HB3  LYS  63           HB3      LYS  63 -15.992   5.643  -9.528
  457    HG2  LYS  63           HG2      LYS  63 -14.335   5.987 -11.812
  458    HG3  LYS  63           HG3      LYS  63 -15.703   7.095 -11.937
  459    HD2  LYS  63           HD2      LYS  63 -15.014   8.340 -10.188
  460    HD3  LYS  63           HD3      LYS  63 -14.481   6.931  -9.267
  461    HE2  LYS  63           HE2      LYS  63 -12.462   6.801 -10.640
  462    HE3  LYS  63           HE3      LYS  63 -12.996   8.204 -11.564
  463    HZ1  LYS  63           HZ1      LYS  63 -11.636   9.209 -10.057
  464    HZ2  LYS  63           HZ2      LYS  63 -11.932   8.063  -8.841
  465    HZ3  LYS  63           HZ3      LYS  63 -13.084   9.256  -9.172
  466    H    ALA  64           HN       ALA  64 -13.126   3.622 -11.345
  467    HA   ALA  64           HA       ALA  64 -12.522   3.034  -8.526
  468    HB1  ALA  64           HB1      ALA  64 -12.191   1.191 -10.253
  469    HB2  ALA  64           HB2      ALA  64 -10.830   2.147 -10.841
  470    HB3  ALA  64           HB3      ALA  64 -10.836   1.547  -9.181
  471    H    THR  65           HN       THR  65 -10.831   4.015  -7.565
  472    HA   THR  65           HA       THR  65  -9.083   5.720  -9.189
  473    HB   THR  65           HB       THR  65  -9.598   6.763  -6.479
  474    HG1  THR  65           HG1      THR  65 -11.750   6.084  -7.366
  475   HG21  THR  65          HG21      THR  65  -9.449   8.882  -7.594
  476   HG22  THR  65          HG22      THR  65  -9.655   8.126  -9.173
  477   HG23  THR  65          HG23      THR  65  -8.184   7.839  -8.244
  478    H    LEU  66           HN       LEU  66  -7.672   6.551  -6.694
  479    HA   LEU  66           HA       LEU  66  -6.782   4.036  -5.575
  480    HB2  LEU  66           HB2      LEU  66  -4.335   4.919  -6.202
  481    HB3  LEU  66           HB3      LEU  66  -5.229   3.780  -7.188
  482    HG   LEU  66           HG       LEU  66  -5.986   6.340  -8.084
  483   HD11  LEU  66          HD11      LEU  66  -4.199   7.674  -8.098
  484   HD12  LEU  66          HD12      LEU  66  -3.558   6.628  -6.830
  485   HD13  LEU  66          HD13      LEU  66  -3.107   6.352  -8.512
  486   HD21  LEU  66          HD21      LEU  66  -4.093   4.309  -9.258
  487   HD22  LEU  66          HD22      LEU  66  -5.847   4.318  -9.436
  488   HD23  LEU  66          HD23      LEU  66  -4.882   5.614 -10.143
  489    H    ALA  67           HN       ALA  67  -6.063   4.250  -3.583
  490    HA   ALA  67           HA       ALA  67  -5.607   6.947  -2.521
  491    HB1  ALA  67           HB1      ALA  67  -7.067   6.141  -0.993
  492    HB2  ALA  67           HB2      ALA  67  -6.741   4.463  -1.425
  493    HB3  ALA  67           HB3      ALA  67  -5.649   5.320  -0.339
  494    H    ASP  68           HN       ASP  68  -3.589   6.708  -3.786
  495    HA   ASP  68           HA       ASP  68  -1.654   4.777  -3.417
  496    HB2  ASP  68           HB2      ASP  68  -1.655   6.361  -5.273
  497    HB3  ASP  68           HB3      ASP  68  -1.300   7.681  -4.165
  498    H    ALA  69           HN       ALA  69  -0.054   4.418  -2.050
  499    HA   ALA  69           HA       ALA  69   1.370   4.548  -0.304
  500    HB1  ALA  69           HB1      ALA  69   2.322   6.568  -0.583
  501    HB2  ALA  69           HB2      ALA  69   0.775   7.409  -0.706
  502    HB3  ALA  69           HB3      ALA  69   1.407   6.949   0.876
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1  -0.188  -4.437   1.596
    2    H2   MET   1           H2       MET   1  -1.386  -4.318   0.406
    3    H3   MET   1           H3       MET   1  -1.115  -3.023   1.467
    4    HA   MET   1           HA       MET   1   1.257  -3.050   0.539
    5    HB2  MET   1           HB2      MET   1   0.066  -5.120  -0.961
    6    HB3  MET   1           HB3      MET   1   0.276  -3.773  -2.075
    7    HG2  MET   1           HG2      MET   1   2.522  -4.676  -0.317
    8    HG3  MET   1           HG3      MET   1   2.161  -5.499  -1.836
    9    HE1  MET   1           HE1      MET   1   4.482  -4.003  -0.465
   10    HE2  MET   1           HE2      MET   1   5.363  -3.548  -1.924
   11    HE3  MET   1           HE3      MET   1   4.706  -2.300  -0.863
   12    H    THR   2           HN       THR   2  -0.947  -2.810  -2.161
   13    HA   THR   2           HA       THR   2  -0.728   0.102  -2.000
   14    HB   THR   2           HB       THR   2  -2.034  -1.050  -4.363
   15    HG1  THR   2           HG1      THR   2   0.641  -1.505  -4.591
   16   HG21  THR   2          HG21      THR   2  -0.164   0.326  -5.447
   17   HG22  THR   2          HG22      THR   2   0.221   0.868  -3.813
   18   HG23  THR   2          HG23      THR   2  -1.368   1.203  -4.503
   19    H    HIS   3           HN       HIS   3  -2.504   1.445  -1.922
   20    HA   HIS   3           HA       HIS   3  -5.062   0.110  -1.337
   21    HB2  HIS   3           HB2      HIS   3  -3.973   2.800  -0.604
   22    HB3  HIS   3           HB3      HIS   3  -5.690   2.474  -0.525
   23    HD1  HIS   3           HD1      HIS   3  -4.464   3.195   2.084
   24    HD2  HIS   3           HD2      HIS   3  -4.496  -0.721   0.664
   25    HE1  HIS   3           HE1      HIS   3  -4.242   1.731   4.114
   26    HE2  HIS   3           HE2      HIS   3  -4.510  -0.620   3.249
   27    H    LEU   4           HN       LEU   4  -6.774   0.411  -2.507
   28    HA   LEU   4           HA       LEU   4  -6.670   2.320  -4.749
   29    HB2  LEU   4           HB2      LEU   4  -7.043  -0.495  -4.809
   30    HB3  LEU   4           HB3      LEU   4  -8.580   0.238  -5.225
   31    HG   LEU   4           HG       LEU   4  -7.116   1.660  -6.882
   32   HD11  LEU   4          HD11      LEU   4  -5.441  -0.827  -6.557
   33   HD12  LEU   4          HD12      LEU   4  -5.221   0.434  -7.771
   34   HD13  LEU   4          HD13      LEU   4  -4.968   0.800  -6.065
   35   HD21  LEU   4          HD21      LEU   4  -8.699  -0.640  -7.079
   36   HD22  LEU   4          HD22      LEU   4  -8.263   0.481  -8.371
   37   HD23  LEU   4          HD23      LEU   4  -7.272  -0.949  -8.072
   38    H    LYS   5           HN       LYS   5  -8.851   3.126  -5.416
   39    HA   LYS   5           HA       LYS   5 -10.536   3.369  -3.011
   40    HB2  LYS   5           HB2      LYS   5  -9.307   5.433  -3.512
   41    HB3  LYS   5           HB3      LYS   5  -9.990   5.450  -5.132
   42    HG2  LYS   5           HG2      LYS   5 -11.245   6.993  -3.893
   43    HG3  LYS   5           HG3      LYS   5 -12.263   5.558  -4.027
   44    HD2  LYS   5           HD2      LYS   5 -11.087   4.946  -1.741
   45    HD3  LYS   5           HD3      LYS   5 -10.876   6.697  -1.653
   46    HE2  LYS   5           HE2      LYS   5 -13.294   6.981  -1.993
   47    HE3  LYS   5           HE3      LYS   5 -13.485   5.230  -2.024
   48    HZ1  LYS   5           HZ1      LYS   5 -12.975   7.013   0.234
   49    HZ2  LYS   5           HZ2      LYS   5 -12.243   5.484   0.284
   50    HZ3  LYS   5           HZ3      LYS   5 -13.930   5.614   0.151
   51    H    ILE   6           HN       ILE   6 -12.551   2.709  -3.216
   52    HA   ILE   6           HA       ILE   6 -13.590   2.014  -5.826
   53    HB   ILE   6           HB       ILE   6 -14.225   1.342  -3.044
   54   HG12  ILE   6          HG12      ILE   6 -15.090  -0.737  -4.224
   55   HG13  ILE   6          HG13      ILE   6 -14.579   0.017  -5.731
   56   HG21  ILE   6          HG21      ILE   6 -16.285   2.380  -3.189
   57   HG22  ILE   6          HG22      ILE   6 -16.450   2.042  -4.913
   58   HG23  ILE   6          HG23      ILE   6 -16.647   0.743  -3.737
   59   HD11  ILE   6          HD11      ILE   6 -12.563  -0.827  -5.419
   60   HD12  ILE   6          HD12      ILE   6 -12.392   0.164  -3.969
   61   HD13  ILE   6          HD13      ILE   6 -13.047  -1.469  -3.850
   62    H    THR   7           HN       THR   7 -14.989   3.220  -6.988
   63    HA   THR   7           HA       THR   7 -16.206   5.548  -5.681
   64    HB   THR   7           HB       THR   7 -15.594   6.303  -8.343
   65    HG1  THR   7           HG1      THR   7 -13.774   4.595  -7.374
   66   HG21  THR   7          HG21      THR   7 -15.789   7.906  -6.579
   67   HG22  THR   7          HG22      THR   7 -14.127   7.977  -7.162
   68   HG23  THR   7          HG23      THR   7 -14.498   7.136  -5.655
   69    H    GLY   8           HN       GLY   8 -18.031   6.454  -6.908
   70    HA2  GLY   8           HA1      GLY   8 -19.995   6.144  -8.135
   71    HA3  GLY   8           HA2      GLY   8 -19.360   4.604  -8.722
   72    H    MET   9           HN       MET   9 -19.047   2.937  -6.942
   73    HA   MET   9           HA       MET   9 -21.367   2.830  -5.235
   74    HB2  MET   9           HB2      MET   9 -19.193   0.816  -5.038
   75    HB3  MET   9           HB3      MET   9 -20.939   0.602  -4.973
   76    HG2  MET   9           HG2      MET   9 -21.119   0.317  -7.153
   77    HG3  MET   9           HG3      MET   9 -19.988   1.604  -7.492
   78    HE1  MET   9           HE1      MET   9 -16.742   0.267  -7.986
   79    HE2  MET   9           HE2      MET   9 -17.653   1.513  -7.130
   80    HE3  MET   9           HE3      MET   9 -16.901   0.196  -6.231
   81    H    THR  10           HN       THR  10 -20.879   2.059  -2.859
   82    HA   THR  10           HA       THR  10 -18.520   3.509  -1.872
   83    HB   THR  10           HB       THR  10 -20.964   3.660  -0.202
   84    HG1  THR  10           HG1      THR  10 -21.572   4.186  -2.459
   85   HG21  THR  10          HG21      THR  10 -18.434   5.096  -0.610
   86   HG22  THR  10          HG22      THR  10 -19.404   4.900   0.848
   87   HG23  THR  10          HG23      THR  10 -19.831   6.140  -0.332
   88    H    CYS  11           HN       CYS  11 -20.779   0.850  -1.430
   89    HA   CYS  11           HA       CYS  11 -19.039  -0.301   0.577
   90    HB2  CYS  11           HB2      CYS  11 -21.189  -0.524   2.057
   91    HB3  CYS  11           HB3      CYS  11 -20.140   0.877   2.166
   92    HG   CYS  11           HG       CYS  11 -23.291   0.944   1.793
   93    H    ASP  12           HN       ASP  12 -19.629  -2.371   1.265
   94    HA   ASP  12           HA       ASP  12 -20.161  -4.564   0.788
   95    HB2  ASP  12           HB2      ASP  12 -21.762  -3.196   2.458
   96    HB3  ASP  12           HB3      ASP  12 -22.954  -3.890   1.361
   97    H    SER  13           HN       SER  13 -20.687  -6.067  -0.540
   98    HA   SER  13           HA       SER  13 -21.490  -7.209  -2.314
   99    HB2  SER  13           HB2      SER  13 -23.684  -5.181  -2.683
  100    HB3  SER  13           HB3      SER  13 -23.703  -6.903  -3.060
  101    HG   SER  13           HG       SER  13 -24.288  -7.319  -1.084
  102    H    CYS  14           HN       CYS  14 -21.875  -3.722  -2.955
  103    HA   CYS  14           HA       CYS  14 -20.978  -3.791  -5.613
  104    HB2  CYS  14           HB2      CYS  14 -20.621  -1.589  -3.569
  105    HB3  CYS  14           HB3      CYS  14 -20.550  -1.403  -5.317
  106    HG   CYS  14           HG       CYS  14 -23.348  -2.490  -5.373
  107    H    ALA  15           HN       ALA  15 -19.294  -3.534  -2.531
  108    HA   ALA  15           HA       ALA  15 -16.682  -3.277  -3.655
  109    HB1  ALA  15           HB1      ALA  15 -17.535  -4.171  -0.899
  110    HB2  ALA  15           HB2      ALA  15 -15.891  -3.748  -1.377
  111    HB3  ALA  15           HB3      ALA  15 -17.156  -2.520  -1.392
  112    H    ALA  16           HN       ALA  16 -18.802  -5.929  -2.983
  113    HA   ALA  16           HA       ALA  16 -16.782  -7.962  -2.910
  114    HB1  ALA  16           HB1      ALA  16 -18.970  -8.246  -1.814
  115    HB2  ALA  16           HB2      ALA  16 -19.746  -8.250  -3.398
  116    HB3  ALA  16           HB3      ALA  16 -18.624  -9.539  -2.961
  117    H    HIS  17           HN       HIS  17 -18.996  -6.669  -5.332
  118    HA   HIS  17           HA       HIS  17 -18.411  -8.363  -7.466
  119    HB2  HIS  17           HB2      HIS  17 -19.544  -5.673  -7.096
  120    HB3  HIS  17           HB3      HIS  17 -18.783  -5.919  -8.658
  121    HD1  HIS  17           HD1      HIS  17 -19.777  -8.010 -10.085
  122    HD2  HIS  17           HD2      HIS  17 -22.061  -6.654  -6.883
  123    HE1  HIS  17           HE1      HIS  17 -22.087  -8.923 -10.463
  124    HE2  HIS  17           HE2      HIS  17 -23.428  -8.189  -8.457
  125    H    VAL  18           HN       VAL  18 -16.915  -5.298  -6.509
  126    HA   VAL  18           HA       VAL  18 -14.934  -5.246  -8.516
  127    HB   VAL  18           HB       VAL  18 -14.919  -3.965  -5.774
  128   HG11  VAL  18          HG11      VAL  18 -13.430  -2.669  -7.936
  129   HG12  VAL  18          HG12      VAL  18 -12.991  -2.931  -6.250
  130   HG13  VAL  18          HG13      VAL  18 -12.767  -4.222  -7.429
  131   HG21  VAL  18          HG21      VAL  18 -15.369  -1.996  -7.640
  132   HG22  VAL  18          HG22      VAL  18 -16.313  -3.351  -8.258
  133   HG23  VAL  18          HG23      VAL  18 -16.594  -2.755  -6.623
  134    H    LYS  19           HN       LYS  19 -14.939  -6.458  -5.191
  135    HA   LYS  19           HA       LYS  19 -12.244  -7.148  -4.989
  136    HB2  LYS  19           HB2      LYS  19 -13.647  -7.136  -3.035
  137    HB3  LYS  19           HB3      LYS  19 -14.695  -8.374  -3.713
  138    HG2  LYS  19           HG2      LYS  19 -12.045  -9.389  -3.650
  139    HG3  LYS  19           HG3      LYS  19 -12.418  -8.694  -2.071
  140    HD2  LYS  19           HD2      LYS  19 -14.683  -9.990  -2.404
  141    HD3  LYS  19           HD3      LYS  19 -13.707 -10.970  -3.500
  142    HE2  LYS  19           HE2      LYS  19 -12.161 -10.630  -1.190
  143    HE3  LYS  19           HE3      LYS  19 -13.796 -10.976  -0.627
  144    HZ1  LYS  19           HZ1      LYS  19 -12.413 -12.617  -2.676
  145    HZ2  LYS  19           HZ2      LYS  19 -13.827 -12.996  -1.819
  146    HZ3  LYS  19           HZ3      LYS  19 -12.336 -12.956  -1.013
  147    H    GLU  20           HN       GLU  20 -15.013  -9.118  -6.049
  148    HA   GLU  20           HA       GLU  20 -13.477 -11.418  -6.629
  149    HB2  GLU  20           HB2      GLU  20 -16.193 -10.739  -6.648
  150    HB3  GLU  20           HB3      GLU  20 -15.824 -11.214  -8.300
  151    HG2  GLU  20           HG2      GLU  20 -15.617 -13.371  -7.756
  152    HG3  GLU  20           HG3      GLU  20 -14.728 -13.011  -6.276
  153    H    ALA  21           HN       ALA  21 -14.424  -8.633  -8.560
  154    HA   ALA  21           HA       ALA  21 -13.581  -9.607 -11.065
  155    HB1  ALA  21           HB1      ALA  21 -14.622  -7.200 -10.052
  156    HB2  ALA  21           HB2      ALA  21 -13.108  -6.785 -10.855
  157    HB3  ALA  21           HB3      ALA  21 -14.370  -7.642 -11.740
  158    H    LEU  22           HN       LEU  22 -11.905  -7.953  -8.460
  159    HA   LEU  22           HA       LEU  22  -9.393  -7.706  -9.764
  160    HB2  LEU  22           HB2      LEU  22 -10.279  -7.630  -6.895
  161    HB3  LEU  22           HB3      LEU  22  -8.578  -7.571  -7.316
  162    HG   LEU  22           HG       LEU  22 -10.495  -5.611  -8.523
  163   HD11  LEU  22          HD11      LEU  22  -8.997  -4.924  -6.044
  164   HD12  LEU  22          HD12      LEU  22 -10.463  -4.208  -6.712
  165   HD13  LEU  22          HD13      LEU  22 -10.536  -5.775  -5.905
  166   HD21  LEU  22          HD21      LEU  22  -7.746  -4.906  -7.733
  167   HD22  LEU  22          HD22      LEU  22  -7.901  -6.096  -9.025
  168   HD23  LEU  22          HD23      LEU  22  -8.651  -4.510  -9.195
  169    H    GLU  23           HN       GLU  23 -10.741 -10.075  -7.511
  170    HA   GLU  23           HA       GLU  23  -8.387 -11.658  -7.357
  171    HB2  GLU  23           HB2      GLU  23 -11.250 -12.065  -6.567
  172    HB3  GLU  23           HB3      GLU  23 -10.101 -13.391  -6.462
  173    HG2  GLU  23           HG2      GLU  23  -8.670 -11.961  -5.028
  174    HG3  GLU  23           HG3      GLU  23  -9.947 -10.744  -5.043
  175    H    LYS  24           HN       LYS  24 -10.800 -11.372  -9.732
  176    HA   LYS  24           HA       LYS  24 -10.539 -13.984 -10.868
  177    HB2  LYS  24           HB2      LYS  24 -12.243 -11.877 -11.266
  178    HB3  LYS  24           HB3      LYS  24 -11.220 -11.772 -12.692
  179    HG2  LYS  24           HG2      LYS  24 -11.844 -13.913 -13.428
  180    HG3  LYS  24           HG3      LYS  24 -12.542 -14.335 -11.863
  181    HD2  LYS  24           HD2      LYS  24 -13.874 -12.012 -12.720
  182    HD3  LYS  24           HD3      LYS  24 -13.785 -13.075 -14.125
  183    HE2  LYS  24           HE2      LYS  24 -14.783 -13.916 -11.406
  184    HE3  LYS  24           HE3      LYS  24 -15.825 -13.407 -12.733
  185    HZ1  LYS  24           HZ1      LYS  24 -15.831 -15.674 -12.974
  186    HZ2  LYS  24           HZ2      LYS  24 -14.228 -15.862 -12.454
  187    HZ3  LYS  24           HZ3      LYS  24 -14.552 -15.264 -14.010
  188    H    VAL  25           HN       VAL  25  -8.639 -11.161 -10.826
  189    HA   VAL  25           HA       VAL  25  -7.155 -11.750 -13.245
  190    HB   VAL  25           HB       VAL  25  -6.813  -9.655 -11.093
  191   HG11  VAL  25          HG11      VAL  25  -4.661  -9.625 -11.776
  192   HG12  VAL  25          HG12      VAL  25  -5.020 -10.462 -13.286
  193   HG13  VAL  25          HG13      VAL  25  -5.321  -8.731 -13.146
  194   HG21  VAL  25          HG21      VAL  25  -8.743  -9.560 -12.773
  195   HG22  VAL  25          HG22      VAL  25  -7.736  -8.124 -12.594
  196   HG23  VAL  25          HG23      VAL  25  -7.504  -9.198 -13.973
  197    HA   PRO  26           HA       PRO  26  -4.478 -14.586 -11.069
  198    HB2  PRO  26           HB2      PRO  26  -2.636 -14.882 -13.053
  199    HB3  PRO  26           HB3      PRO  26  -4.215 -15.676 -13.070
  200    HG2  PRO  26           HG2      PRO  26  -3.340 -13.170 -14.456
  201    HG3  PRO  26           HG3      PRO  26  -4.309 -14.516 -15.086
  202    HD2  PRO  26           HD2      PRO  26  -5.433 -12.209 -14.267
  203    HD3  PRO  26           HD3      PRO  26  -6.238 -13.776 -14.046
  204    H    GLY  27           HN       GLY  27  -3.603 -11.449 -12.177
  205    HA2  GLY  27           HA1      GLY  27  -0.902 -11.525 -11.139
  206    HA3  GLY  27           HA2      GLY  27  -1.735 -10.115 -11.779
  207    H    VAL  28           HN       VAL  28  -3.979 -11.091  -9.808
  208    HA   VAL  28           HA       VAL  28  -3.045  -9.392  -7.632
  209    HB   VAL  28           HB       VAL  28  -5.769 -10.567  -8.219
  210   HG11  VAL  28          HG11      VAL  28  -5.897  -8.428  -6.353
  211   HG12  VAL  28          HG12      VAL  28  -6.383 -10.109  -6.134
  212   HG13  VAL  28          HG13      VAL  28  -4.735  -9.610  -5.754
  213   HG21  VAL  28          HG21      VAL  28  -6.356  -8.162  -8.590
  214   HG22  VAL  28          HG22      VAL  28  -4.634  -7.792  -8.500
  215   HG23  VAL  28          HG23      VAL  28  -5.246  -8.843  -9.778
  216    H    GLN  29           HN       GLN  29  -2.267 -10.211  -5.799
  217    HA   GLN  29           HA       GLN  29  -2.529 -13.086  -5.352
  218    HB2  GLN  29           HB2      GLN  29  -0.605 -10.989  -4.446
  219    HB3  GLN  29           HB3      GLN  29  -0.815 -12.426  -3.455
  220    HG2  GLN  29           HG2      GLN  29   0.353 -12.150  -6.171
  221    HG3  GLN  29           HG3      GLN  29   0.919 -13.076  -4.783
  222   HE21  GLN  29          HE21      GLN  29  -0.790 -13.169  -7.706
  223   HE22  GLN  29          HE22      GLN  29  -1.340 -14.802  -7.611
  224    H    SER  30           HN       SER  30  -3.299 -10.001  -3.876
  225    HA   SER  30           HA       SER  30  -5.356 -11.320  -2.336
  226    HB2  SER  30           HB2      SER  30  -4.444  -9.776  -0.319
  227    HB3  SER  30           HB3      SER  30  -3.998 -11.471  -0.510
  228    HG   SER  30           HG       SER  30  -2.036 -10.913  -1.189
  229    H    ALA  31           HN       ALA  31  -7.122 -10.150  -2.481
  230    HA   ALA  31           HA       ALA  31  -6.890  -7.221  -2.648
  231    HB1  ALA  31           HB1      ALA  31  -7.799  -7.148  -4.676
  232    HB2  ALA  31           HB2      ALA  31  -7.730  -8.908  -4.741
  233    HB3  ALA  31           HB3      ALA  31  -9.174  -8.107  -4.127
  234    H    LEU  32           HN       LEU  32  -7.538  -6.862  -0.569
  235    HA   LEU  32           HA       LEU  32 -10.185  -7.925   0.170
  236    HB2  LEU  32           HB2      LEU  32  -9.409  -7.251   2.544
  237    HB3  LEU  32           HB3      LEU  32  -8.787  -8.725   1.831
  238    HG   LEU  32           HG       LEU  32  -7.155  -6.272   1.460
  239   HD11  LEU  32          HD11      LEU  32  -7.739  -7.536   4.099
  240   HD12  LEU  32          HD12      LEU  32  -6.116  -6.936   3.763
  241   HD13  LEU  32          HD13      LEU  32  -7.493  -5.839   3.693
  242   HD21  LEU  32          HD21      LEU  32  -6.862  -9.116   1.269
  243   HD22  LEU  32          HD22      LEU  32  -5.749  -7.844   0.766
  244   HD23  LEU  32          HD23      LEU  32  -5.684  -8.471   2.412
  245    H    VAL  33           HN       VAL  33 -11.561  -6.420  -0.541
  246    HA   VAL  33           HA       VAL  33 -10.991  -3.603  -0.279
  247    HB   VAL  33           HB       VAL  33 -13.617  -4.830  -1.085
  248   HG11  VAL  33          HG11      VAL  33 -14.128  -2.637  -0.956
  249   HG12  VAL  33          HG12      VAL  33 -12.446  -2.131  -1.112
  250   HG13  VAL  33          HG13      VAL  33 -13.364  -2.590  -2.547
  251   HG21  VAL  33          HG21      VAL  33 -12.834  -5.452  -3.084
  252   HG22  VAL  33          HG22      VAL  33 -11.937  -3.947  -3.277
  253   HG23  VAL  33          HG23      VAL  33 -11.224  -5.288  -2.384
  254    H    SER  34           HN       SER  34 -11.429  -2.437   1.438
  255    HA   SER  34           HA       SER  34 -12.941  -3.576   3.630
  256    HB2  SER  34           HB2      SER  34 -11.856  -0.803   3.754
  257    HB3  SER  34           HB3      SER  34 -11.816  -2.085   4.969
  258    HG   SER  34           HG       SER  34 -10.331  -3.105   3.258
  259    H    TYR  35           HN       TYR  35 -15.059  -3.503   3.265
  260    HA   TYR  35           HA       TYR  35 -16.394  -1.608   1.716
  261    HB2  TYR  35           HB2      TYR  35 -18.012  -3.120   1.835
  262    HB3  TYR  35           HB3      TYR  35 -17.010  -4.041   2.937
  263    HD1  TYR  35           HD1      TYR  35 -19.605  -1.347   2.904
  264    HD2  TYR  35           HD2      TYR  35 -17.805  -4.545   5.062
  265    HE1  TYR  35           HE1      TYR  35 -21.358  -1.175   4.617
  266    HE2  TYR  35           HE2      TYR  35 -19.549  -4.369   6.783
  267    HH   TYR  35           HH       TYR  35 -22.049  -3.493   6.772
  268    HA   PRO  36           HA       PRO  36 -17.830   0.527   5.849
  269    HB2  PRO  36           HB2      PRO  36 -15.462   0.166   7.571
  270    HB3  PRO  36           HB3      PRO  36 -17.176   0.034   7.973
  271    HG2  PRO  36           HG2      PRO  36 -15.623  -2.133   7.817
  272    HG3  PRO  36           HG3      PRO  36 -17.309  -2.165   7.269
  273    HD2  PRO  36           HD2      PRO  36 -14.795  -1.940   5.652
  274    HD3  PRO  36           HD3      PRO  36 -16.250  -2.912   5.342
  275    H    LYS  37           HN       LYS  37 -14.637   0.471   4.516
  276    HA   LYS  37           HA       LYS  37 -14.266   3.312   5.166
  277    HB2  LYS  37           HB2      LYS  37 -12.448   1.038   4.911
  278    HB3  LYS  37           HB3      LYS  37 -11.902   2.459   4.028
  279    HG2  LYS  37           HG2      LYS  37 -11.061   3.204   5.937
  280    HG3  LYS  37           HG3      LYS  37 -12.718   3.442   6.497
  281    HD2  LYS  37           HD2      LYS  37 -11.810   0.678   6.740
  282    HD3  LYS  37           HD3      LYS  37 -10.831   1.810   7.676
  283    HE2  LYS  37           HE2      LYS  37 -13.690   2.314   7.904
  284    HE3  LYS  37           HE3      LYS  37 -13.235   0.701   8.453
  285    HZ1  LYS  37           HZ1      LYS  37 -12.277   3.318   9.456
  286    HZ2  LYS  37           HZ2      LYS  37 -11.452   1.878   9.794
  287    HZ3  LYS  37           HZ3      LYS  37 -13.052   2.083  10.321
  288    H    GLY  38           HN       GLY  38 -14.700   1.055   2.565
  289    HA2  GLY  38           HA1      GLY  38 -15.311   1.510   0.371
  290    HA3  GLY  38           HA2      GLY  38 -15.049   3.222   0.681
  291    H    THR  39           HN       THR  39 -12.526   1.130   1.624
  292    HA   THR  39           HA       THR  39 -10.978   1.964  -0.746
  293    HB   THR  39           HB       THR  39  -9.348   1.242   1.542
  294    HG1  THR  39           HG1      THR  39 -10.716   3.681   1.922
  295   HG21  THR  39          HG21      THR  39  -8.575   2.445  -0.475
  296   HG22  THR  39          HG22      THR  39  -8.221   3.318   1.014
  297   HG23  THR  39          HG23      THR  39  -9.568   3.825  -0.003
  298    H    ALA  40           HN       ALA  40  -9.238   0.508  -1.362
  299    HA   ALA  40           HA       ALA  40  -9.895  -2.289  -0.713
  300    HB1  ALA  40           HB1      ALA  40 -10.201  -1.162  -3.143
  301    HB2  ALA  40           HB2      ALA  40  -8.545  -1.755  -3.273
  302    HB3  ALA  40           HB3      ALA  40  -9.854  -2.872  -2.890
  303    H    GLN  41           HN       GLN  41  -8.329  -3.465   0.156
  304    HA   GLN  41           HA       GLN  41  -5.588  -2.421   0.096
  305    HB2  GLN  41           HB2      GLN  41  -6.232  -4.887   1.621
  306    HB3  GLN  41           HB3      GLN  41  -5.183  -3.544   2.049
  307    HG2  GLN  41           HG2      GLN  41  -8.048  -2.902   1.945
  308    HG3  GLN  41           HG3      GLN  41  -7.576  -4.052   3.194
  309   HE21  GLN  41          HE21      GLN  41  -8.598  -1.450   3.636
  310   HE22  GLN  41          HE22      GLN  41  -7.363  -0.537   4.445
  311    H    LEU  42           HN       LEU  42  -4.616  -3.014  -1.747
  312    HA   LEU  42           HA       LEU  42  -5.122  -5.734  -2.750
  313    HB2  LEU  42           HB2      LEU  42  -6.106  -4.305  -4.297
  314    HB3  LEU  42           HB3      LEU  42  -4.853  -3.092  -4.124
  315    HG   LEU  42           HG       LEU  42  -3.499  -5.278  -5.155
  316   HD11  LEU  42          HD11      LEU  42  -5.389  -6.530  -5.740
  317   HD12  LEU  42          HD12      LEU  42  -6.270  -5.104  -6.294
  318   HD13  LEU  42          HD13      LEU  42  -4.908  -5.718  -7.231
  319   HD21  LEU  42          HD21      LEU  42  -3.443  -3.916  -7.221
  320   HD22  LEU  42          HD22      LEU  42  -4.678  -2.867  -6.524
  321   HD23  LEU  42          HD23      LEU  42  -3.092  -2.986  -5.763
  322    H    ALA  43           HN       ALA  43  -3.468  -7.021  -3.138
  323    HA   ALA  43           HA       ALA  43  -0.766  -5.858  -3.327
  324    HB1  ALA  43           HB1      ALA  43  -1.644  -7.591  -1.352
  325    HB2  ALA  43           HB2      ALA  43  -0.798  -8.638  -2.493
  326    HB3  ALA  43           HB3      ALA  43   0.035  -7.257  -1.780
  327    H    ILE  44           HN       ILE  44  -0.215  -5.965  -5.389
  328    HA   ILE  44           HA       ILE  44  -1.116  -8.244  -7.002
  329    HB   ILE  44           HB       ILE  44   0.021  -6.525  -8.800
  330   HG12  ILE  44          HG12      ILE  44  -1.542  -4.433  -7.768
  331   HG13  ILE  44          HG13      ILE  44  -0.558  -4.987  -6.416
  332   HG21  ILE  44          HG21      ILE  44  -1.969  -6.955  -9.670
  333   HG22  ILE  44          HG22      ILE  44  -2.579  -7.455  -8.091
  334   HG23  ILE  44          HG23      ILE  44  -2.686  -5.766  -8.584
  335   HD11  ILE  44          HD11      ILE  44   0.836  -4.592  -8.985
  336   HD12  ILE  44          HD12      ILE  44   0.254  -3.146  -8.163
  337   HD13  ILE  44          HD13      ILE  44   1.360  -4.243  -7.337
  338    H    VAL  45           HN       VAL  45   0.372  -9.183  -8.507
  339    HA   VAL  45           HA       VAL  45   2.993  -9.617  -7.470
  340    HB   VAL  45           HB       VAL  45   1.725 -10.365 -10.112
  341   HG11  VAL  45          HG11      VAL  45   4.347 -10.149  -9.924
  342   HG12  VAL  45          HG12      VAL  45   4.183 -11.716  -9.133
  343   HG13  VAL  45          HG13      VAL  45   3.592 -11.492 -10.779
  344   HG21  VAL  45          HG21      VAL  45   0.686 -11.850  -8.809
  345   HG22  VAL  45          HG22      VAL  45   2.248 -12.665  -8.710
  346   HG23  VAL  45          HG23      VAL  45   1.759 -11.536  -7.445
  347    HA   PRO  46           HA       PRO  46   4.991  -5.925  -8.983
  348    HB2  PRO  46           HB2      PRO  46   7.268  -7.864  -9.107
  349    HB3  PRO  46           HB3      PRO  46   7.213  -6.233  -8.425
  350    HG2  PRO  46           HG2      PRO  46   7.129  -8.361  -6.836
  351    HG3  PRO  46           HG3      PRO  46   6.137  -6.930  -6.493
  352    HD2  PRO  46           HD2      PRO  46   5.331  -9.582  -7.579
  353    HD3  PRO  46           HD3      PRO  46   4.421  -8.454  -6.553
  354    H    GLY  47           HN       GLY  47   4.474  -5.376 -10.983
  355    HA2  GLY  47           HA1      GLY  47   5.578  -5.525 -13.291
  356    HA3  GLY  47           HA2      GLY  47   5.110  -7.220 -13.192
  357    H    THR  48           HN       THR  48   2.643  -6.880 -11.898
  358    HA   THR  48           HA       THR  48   0.964  -6.011 -14.062
  359    HB   THR  48           HB       THR  48  -0.312  -6.430 -11.445
  360    HG1  THR  48           HG1      THR  48   1.320  -7.931 -11.139
  361   HG21  THR  48          HG21      THR  48  -0.732  -7.095 -14.283
  362   HG22  THR  48          HG22      THR  48  -1.897  -6.630 -13.041
  363   HG23  THR  48          HG23      THR  48  -1.321  -8.295 -13.132
  364    H    SER  49           HN       SER  49   0.556  -3.960 -14.440
  365    HA   SER  49           HA       SER  49   1.019  -1.951 -12.490
  366    HB2  SER  49           HB2      SER  49  -0.478  -0.961 -14.733
  367    HB3  SER  49           HB3      SER  49   1.220  -0.688 -14.334
  368    HG   SER  49           HG       SER  49   0.115  -2.322 -16.215
  369    HA   PRO  50           HA       PRO  50  -2.986  -2.278 -10.609
  370    HB2  PRO  50           HB2      PRO  50  -2.827  -0.008  -9.084
  371    HB3  PRO  50           HB3      PRO  50  -2.064  -1.541  -8.652
  372    HG2  PRO  50           HG2      PRO  50  -0.863   0.878  -9.932
  373    HG3  PRO  50           HG3      PRO  50  -0.190  -0.176  -8.674
  374    HD2  PRO  50           HD2      PRO  50   0.554  -0.353 -11.267
  375    HD3  PRO  50           HD3      PRO  50   0.482  -1.771 -10.201
  376    H    ASP  51           HN       ASP  51  -1.978   0.242 -12.672
  377    HA   ASP  51           HA       ASP  51  -4.345   1.841 -12.567
  378    HB2  ASP  51           HB2      ASP  51  -2.057   2.567 -13.441
  379    HB3  ASP  51           HB3      ASP  51  -2.411   1.623 -14.885
  380    H    ALA  52           HN       ALA  52  -3.438  -1.126 -13.995
  381    HA   ALA  52           HA       ALA  52  -5.380  -1.058 -16.102
  382    HB1  ALA  52           HB1      ALA  52  -4.726  -3.284 -16.606
  383    HB2  ALA  52           HB2      ALA  52  -3.256  -2.423 -16.147
  384    HB3  ALA  52           HB3      ALA  52  -4.036  -3.513 -14.999
  385    H    LEU  53           HN       LEU  53  -5.219  -2.068 -12.818
  386    HA   LEU  53           HA       LEU  53  -7.662  -3.555 -12.805
  387    HB2  LEU  53           HB2      LEU  53  -6.207  -2.300 -10.475
  388    HB3  LEU  53           HB3      LEU  53  -7.395  -3.588 -10.402
  389    HG   LEU  53           HG       LEU  53  -4.803  -3.933 -11.886
  390   HD11  LEU  53          HD11      LEU  53  -5.341  -4.278  -8.953
  391   HD12  LEU  53          HD12      LEU  53  -4.033  -5.114  -9.790
  392   HD13  LEU  53          HD13      LEU  53  -4.061  -3.352  -9.733
  393   HD21  LEU  53          HD21      LEU  53  -6.763  -5.504 -12.194
  394   HD22  LEU  53          HD22      LEU  53  -5.241  -6.245 -11.698
  395   HD23  LEU  53          HD23      LEU  53  -6.523  -5.985 -10.514
  396    H    THR  54           HN       THR  54  -6.651  -0.277 -12.034
  397    HA   THR  54           HA       THR  54  -9.092   0.718 -11.083
  398    HB   THR  54           HB       THR  54  -7.666   2.663 -12.702
  399    HG1  THR  54           HG1      THR  54  -6.135   1.228 -10.773
  400   HG21  THR  54          HG21      THR  54  -9.088   2.693 -10.405
  401   HG22  THR  54          HG22      THR  54  -7.975   3.973 -10.887
  402   HG23  THR  54          HG23      THR  54  -7.444   2.718  -9.764
  403    H    ALA  55           HN       ALA  55  -7.723   0.679 -14.363
  404    HA   ALA  55           HA       ALA  55  -9.989   1.794 -15.638
  405    HB1  ALA  55           HB1      ALA  55  -8.970   0.844 -17.721
  406    HB2  ALA  55           HB2      ALA  55  -7.886   1.856 -16.767
  407    HB3  ALA  55           HB3      ALA  55  -7.735   0.101 -16.704
  408    H    ALA  56           HN       ALA  56  -9.068  -1.499 -14.822
  409    HA   ALA  56           HA       ALA  56 -11.071  -2.842 -16.260
  410    HB1  ALA  56           HB1      ALA  56 -10.755  -4.365 -13.988
  411    HB2  ALA  56           HB2      ALA  56  -9.784  -4.483 -15.454
  412    HB3  ALA  56           HB3      ALA  56  -9.223  -3.498 -14.105
  413    H    VAL  57           HN       VAL  57 -11.090  -1.622 -12.907
  414    HA   VAL  57           HA       VAL  57 -13.759  -2.408 -12.390
  415    HB   VAL  57           HB       VAL  57 -12.168  -0.230 -11.059
  416   HG11  VAL  57          HG11      VAL  57 -14.869  -1.309 -10.595
  417   HG12  VAL  57          HG12      VAL  57 -13.860  -1.127  -9.160
  418   HG13  VAL  57          HG13      VAL  57 -14.190   0.267 -10.187
  419   HG21  VAL  57          HG21      VAL  57 -12.267  -2.329  -9.320
  420   HG22  VAL  57          HG22      VAL  57 -12.114  -3.146 -10.875
  421   HG23  VAL  57          HG23      VAL  57 -10.908  -1.955 -10.382
  422    H    ALA  58           HN       ALA  58 -12.347   0.653 -13.525
  423    HA   ALA  58           HA       ALA  58 -14.742   2.123 -13.583
  424    HB1  ALA  58           HB1      ALA  58 -12.036   2.435 -14.601
  425    HB2  ALA  58           HB2      ALA  58 -13.251   3.157 -15.656
  426    HB3  ALA  58           HB3      ALA  58 -13.150   3.644 -13.963
  427    H    GLY  59           HN       GLY  59 -13.280  -0.048 -15.921
  428    HA2  GLY  59           HA1      GLY  59 -15.221   0.519 -17.976
  429    HA3  GLY  59           HA2      GLY  59 -14.011  -0.755 -18.003
  430    H    LEU  60           HN       LEU  60 -15.289  -1.313 -15.158
  431    HA   LEU  60           HA       LEU  60 -17.014  -3.396 -16.182
  432    HB2  LEU  60           HB2      LEU  60 -15.441  -2.962 -13.814
  433    HB3  LEU  60           HB3      LEU  60 -17.069  -3.448 -13.383
  434    HG   LEU  60           HG       LEU  60 -15.707  -5.044 -15.479
  435   HD11  LEU  60          HD11      LEU  60 -14.980  -6.217 -13.034
  436   HD12  LEU  60          HD12      LEU  60 -13.917  -5.547 -14.273
  437   HD13  LEU  60          HD13      LEU  60 -14.479  -4.527 -12.947
  438   HD21  LEU  60          HD21      LEU  60 -17.004  -6.295 -13.160
  439   HD22  LEU  60          HD22      LEU  60 -18.051  -5.263 -14.133
  440   HD23  LEU  60          HD23      LEU  60 -17.202  -6.614 -14.882
  441    H    GLY  61           HN       GLY  61 -17.602  -0.360 -15.846
  442    HA2  GLY  61           HA1      GLY  61 -19.754   0.605 -15.927
  443    HA3  GLY  61           HA2      GLY  61 -20.388  -0.795 -15.070
  444    H    TYR  62           HN       TYR  62 -17.732  -0.139 -13.418
  445    HA   TYR  62           HA       TYR  62 -19.117   1.641 -11.544
  446    HB2  TYR  62           HB2      TYR  62 -16.688  -0.031 -10.911
  447    HB3  TYR  62           HB3      TYR  62 -17.858   0.659  -9.798
  448    HD1  TYR  62           HD2      TYR  62 -20.411  -0.222 -10.526
  449    HD2  TYR  62           HD1      TYR  62 -16.736  -2.322 -10.961
  450    HE1  TYR  62           HE2      TYR  62 -21.631  -2.357 -10.475
  451    HE2  TYR  62           HE1      TYR  62 -17.945  -4.462 -10.910
  452    HH   TYR  62           HH       TYR  62 -20.424  -5.204 -11.497
  453    H    LYS  63           HN       LYS  63 -16.902   2.507 -10.087
  454    HA   LYS  63           HA       LYS  63 -15.093   3.667 -12.078
  455    HB2  LYS  63           HB2      LYS  63 -17.064   5.175 -10.991
  456    HB3  LYS  63           HB3      LYS  63 -15.805   5.400  -9.785
  457    HG2  LYS  63           HG2      LYS  63 -14.577   5.717 -12.297
  458    HG3  LYS  63           HG3      LYS  63 -16.088   6.629 -12.345
  459    HD2  LYS  63           HD2      LYS  63 -15.353   8.155 -10.856
  460    HD3  LYS  63           HD3      LYS  63 -14.549   6.939  -9.861
  461    HE2  LYS  63           HE2      LYS  63 -12.586   7.539 -10.707
  462    HE3  LYS  63           HE3      LYS  63 -13.152   7.122 -12.323
  463    HZ1  LYS  63           HZ1      LYS  63 -13.675   9.272 -12.797
  464    HZ2  LYS  63           HZ2      LYS  63 -12.361   9.528 -11.760
  465    HZ3  LYS  63           HZ3      LYS  63 -13.944   9.703 -11.178
  466    H    ALA  64           HN       ALA  64 -12.988   3.595 -11.471
  467    HA   ALA  64           HA       ALA  64 -12.461   2.961  -8.644
  468    HB1  ALA  64           HB1      ALA  64 -11.988   1.291 -10.783
  469    HB2  ALA  64           HB2      ALA  64 -10.412   2.019 -10.468
  470    HB3  ALA  64           HB3      ALA  64 -11.263   1.168  -9.180
  471    H    THR  65           HN       THR  65 -10.968   4.105  -7.627
  472    HA   THR  65           HA       THR  65  -9.094   5.732  -9.200
  473    HB   THR  65           HB       THR  65  -9.324   7.220  -6.947
  474    HG1  THR  65           HG1      THR  65 -11.973   6.294  -7.490
  475   HG21  THR  65          HG21      THR  65 -10.861   7.379  -9.526
  476   HG22  THR  65          HG22      THR  65  -9.432   8.289  -9.038
  477   HG23  THR  65          HG23      THR  65 -10.990   8.630  -8.289
  478    H    LEU  66           HN       LEU  66  -7.719   6.673  -6.817
  479    HA   LEU  66           HA       LEU  66  -7.109   4.279  -5.309
  480    HB2  LEU  66           HB2      LEU  66  -4.966   3.902  -5.987
  481    HB3  LEU  66           HB3      LEU  66  -5.682   4.421  -7.499
  482    HG   LEU  66           HG       LEU  66  -4.627   6.705  -6.110
  483   HD11  LEU  66          HD11      LEU  66  -2.693   6.018  -5.267
  484   HD12  LEU  66          HD12      LEU  66  -3.138   4.352  -5.633
  485   HD13  LEU  66          HD13      LEU  66  -2.246   5.307  -6.816
  486   HD21  LEU  66          HD21      LEU  66  -5.057   6.014  -8.646
  487   HD22  LEU  66          HD22      LEU  66  -3.875   7.239  -8.183
  488   HD23  LEU  66          HD23      LEU  66  -3.347   5.595  -8.537
  489    H    ALA  67           HN       ALA  67  -6.579   4.698  -3.317
  490    HA   ALA  67           HA       ALA  67  -5.577   7.363  -2.600
  491    HB1  ALA  67           HB1      ALA  67  -7.394   7.763  -1.372
  492    HB2  ALA  67           HB2      ALA  67  -8.077   6.208  -1.845
  493    HB3  ALA  67           HB3      ALA  67  -7.052   6.322  -0.414
  494    H    ASP  68           HN       ASP  68  -3.565   6.142  -2.839
  495    HA   ASP  68           HA       ASP  68  -3.052   3.889  -1.190
  496    HB2  ASP  68           HB2      ASP  68  -1.993   4.446  -3.470
  497    HB3  ASP  68           HB3      ASP  68  -0.928   5.514  -2.557
  498    H    ALA  69           HN       ALA  69  -3.824   5.284   0.697
  499    HA   ALA  69           HA       ALA  69  -1.457   6.016   2.214
  500    HB1  ALA  69           HB1      ALA  69  -3.818   7.885   2.127
  501    HB2  ALA  69           HB2      ALA  69  -2.257   8.144   2.905
  502    HB3  ALA  69           HB3      ALA  69  -2.373   8.119   1.146
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1  -0.778  -3.748  -2.460
    2    H2   MET   1           H2       MET   1   0.077  -4.087  -1.036
    3    H3   MET   1           H3       MET   1   0.616  -4.712  -2.515
    4    HA   MET   1           HA       MET   1   1.555  -2.492  -1.348
    5    HB2  MET   1           HB2      MET   1   2.428  -3.885  -3.307
    6    HB3  MET   1           HB3      MET   1   1.459  -2.845  -4.343
    7    HG2  MET   1           HG2      MET   1   2.959  -1.160  -2.650
    8    HG3  MET   1           HG3      MET   1   4.056  -2.394  -3.269
    9    HE1  MET   1           HE1      MET   1   4.203  -3.042  -5.760
   10    HE2  MET   1           HE2      MET   1   4.460  -1.731  -6.911
   11    HE3  MET   1           HE3      MET   1   5.422  -1.808  -5.432
   12    H    THR   2           HN       THR   2  -0.092  -2.047  -4.458
   13    HA   THR   2           HA       THR   2  -0.641   0.675  -3.901
   14    HB   THR   2           HB       THR   2  -2.215  -0.583  -6.035
   15    HG1  THR   2           HG1      THR   2   0.425  -0.507  -6.786
   16   HG21  THR   2          HG21      THR   2  -1.689   1.327  -7.180
   17   HG22  THR   2          HG22      THR   2  -0.064   1.417  -6.503
   18   HG23  THR   2          HG23      THR   2  -1.451   1.914  -5.535
   19    H    HIS   3           HN       HIS   3  -2.339   1.587  -2.934
   20    HA   HIS   3           HA       HIS   3  -4.694  -0.042  -2.342
   21    HB2  HIS   3           HB2      HIS   3  -4.013   2.767  -1.463
   22    HB3  HIS   3           HB3      HIS   3  -5.417   1.855  -0.943
   23    HD1  HIS   3           HD1      HIS   3  -3.786   2.807   1.287
   24    HD2  HIS   3           HD2      HIS   3  -2.868  -0.741  -0.686
   25    HE1  HIS   3           HE1      HIS   3  -2.400   1.467   2.904
   26    HE2  HIS   3           HE2      HIS   3  -1.991  -0.737   1.753
   27    H    LEU   4           HN       LEU   4  -6.630   0.309  -3.235
   28    HA   LEU   4           HA       LEU   4  -6.755   2.321  -5.376
   29    HB2  LEU   4           HB2      LEU   4  -7.746  -0.461  -5.139
   30    HB3  LEU   4           HB3      LEU   4  -8.797   0.669  -5.967
   31    HG   LEU   4           HG       LEU   4  -6.461   1.193  -7.223
   32   HD11  LEU   4          HD11      LEU   4  -6.283  -1.552  -6.103
   33   HD12  LEU   4          HD12      LEU   4  -5.725  -1.287  -7.756
   34   HD13  LEU   4          HD13      LEU   4  -5.009  -0.374  -6.427
   35   HD21  LEU   4          HD21      LEU   4  -7.460  -0.863  -8.731
   36   HD22  LEU   4          HD22      LEU   4  -8.853  -0.388  -7.757
   37   HD23  LEU   4          HD23      LEU   4  -8.033   0.806  -8.763
   38    H    LYS   5           HN       LYS   5  -8.623   3.565  -5.585
   39    HA   LYS   5           HA       LYS   5 -10.203   3.744  -3.120
   40    HB2  LYS   5           HB2      LYS   5  -9.004   5.782  -3.905
   41    HB3  LYS   5           HB3      LYS   5  -9.966   5.744  -5.376
   42    HG2  LYS   5           HG2      LYS   5 -11.133   7.268  -4.141
   43    HG3  LYS   5           HG3      LYS   5 -11.976   5.782  -3.697
   44    HD2  LYS   5           HD2      LYS   5 -10.584   5.619  -1.676
   45    HD3  LYS   5           HD3      LYS   5  -9.786   7.131  -2.118
   46    HE2  LYS   5           HE2      LYS   5 -12.700   7.305  -2.089
   47    HE3  LYS   5           HE3      LYS   5 -12.006   6.888  -0.521
   48    HZ1  LYS   5           HZ1      LYS   5 -12.008   9.177  -0.494
   49    HZ2  LYS   5           HZ2      LYS   5 -11.613   9.320  -2.135
   50    HZ3  LYS   5           HZ3      LYS   5 -10.429   8.846  -1.015
   51    H    ILE   6           HN       ILE   6 -12.264   3.142  -3.105
   52    HA   ILE   6           HA       ILE   6 -13.493   2.450  -5.681
   53    HB   ILE   6           HB       ILE   6 -13.424   1.144  -3.083
   54   HG12  ILE   6          HG12      ILE   6 -14.274  -0.766  -4.535
   55   HG13  ILE   6          HG13      ILE   6 -14.231   0.366  -5.882
   56   HG21  ILE   6          HG21      ILE   6 -16.110   1.776  -4.241
   57   HG22  ILE   6          HG22      ILE   6 -15.839   0.274  -3.355
   58   HG23  ILE   6          HG23      ILE   6 -15.578   1.828  -2.561
   59   HD11  ILE   6          HD11      ILE   6 -12.128  -0.232  -6.199
   60   HD12  ILE   6          HD12      ILE   6 -11.728   0.569  -4.679
   61   HD13  ILE   6          HD13      ILE   6 -12.105  -1.153  -4.696
   62    H    THR   7           HN       THR   7 -15.235   3.556  -6.380
   63    HA   THR   7           HA       THR   7 -16.739   5.184  -4.492
   64    HB   THR   7           HB       THR   7 -16.290   6.865  -6.703
   65    HG1  THR   7           HG1      THR   7 -14.388   5.485  -7.043
   66   HG21  THR   7          HG21      THR   7 -15.635   8.397  -5.097
   67   HG22  THR   7          HG22      THR   7 -14.809   7.179  -4.125
   68   HG23  THR   7          HG23      THR   7 -16.571   7.255  -4.136
   69    H    GLY   8           HN       GLY   8 -18.788   5.823  -5.252
   70    HA2  GLY   8           HA1      GLY   8 -20.563   5.995  -6.742
   71    HA3  GLY   8           HA2      GLY   8 -19.573   5.245  -7.980
   72    H    MET   9           HN       MET   9 -18.984   2.996  -6.043
   73    HA   MET   9           HA       MET   9 -21.166   1.351  -6.942
   74    HB2  MET   9           HB2      MET   9 -19.139   0.238  -5.094
   75    HB3  MET   9           HB3      MET   9 -19.822  -0.442  -6.560
   76    HG2  MET   9           HG2      MET   9 -18.508   1.143  -7.880
   77    HG3  MET   9           HG3      MET   9 -17.760   1.739  -6.401
   78    HE1  MET   9           HE1      MET   9 -18.008  -0.851  -4.905
   79    HE2  MET   9           HE2      MET   9 -17.135  -2.264  -5.501
   80    HE3  MET   9           HE3      MET   9 -16.251  -0.924  -4.773
   81    H    THR  10           HN       THR  10 -20.573   3.153  -4.175
   82    HA   THR  10           HA       THR  10 -21.403   3.292  -2.092
   83    HB   THR  10           HB       THR  10 -23.515   1.482  -3.204
   84    HG1  THR  10           HG1      THR  10 -23.971   3.073  -4.488
   85   HG21  THR  10          HG21      THR  10 -24.115   3.679  -1.290
   86   HG22  THR  10          HG22      THR  10 -23.381   2.210  -0.649
   87   HG23  THR  10          HG23      THR  10 -24.924   2.126  -1.498
   88    H    CYS  11           HN       CYS  11 -19.734   0.883  -3.058
   89    HA   CYS  11           HA       CYS  11 -18.892  -1.095  -2.321
   90    HB2  CYS  11           HB2      CYS  11 -19.306  -0.668   0.455
   91    HB3  CYS  11           HB3      CYS  11 -17.815  -0.754  -0.445
   92    HG   CYS  11           HG       CYS  11 -18.122   1.674   1.095
   93    H    ASP  12           HN       ASP  12 -19.278  -2.717  -0.193
   94    HA   ASP  12           HA       ASP  12 -20.418  -4.568   0.411
   95    HB2  ASP  12           HB2      ASP  12 -21.684  -2.805   1.666
   96    HB3  ASP  12           HB3      ASP  12 -22.871  -2.806   0.362
   97    H    SER  13           HN       SER  13 -20.610  -6.215  -0.885
   98    HA   SER  13           HA       SER  13 -21.220  -7.587  -2.575
   99    HB2  SER  13           HB2      SER  13 -23.610  -5.744  -2.798
  100    HB3  SER  13           HB3      SER  13 -23.420  -7.234  -3.723
  101    HG   SER  13           HG       SER  13 -24.200  -6.887  -1.140
  102    H    CYS  14           HN       CYS  14 -21.809  -4.195  -3.524
  103    HA   CYS  14           HA       CYS  14 -20.750  -4.412  -6.117
  104    HB2  CYS  14           HB2      CYS  14 -20.590  -2.030  -4.246
  105    HB3  CYS  14           HB3      CYS  14 -20.434  -1.985  -5.993
  106    HG   CYS  14           HG       CYS  14 -22.973  -1.020  -4.852
  107    H    ALA  15           HN       ALA  15 -19.281  -3.861  -2.967
  108    HA   ALA  15           HA       ALA  15 -16.623  -3.567  -4.004
  109    HB1  ALA  15           HB1      ALA  15 -16.471  -4.342  -1.305
  110    HB2  ALA  15           HB2      ALA  15 -16.356  -2.711  -1.965
  111    HB3  ALA  15           HB3      ALA  15 -17.919  -3.346  -1.450
  112    H    ALA  16           HN       ALA  16 -18.677  -6.193  -3.156
  113    HA   ALA  16           HA       ALA  16 -16.600  -8.126  -2.750
  114    HB1  ALA  16           HB1      ALA  16 -19.177  -9.227  -3.505
  115    HB2  ALA  16           HB2      ALA  16 -18.246  -9.435  -2.020
  116    HB3  ALA  16           HB3      ALA  16 -19.305  -8.036  -2.211
  117    H    HIS  17           HN       HIS  17 -18.866  -7.385  -5.402
  118    HA   HIS  17           HA       HIS  17 -17.804  -9.341  -7.151
  119    HB2  HIS  17           HB2      HIS  17 -19.973  -7.638  -7.236
  120    HB3  HIS  17           HB3      HIS  17 -18.921  -6.997  -8.498
  121    HD1  HIS  17           HD1      HIS  17 -18.871 -10.673  -7.848
  122    HD2  HIS  17           HD2      HIS  17 -20.673  -7.989 -10.480
  123    HE1  HIS  17           HE1      HIS  17 -19.845 -12.073  -9.695
  124    HE2  HIS  17           HE2      HIS  17 -21.088 -10.453 -11.166
  125    H    VAL  18           HN       VAL  18 -17.017  -5.960  -6.561
  126    HA   VAL  18           HA       VAL  18 -15.105  -5.713  -8.636
  127    HB   VAL  18           HB       VAL  18 -15.838  -4.182  -6.218
  128   HG11  VAL  18          HG11      VAL  18 -13.154  -3.609  -7.439
  129   HG12  VAL  18          HG12      VAL  18 -13.875  -2.911  -5.989
  130   HG13  VAL  18          HG13      VAL  18 -13.334  -4.589  -5.986
  131   HG21  VAL  18          HG21      VAL  18 -16.546  -3.761  -8.601
  132   HG22  VAL  18          HG22      VAL  18 -15.905  -2.371  -7.726
  133   HG23  VAL  18          HG23      VAL  18 -14.896  -3.216  -8.901
  134    H    LYS  19           HN       LYS  19 -14.927  -6.741  -5.267
  135    HA   LYS  19           HA       LYS  19 -12.200  -7.216  -5.040
  136    HB2  LYS  19           HB2      LYS  19 -14.175  -7.410  -3.330
  137    HB3  LYS  19           HB3      LYS  19 -14.214  -9.088  -3.848
  138    HG2  LYS  19           HG2      LYS  19 -11.951  -9.415  -3.119
  139    HG3  LYS  19           HG3      LYS  19 -11.791  -7.699  -2.732
  140    HD2  LYS  19           HD2      LYS  19 -12.704  -8.002  -0.728
  141    HD3  LYS  19           HD3      LYS  19 -14.102  -8.816  -1.433
  142    HE2  LYS  19           HE2      LYS  19 -11.520  -9.995  -0.469
  143    HE3  LYS  19           HE3      LYS  19 -13.169 -10.413  -0.007
  144    HZ1  LYS  19           HZ1      LYS  19 -11.813 -11.009  -2.582
  145    HZ2  LYS  19           HZ2      LYS  19 -13.474 -11.241  -2.315
  146    HZ3  LYS  19           HZ3      LYS  19 -12.339 -12.119  -1.411
  147    H    GLU  20           HN       GLU  20 -14.780  -9.394  -6.129
  148    HA   GLU  20           HA       GLU  20 -13.092 -11.567  -6.724
  149    HB2  GLU  20           HB2      GLU  20 -15.805 -10.897  -7.871
  150    HB3  GLU  20           HB3      GLU  20 -15.007 -12.459  -7.986
  151    HG2  GLU  20           HG2      GLU  20 -15.240 -12.874  -5.700
  152    HG3  GLU  20           HG3      GLU  20 -15.614 -11.189  -5.346
  153    H    ALA  21           HN       ALA  21 -14.199  -8.838  -8.649
  154    HA   ALA  21           HA       ALA  21 -13.227  -9.720 -11.139
  155    HB1  ALA  21           HB1      ALA  21 -14.687  -7.622 -10.436
  156    HB2  ALA  21           HB2      ALA  21 -13.115  -6.823 -10.483
  157    HB3  ALA  21           HB3      ALA  21 -13.734  -7.635 -11.920
  158    H    LEU  22           HN       LEU  22 -11.728  -7.956  -8.486
  159    HA   LEU  22           HA       LEU  22  -9.233  -7.513  -9.768
  160    HB2  LEU  22           HB2      LEU  22 -10.014  -7.597  -6.857
  161    HB3  LEU  22           HB3      LEU  22  -8.422  -7.138  -7.424
  162    HG   LEU  22           HG       LEU  22 -10.833  -5.674  -8.427
  163   HD11  LEU  22          HD11      LEU  22 -10.769  -4.157  -6.596
  164   HD12  LEU  22          HD12      LEU  22 -10.931  -5.781  -5.929
  165   HD13  LEU  22          HD13      LEU  22  -9.367  -4.967  -5.898
  166   HD21  LEU  22          HD21      LEU  22  -7.898  -5.188  -8.199
  167   HD22  LEU  22          HD22      LEU  22  -8.968  -4.975  -9.585
  168   HD23  LEU  22          HD23      LEU  22  -9.011  -3.822  -8.250
  169    H    GLU  23           HN       GLU  23 -10.453 -10.005  -7.572
  170    HA   GLU  23           HA       GLU  23  -7.984 -11.435  -7.486
  171    HB2  GLU  23           HB2      GLU  23 -10.736 -11.852  -6.451
  172    HB3  GLU  23           HB3      GLU  23  -9.693 -13.264  -6.590
  173    HG2  GLU  23           HG2      GLU  23  -8.134 -12.406  -5.080
  174    HG3  GLU  23           HG3      GLU  23  -8.772 -10.769  -5.215
  175    H    LYS  24           HN       LYS  24 -10.434 -11.228  -9.798
  176    HA   LYS  24           HA       LYS  24 -10.092 -13.819 -10.969
  177    HB2  LYS  24           HB2      LYS  24 -12.033 -12.965 -11.799
  178    HB3  LYS  24           HB3      LYS  24 -11.489 -11.304 -11.642
  179    HG2  LYS  24           HG2      LYS  24 -11.130 -11.197 -13.822
  180    HG3  LYS  24           HG3      LYS  24  -9.998 -12.545 -13.725
  181    HD2  LYS  24           HD2      LYS  24 -11.598 -14.108 -14.281
  182    HD3  LYS  24           HD3      LYS  24 -12.930 -13.098 -13.715
  183    HE2  LYS  24           HE2      LYS  24 -12.995 -13.199 -16.120
  184    HE3  LYS  24           HE3      LYS  24 -12.523 -11.573 -15.632
  185    HZ1  LYS  24           HZ1      LYS  24 -11.209 -12.545 -17.499
  186    HZ2  LYS  24           HZ2      LYS  24 -10.570 -13.671 -16.400
  187    HZ3  LYS  24           HZ3      LYS  24 -10.280 -12.013 -16.185
  188    H    VAL  25           HN       VAL  25  -8.399 -10.843 -10.974
  189    HA   VAL  25           HA       VAL  25  -6.790 -11.347 -13.298
  190    HB   VAL  25           HB       VAL  25  -6.487  -9.387 -11.014
  191   HG11  VAL  25          HG11      VAL  25  -4.555  -8.577 -11.866
  192   HG12  VAL  25          HG12      VAL  25  -4.404 -10.205 -12.521
  193   HG13  VAL  25          HG13      VAL  25  -5.027  -8.904 -13.534
  194   HG21  VAL  25          HG21      VAL  25  -7.265  -7.732 -12.587
  195   HG22  VAL  25          HG22      VAL  25  -7.319  -8.934 -13.876
  196   HG23  VAL  25          HG23      VAL  25  -8.427  -9.055 -12.509
  197    HA   PRO  26           HA       PRO  26  -4.314 -14.347 -11.128
  198    HB2  PRO  26           HB2      PRO  26  -2.535 -14.816 -13.137
  199    HB3  PRO  26           HB3      PRO  26  -4.174 -15.475 -13.112
  200    HG2  PRO  26           HG2      PRO  26  -3.109 -13.098 -14.578
  201    HG3  PRO  26           HG3      PRO  26  -4.236 -14.350 -15.135
  202    HD2  PRO  26           HD2      PRO  26  -5.053 -11.894 -14.319
  203    HD3  PRO  26           HD3      PRO  26  -6.041 -13.353 -14.120
  204    H    GLY  27           HN       GLY  27  -3.399 -11.223 -11.861
  205    HA2  GLY  27           HA1      GLY  27  -0.643 -11.534 -10.949
  206    HA3  GLY  27           HA2      GLY  27  -1.403 -10.030 -11.450
  207    H    VAL  28           HN       VAL  28  -3.570 -11.477  -9.491
  208    HA   VAL  28           HA       VAL  28  -2.759  -9.777  -7.265
  209    HB   VAL  28           HB       VAL  28  -5.137  -9.911  -8.420
  210   HG11  VAL  28          HG11      VAL  28  -5.035 -12.427  -7.187
  211   HG12  VAL  28          HG12      VAL  28  -6.153 -11.454  -6.230
  212   HG13  VAL  28          HG13      VAL  28  -6.420 -11.657  -7.960
  213   HG21  VAL  28          HG21      VAL  28  -4.188  -9.171  -5.779
  214   HG22  VAL  28          HG22      VAL  28  -5.255  -8.303  -6.883
  215   HG23  VAL  28          HG23      VAL  28  -5.915  -9.528  -5.801
  216    H    GLN  29           HN       GLN  29  -2.444 -10.486  -5.210
  217    HA   GLN  29           HA       GLN  29  -2.371 -13.382  -4.763
  218    HB2  GLN  29           HB2      GLN  29  -1.396 -11.276  -2.842
  219    HB3  GLN  29           HB3      GLN  29  -0.943 -12.972  -2.923
  220    HG2  GLN  29           HG2      GLN  29  -0.302 -11.634  -5.387
  221    HG3  GLN  29           HG3      GLN  29   0.413 -10.795  -4.013
  222   HE21  GLN  29          HE21      GLN  29   2.414 -11.404  -3.699
  223   HE22  GLN  29          HE22      GLN  29   3.031 -13.015  -3.857
  224    H    SER  30           HN       SER  30  -3.660 -10.346  -3.435
  225    HA   SER  30           HA       SER  30  -6.107 -11.650  -2.715
  226    HB2  SER  30           HB2      SER  30  -4.050 -11.119  -0.661
  227    HB3  SER  30           HB3      SER  30  -5.670 -10.549  -0.267
  228    HG   SER  30           HG       SER  30  -6.151 -12.884  -1.148
  229    H    ALA  31           HN       ALA  31  -7.607 -10.228  -3.259
  230    HA   ALA  31           HA       ALA  31  -7.052  -7.375  -3.129
  231    HB1  ALA  31           HB1      ALA  31  -8.967  -9.091  -4.558
  232    HB2  ALA  31           HB2      ALA  31  -9.610  -7.544  -4.008
  233    HB3  ALA  31           HB3      ALA  31  -8.197  -7.587  -5.062
  234    H    LEU  32           HN       LEU  32  -7.191  -6.692  -1.050
  235    HA   LEU  32           HA       LEU  32  -9.428  -7.650   0.577
  236    HB2  LEU  32           HB2      LEU  32  -6.926  -6.136   1.322
  237    HB3  LEU  32           HB3      LEU  32  -8.183  -6.593   2.456
  238    HG   LEU  32           HG       LEU  32  -7.120  -8.835   0.887
  239   HD11  LEU  32          HD11      LEU  32  -5.271  -6.977   2.002
  240   HD12  LEU  32          HD12      LEU  32  -5.220  -8.467   2.942
  241   HD13  LEU  32          HD13      LEU  32  -4.951  -8.514   1.200
  242   HD21  LEU  32          HD21      LEU  32  -7.946  -9.933   2.627
  243   HD22  LEU  32          HD22      LEU  32  -6.897  -9.052   3.737
  244   HD23  LEU  32          HD23      LEU  32  -8.471  -8.390   3.302
  245    H    VAL  33           HN       VAL  33 -10.778  -6.321  -0.902
  246    HA   VAL  33           HA       VAL  33 -10.703  -3.473  -0.688
  247    HB   VAL  33           HB       VAL  33 -13.101  -5.121  -1.469
  248   HG11  VAL  33          HG11      VAL  33 -12.205  -2.328  -2.155
  249   HG12  VAL  33          HG12      VAL  33 -13.570  -3.151  -2.910
  250   HG13  VAL  33          HG13      VAL  33 -13.602  -2.795  -1.183
  251   HG21  VAL  33          HG21      VAL  33 -12.117  -4.595  -3.848
  252   HG22  VAL  33          HG22      VAL  33 -10.589  -4.579  -2.968
  253   HG23  VAL  33          HG23      VAL  33 -11.602  -6.023  -2.950
  254    H    SER  34           HN       SER  34 -11.406  -2.265   0.920
  255    HA   SER  34           HA       SER  34 -13.038  -3.476   3.023
  256    HB2  SER  34           HB2      SER  34 -11.757  -0.748   3.149
  257    HB3  SER  34           HB3      SER  34 -12.215  -1.813   4.478
  258    HG   SER  34           HG       SER  34 -10.553  -3.280   3.363
  259    H    TYR  35           HN       TYR  35 -15.118  -3.351   2.465
  260    HA   TYR  35           HA       TYR  35 -16.289  -1.345   0.917
  261    HB2  TYR  35           HB2      TYR  35 -18.040  -2.704   0.919
  262    HB3  TYR  35           HB3      TYR  35 -17.082  -3.795   1.891
  263    HD1  TYR  35           HD1      TYR  35 -19.582  -1.042   2.140
  264    HD2  TYR  35           HD2      TYR  35 -17.816  -4.427   4.019
  265    HE1  TYR  35           HE1      TYR  35 -21.292  -0.948   3.901
  266    HE2  TYR  35           HE2      TYR  35 -19.518  -4.333   5.792
  267    HH   TYR  35           HH       TYR  35 -21.100  -2.931   6.766
  268    HA   PRO  36           HA       PRO  36 -17.826   0.694   5.039
  269    HB2  PRO  36           HB2      PRO  36 -15.663   0.159   6.951
  270    HB3  PRO  36           HB3      PRO  36 -17.408   0.004   7.163
  271    HG2  PRO  36           HG2      PRO  36 -15.794  -2.142   7.020
  272    HG3  PRO  36           HG3      PRO  36 -17.444  -2.160   6.371
  273    HD2  PRO  36           HD2      PRO  36 -14.842  -1.835   4.923
  274    HD3  PRO  36           HD3      PRO  36 -16.271  -2.790   4.471
  275    H    LYS  37           HN       LYS  37 -14.590   0.535   3.876
  276    HA   LYS  37           HA       LYS  37 -14.040   3.270   4.790
  277    HB2  LYS  37           HB2      LYS  37 -12.376   0.891   4.300
  278    HB3  LYS  37           HB3      LYS  37 -11.686   2.407   3.745
  279    HG2  LYS  37           HG2      LYS  37 -11.913   3.350   5.974
  280    HG3  LYS  37           HG3      LYS  37 -12.660   1.856   6.538
  281    HD2  LYS  37           HD2      LYS  37 -10.672   0.906   6.863
  282    HD3  LYS  37           HD3      LYS  37 -10.147   1.322   5.231
  283    HE2  LYS  37           HE2      LYS  37  -9.633   3.617   6.050
  284    HE3  LYS  37           HE3      LYS  37 -10.014   3.072   7.684
  285    HZ1  LYS  37           HZ1      LYS  37  -8.063   1.501   6.183
  286    HZ2  LYS  37           HZ2      LYS  37  -8.106   1.895   7.833
  287    HZ3  LYS  37           HZ3      LYS  37  -7.572   3.038   6.701
  288    H    GLY  38           HN       GLY  38 -14.818   1.432   2.025
  289    HA2  GLY  38           HA1      GLY  38 -15.133   2.063  -0.168
  290    HA3  GLY  38           HA2      GLY  38 -14.820   3.721   0.329
  291    H    THR  39           HN       THR  39 -12.568   1.132   0.912
  292    HA   THR  39           HA       THR  39 -10.858   2.094  -1.269
  293    HB   THR  39           HB       THR  39  -9.169   1.475   0.930
  294    HG1  THR  39           HG1      THR  39 -11.295   3.275   1.539
  295   HG21  THR  39          HG21      THR  39  -8.077   3.274   0.153
  296   HG22  THR  39          HG22      THR  39  -9.493   4.311   0.324
  297   HG23  THR  39          HG23      THR  39  -9.300   3.311  -1.116
  298    H    ALA  40           HN       ALA  40  -9.153   0.568  -1.831
  299    HA   ALA  40           HA       ALA  40  -9.790  -2.181  -0.973
  300    HB1  ALA  40           HB1      ALA  40  -9.192  -2.889  -3.288
  301    HB2  ALA  40           HB2      ALA  40 -10.650  -1.899  -3.188
  302    HB3  ALA  40           HB3      ALA  40  -9.135  -1.184  -3.741
  303    H    GLN  41           HN       GLN  41  -8.127  -3.164  -0.026
  304    HA   GLN  41           HA       GLN  41  -5.407  -2.226  -0.519
  305    HB2  GLN  41           HB2      GLN  41  -5.562  -2.602   1.745
  306    HB3  GLN  41           HB3      GLN  41  -6.754  -3.876   1.562
  307    HG2  GLN  41           HG2      GLN  41  -4.743  -4.799   2.468
  308    HG3  GLN  41           HG3      GLN  41  -4.960  -5.408   0.831
  309   HE21  GLN  41          HE21      GLN  41  -2.561  -5.791   1.650
  310   HE22  GLN  41          HE22      GLN  41  -1.430  -4.617   1.062
  311    H    LEU  42           HN       LEU  42  -4.672  -2.953  -2.420
  312    HA   LEU  42           HA       LEU  42  -5.383  -5.661  -3.247
  313    HB2  LEU  42           HB2      LEU  42  -4.653  -3.175  -4.649
  314    HB3  LEU  42           HB3      LEU  42  -4.002  -4.645  -5.346
  315    HG   LEU  42           HG       LEU  42  -6.247  -3.748  -6.233
  316   HD11  LEU  42          HD11      LEU  42  -5.249  -6.414  -5.781
  317   HD12  LEU  42          HD12      LEU  42  -7.012  -6.389  -5.862
  318   HD13  LEU  42          HD13      LEU  42  -6.059  -5.733  -7.193
  319   HD21  LEU  42          HD21      LEU  42  -6.960  -4.578  -3.495
  320   HD22  LEU  42          HD22      LEU  42  -7.711  -3.384  -4.552
  321   HD23  LEU  42          HD23      LEU  42  -8.055  -5.099  -4.775
  322    H    ALA  43           HN       ALA  43  -4.031  -7.213  -2.713
  323    HA   ALA  43           HA       ALA  43  -1.174  -6.647  -2.539
  324    HB1  ALA  43           HB1      ALA  43  -1.259  -9.215  -1.929
  325    HB2  ALA  43           HB2      ALA  43  -1.691  -7.981  -0.745
  326    HB3  ALA  43           HB3      ALA  43  -2.957  -8.847  -1.616
  327    H    ILE  44           HN       ILE  44  -0.890  -6.257  -4.775
  328    HA   ILE  44           HA       ILE  44  -1.280  -8.555  -6.552
  329    HB   ILE  44           HB       ILE  44  -0.406  -6.749  -8.273
  330   HG12  ILE  44          HG12      ILE  44  -1.910  -4.734  -6.819
  331   HG13  ILE  44          HG13      ILE  44  -0.470  -5.221  -5.932
  332   HG21  ILE  44          HG21      ILE  44  -3.089  -5.956  -7.807
  333   HG22  ILE  44          HG22      ILE  44  -2.468  -7.092  -9.005
  334   HG23  ILE  44          HG23      ILE  44  -2.945  -7.667  -7.407
  335   HD11  ILE  44          HD11      ILE  44   0.838  -4.795  -8.030
  336   HD12  ILE  44          HD12      ILE  44  -0.627  -4.078  -8.703
  337   HD13  ILE  44          HD13      ILE  44   0.125  -3.368  -7.273
  338    H    VAL  45           HN       VAL  45   0.434  -9.267  -7.913
  339    HA   VAL  45           HA       VAL  45   2.967  -9.331  -6.546
  340    HB   VAL  45           HB       VAL  45   2.442 -10.374  -9.331
  341   HG11  VAL  45          HG11      VAL  45   4.154 -11.714  -7.293
  342   HG12  VAL  45          HG12      VAL  45   4.296 -11.689  -9.052
  343   HG13  VAL  45          HG13      VAL  45   4.767 -10.275  -8.110
  344   HG21  VAL  45          HG21      VAL  45   1.983 -11.957  -6.812
  345   HG22  VAL  45          HG22      VAL  45   0.686 -11.115  -7.661
  346   HG23  VAL  45          HG23      VAL  45   1.582 -12.399  -8.473
  347    HA   PRO  46           HA       PRO  46   4.786  -5.663  -8.323
  348    HB2  PRO  46           HB2      PRO  46   7.225  -7.390  -8.187
  349    HB3  PRO  46           HB3      PRO  46   6.995  -5.725  -7.639
  350    HG2  PRO  46           HG2      PRO  46   7.027  -7.736  -5.897
  351    HG3  PRO  46           HG3      PRO  46   5.907  -6.375  -5.699
  352    HD2  PRO  46           HD2      PRO  46   5.365  -9.156  -6.615
  353    HD3  PRO  46           HD3      PRO  46   4.328  -8.045  -5.701
  354    H    GLY  47           HN       GLY  47   4.562  -5.200 -10.389
  355    HA2  GLY  47           HA1      GLY  47   5.679  -5.532 -12.624
  356    HA3  GLY  47           HA2      GLY  47   5.314  -7.239 -12.396
  357    H    THR  48           HN       THR  48   2.754  -6.842 -11.196
  358    HA   THR  48           HA       THR  48   1.165  -6.503 -13.550
  359    HB   THR  48           HB       THR  48  -0.146  -6.568 -10.887
  360    HG1  THR  48           HG1      THR  48   1.465  -8.029 -10.435
  361   HG21  THR  48          HG21      THR  48  -0.630  -7.504 -13.637
  362   HG22  THR  48          HG22      THR  48  -1.770  -6.948 -12.411
  363   HG23  THR  48          HG23      THR  48  -1.167  -8.605 -12.367
  364    H    SER  49           HN       SER  49   0.181  -4.750 -14.269
  365    HA   SER  49           HA       SER  49   0.639  -2.254 -12.992
  366    HB2  SER  49           HB2      SER  49  -1.319  -2.319 -15.179
  367    HB3  SER  49           HB3      SER  49   0.176  -1.394 -15.033
  368    HG   SER  49           HG       SER  49   1.147  -2.848 -16.188
  369    HA   PRO  50           HA       PRO  50  -3.145  -2.525 -10.625
  370    HB2  PRO  50           HB2      PRO  50  -2.726  -0.374  -9.057
  371    HB3  PRO  50           HB3      PRO  50  -1.858  -1.895  -8.819
  372    HG2  PRO  50           HG2      PRO  50  -0.946   0.619 -10.148
  373    HG3  PRO  50           HG3      PRO  50  -0.049  -0.469  -9.075
  374    HD2  PRO  50           HD2      PRO  50   0.171  -0.469 -11.817
  375    HD3  PRO  50           HD3      PRO  50   0.520  -1.872 -10.788
  376    H    ASP  51           HN       ASP  51  -2.131   0.048 -12.654
  377    HA   ASP  51           HA       ASP  51  -4.443   1.685 -12.368
  378    HB2  ASP  51           HB2      ASP  51  -3.409   3.065 -13.852
  379    HB3  ASP  51           HB3      ASP  51  -2.002   2.147 -13.368
  380    H    ALA  52           HN       ALA  52  -3.618  -1.178 -13.960
  381    HA   ALA  52           HA       ALA  52  -5.634  -1.087 -15.983
  382    HB1  ALA  52           HB1      ALA  52  -4.253  -3.538 -14.906
  383    HB2  ALA  52           HB2      ALA  52  -5.046  -3.351 -16.470
  384    HB3  ALA  52           HB3      ALA  52  -3.554  -2.476 -16.128
  385    H    LEU  53           HN       LEU  53  -5.394  -2.137 -12.695
  386    HA   LEU  53           HA       LEU  53  -7.857  -3.564 -12.582
  387    HB2  LEU  53           HB2      LEU  53  -6.494  -2.174 -10.281
  388    HB3  LEU  53           HB3      LEU  53  -7.573  -3.553 -10.213
  389    HG   LEU  53           HG       LEU  53  -4.855  -3.662 -11.517
  390   HD11  LEU  53          HD11      LEU  53  -4.609  -5.099  -9.232
  391   HD12  LEU  53          HD12      LEU  53  -4.061  -3.434  -9.429
  392   HD13  LEU  53          HD13      LEU  53  -5.627  -3.766  -8.687
  393   HD21  LEU  53          HD21      LEU  53  -6.772  -5.342 -12.007
  394   HD22  LEU  53          HD22      LEU  53  -5.157  -5.953 -11.644
  395   HD23  LEU  53          HD23      LEU  53  -6.406  -5.963 -10.398
  396    H    THR  54           HN       THR  54  -6.822  -0.273 -11.848
  397    HA   THR  54           HA       THR  54  -9.239   0.797 -10.985
  398    HB   THR  54           HB       THR  54  -7.477   2.447 -12.732
  399    HG1  THR  54           HG1      THR  54  -6.647   1.667 -10.126
  400   HG21  THR  54          HG21      THR  54  -7.676   3.891 -10.578
  401   HG22  THR  54          HG22      THR  54  -8.989   2.785 -10.175
  402   HG23  THR  54          HG23      THR  54  -9.066   3.740 -11.655
  403    H    ALA  55           HN       ALA  55  -7.865   0.659 -14.256
  404    HA   ALA  55           HA       ALA  55 -10.086   1.838 -15.547
  405    HB1  ALA  55           HB1      ALA  55  -8.738   0.042 -17.316
  406    HB2  ALA  55           HB2      ALA  55  -8.671   1.804 -17.265
  407    HB3  ALA  55           HB3      ALA  55  -7.545   0.850 -16.299
  408    H    ALA  56           HN       ALA  56  -9.289  -1.484 -14.713
  409    HA   ALA  56           HA       ALA  56 -11.331  -2.736 -16.207
  410    HB1  ALA  56           HB1      ALA  56 -10.326  -3.771 -13.569
  411    HB2  ALA  56           HB2      ALA  56 -10.888  -4.685 -14.968
  412    HB3  ALA  56           HB3      ALA  56  -9.345  -3.834 -15.033
  413    H    VAL  57           HN       VAL  57 -11.257  -1.508 -12.872
  414    HA   VAL  57           HA       VAL  57 -13.928  -2.273 -12.275
  415    HB   VAL  57           HB       VAL  57 -12.234  -0.152 -10.976
  416   HG11  VAL  57          HG11      VAL  57 -14.965  -1.106 -10.463
  417   HG12  VAL  57          HG12      VAL  57 -13.923  -0.989  -9.045
  418   HG13  VAL  57          HG13      VAL  57 -14.204   0.431 -10.053
  419   HG21  VAL  57          HG21      VAL  57 -12.745  -2.991 -10.111
  420   HG22  VAL  57          HG22      VAL  57 -11.278  -2.433 -10.918
  421   HG23  VAL  57          HG23      VAL  57 -11.696  -1.815  -9.320
  422    H    ALA  58           HN       ALA  58 -12.462   0.776 -13.386
  423    HA   ALA  58           HA       ALA  58 -14.795   2.317 -13.425
  424    HB1  ALA  58           HB1      ALA  58 -13.567   3.900 -14.519
  425    HB2  ALA  58           HB2      ALA  58 -12.261   2.902 -13.880
  426    HB3  ALA  58           HB3      ALA  58 -12.770   2.719 -15.559
  427    H    GLY  59           HN       GLY  59 -13.547  -0.006 -15.731
  428    HA2  GLY  59           HA1      GLY  59 -15.502   0.616 -17.755
  429    HA3  GLY  59           HA2      GLY  59 -14.397  -0.749 -17.757
  430    H    LEU  60           HN       LEU  60 -15.579  -1.191 -14.882
  431    HA   LEU  60           HA       LEU  60 -17.596  -3.049 -15.805
  432    HB2  LEU  60           HB2      LEU  60 -15.828  -2.836 -13.535
  433    HB3  LEU  60           HB3      LEU  60 -17.465  -3.201 -13.024
  434    HG   LEU  60           HG       LEU  60 -16.513  -4.842 -15.262
  435   HD11  LEU  60          HD11      LEU  60 -14.780  -4.438 -13.013
  436   HD12  LEU  60          HD12      LEU  60 -15.383  -6.095 -13.019
  437   HD13  LEU  60          HD13      LEU  60 -14.548  -5.456 -14.435
  438   HD21  LEU  60          HD21      LEU  60 -17.324  -6.541 -13.357
  439   HD22  LEU  60          HD22      LEU  60 -18.143  -5.078 -12.809
  440   HD23  LEU  60          HD23      LEU  60 -18.437  -5.696 -14.435
  441    H    GLY  61           HN       GLY  61 -17.893   0.000 -15.499
  442    HA2  GLY  61           HA1      GLY  61 -19.923   1.176 -15.379
  443    HA3  GLY  61           HA2      GLY  61 -20.614  -0.155 -14.462
  444    H    TYR  62           HN       TYR  62 -17.816   0.228 -12.977
  445    HA   TYR  62           HA       TYR  62 -19.002   1.894 -10.899
  446    HB2  TYR  62           HB2      TYR  62 -16.445   0.283 -10.813
  447    HB3  TYR  62           HB3      TYR  62 -17.298   0.983  -9.444
  448    HD1  TYR  62           HD2      TYR  62 -19.886   0.180  -9.353
  449    HD2  TYR  62           HD1      TYR  62 -16.674  -1.991 -11.100
  450    HE1  TYR  62           HE2      TYR  62 -21.162  -1.905  -9.091
  451    HE2  TYR  62           HE1      TYR  62 -17.941  -4.082 -10.844
  452    HH   TYR  62           HH       TYR  62 -20.525  -4.439  -8.872
  453    H    LYS  63           HN       LYS  63 -17.055   3.079  -9.609
  454    HA   LYS  63           HA       LYS  63 -15.457   4.549 -11.592
  455    HB2  LYS  63           HB2      LYS  63 -17.429   5.559  -9.660
  456    HB3  LYS  63           HB3      LYS  63 -15.881   6.393  -9.600
  457    HG2  LYS  63           HG2      LYS  63 -16.686   7.656 -11.243
  458    HG3  LYS  63           HG3      LYS  63 -16.388   6.266 -12.291
  459    HD2  LYS  63           HD2      LYS  63 -18.727   5.483 -11.596
  460    HD3  LYS  63           HD3      LYS  63 -18.961   7.126 -10.995
  461    HE2  LYS  63           HE2      LYS  63 -18.442   8.000 -13.227
  462    HE3  LYS  63           HE3      LYS  63 -18.247   6.351 -13.820
  463    HZ1  LYS  63           HZ1      LYS  63 -20.457   6.020 -13.884
  464    HZ2  LYS  63           HZ2      LYS  63 -20.527   7.714 -13.969
  465    HZ3  LYS  63           HZ3      LYS  63 -20.764   6.931 -12.483
  466    H    ALA  64           HN       ALA  64 -13.569   3.436 -11.112
  467    HA   ALA  64           HA       ALA  64 -12.750   3.345  -8.308
  468    HB1  ALA  64           HB1      ALA  64 -10.787   2.134  -9.915
  469    HB2  ALA  64           HB2      ALA  64 -11.968   1.349  -8.867
  470    HB3  ALA  64           HB3      ALA  64 -12.350   1.636 -10.564
  471    H    THR  65           HN       THR  65 -10.837   4.159  -7.563
  472    HA   THR  65           HA       THR  65  -9.175   5.728  -9.405
  473    HB   THR  65           HB       THR  65  -9.179   6.968  -6.806
  474    HG1  THR  65           HG1      THR  65 -11.614   6.110  -7.661
  475   HG21  THR  65          HG21      THR  65  -8.846   7.717  -9.422
  476   HG22  THR  65          HG22      THR  65  -9.000   8.831  -8.064
  477   HG23  THR  65          HG23      THR  65 -10.416   8.423  -9.034
  478    H    LEU  66           HN       LEU  66  -7.410   6.572  -7.223
  479    HA   LEU  66           HA       LEU  66  -6.565   4.115  -5.953
  480    HB2  LEU  66           HB2      LEU  66  -4.272   4.243  -6.905
  481    HB3  LEU  66           HB3      LEU  66  -5.502   3.799  -8.070
  482    HG   LEU  66           HG       LEU  66  -5.194   6.630  -8.167
  483   HD11  LEU  66          HD11      LEU  66  -2.834   5.520  -7.277
  484   HD12  LEU  66          HD12      LEU  66  -2.606   5.619  -9.022
  485   HD13  LEU  66          HD13      LEU  66  -3.009   7.069  -8.105
  486   HD21  LEU  66          HD21      LEU  66  -4.829   4.288  -9.968
  487   HD22  LEU  66          HD22      LEU  66  -5.926   5.663 -10.107
  488   HD23  LEU  66          HD23      LEU  66  -4.213   5.859 -10.482
  489    H    ALA  67           HN       ALA  67  -5.106   4.417  -4.279
  490    HA   ALA  67           HA       ALA  67  -4.174   7.133  -3.730
  491    HB1  ALA  67           HB1      ALA  67  -6.496   6.382  -2.595
  492    HB2  ALA  67           HB2      ALA  67  -5.359   5.767  -1.396
  493    HB3  ALA  67           HB3      ALA  67  -5.349   7.478  -1.828
  494    H    ASP  68           HN       ASP  68  -2.066   6.479  -3.973
  495    HA   ASP  68           HA       ASP  68  -1.107   4.083  -2.760
  496    HB2  ASP  68           HB2      ASP  68   1.101   4.766  -3.674
  497    HB3  ASP  68           HB3      ASP  68  -0.169   4.665  -4.881
  498    H    ALA  69           HN       ALA  69  -2.048   5.284  -0.691
  499    HA   ALA  69           HA       ALA  69   0.032   6.883   0.592
  500    HB1  ALA  69           HB1      ALA  69  -2.800   6.224   1.378
  501    HB2  ALA  69           HB2      ALA  69  -1.681   7.096   2.424
  502    HB3  ALA  69           HB3      ALA  69  -2.152   7.783   0.869
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1   1.846   2.904  -1.874
    2    H2   MET   1           H2       MET   1   2.208   2.153  -3.346
    3    H3   MET   1           H3       MET   1   3.232   1.936  -2.014
    4    HA   MET   1           HA       MET   1   1.997  -0.029  -2.191
    5    HB2  MET   1           HB2      MET   1   1.905   1.577   0.060
    6    HB3  MET   1           HB3      MET   1   0.221   1.129  -0.174
    7    HG2  MET   1           HG2      MET   1   2.509  -0.819  -0.003
    8    HG3  MET   1           HG3      MET   1   1.431  -0.396   1.329
    9    HE1  MET   1           HE1      MET   1   2.128  -3.339  -0.259
   10    HE2  MET   1           HE2      MET   1   1.355  -3.201   1.320
   11    HE3  MET   1           HE3      MET   1   0.569  -4.112   0.032
   12    H    THR   2           HN       THR   2   0.147  -1.140  -2.773
   13    HA   THR   2           HA       THR   2  -1.511   0.306  -4.605
   14    HB   THR   2           HB       THR   2  -2.446  -2.366  -4.259
   15    HG1  THR   2           HG1      THR   2  -0.683  -3.385  -3.713
   16   HG21  THR   2          HG21      THR   2  -2.488  -1.135  -6.356
   17   HG22  THR   2          HG22      THR   2  -1.559  -2.622  -6.550
   18   HG23  THR   2          HG23      THR   2  -0.727  -1.076  -6.382
   19    H    HIS   3           HN       HIS   3  -2.512   1.652  -2.820
   20    HA   HIS   3           HA       HIS   3  -4.885   0.266  -1.773
   21    HB2  HIS   3           HB2      HIS   3  -3.923   3.053  -1.165
   22    HB3  HIS   3           HB3      HIS   3  -5.305   2.271  -0.442
   23    HD1  HIS   3           HD1      HIS   3  -4.046   2.884   1.839
   24    HD2  HIS   3           HD2      HIS   3  -2.250  -0.049  -0.510
   25    HE1  HIS   3           HE1      HIS   3  -2.409   1.710   3.345
   26    HE2  HIS   3           HE2      HIS   3  -1.425  -0.139   1.947
   27    H    LEU   4           HN       LEU   4  -6.636   0.425  -2.912
   28    HA   LEU   4           HA       LEU   4  -6.790   2.471  -5.019
   29    HB2  LEU   4           HB2      LEU   4  -7.785  -0.342  -4.814
   30    HB3  LEU   4           HB3      LEU   4  -8.644   0.786  -5.842
   31    HG   LEU   4           HG       LEU   4  -7.170  -0.368  -7.270
   32   HD11  LEU   4          HD11      LEU   4  -5.226   1.667  -7.233
   33   HD12  LEU   4          HD12      LEU   4  -6.640   1.520  -8.278
   34   HD13  LEU   4          HD13      LEU   4  -6.759   2.399  -6.754
   35   HD21  LEU   4          HD21      LEU   4  -4.705  -0.467  -6.795
   36   HD22  LEU   4          HD22      LEU   4  -5.078   0.080  -5.159
   37   HD23  LEU   4          HD23      LEU   4  -5.724  -1.452  -5.746
   38    H    LYS   5           HN       LYS   5  -9.068   3.185  -5.550
   39    HA   LYS   5           HA       LYS   5 -10.631   3.407  -3.061
   40    HB2  LYS   5           HB2      LYS   5  -9.488   5.513  -3.490
   41    HB3  LYS   5           HB3      LYS   5 -10.122   5.553  -5.129
   42    HG2  LYS   5           HG2      LYS   5 -11.696   6.876  -4.255
   43    HG3  LYS   5           HG3      LYS   5 -12.411   5.370  -3.676
   44    HD2  LYS   5           HD2      LYS   5 -10.831   5.731  -1.634
   45    HD3  LYS   5           HD3      LYS   5 -10.803   7.408  -2.187
   46    HE2  LYS   5           HE2      LYS   5 -13.485   6.702  -2.263
   47    HE3  LYS   5           HE3      LYS   5 -12.879   5.942  -0.791
   48    HZ1  LYS   5           HZ1      LYS   5 -12.766   7.899   0.218
   49    HZ2  LYS   5           HZ2      LYS   5 -13.616   8.563  -1.091
   50    HZ3  LYS   5           HZ3      LYS   5 -11.922   8.616  -1.071
   51    H    ILE   6           HN       ILE   6 -12.709   2.896  -3.192
   52    HA   ILE   6           HA       ILE   6 -13.813   2.199  -5.799
   53    HB   ILE   6           HB       ILE   6 -14.347   1.405  -3.011
   54   HG12  ILE   6          HG12      ILE   6 -15.060  -0.698  -4.198
   55   HG13  ILE   6          HG13      ILE   6 -14.688   0.108  -5.716
   56   HG21  ILE   6          HG21      ILE   6 -16.465   2.676  -4.045
   57   HG22  ILE   6          HG22      ILE   6 -16.731   1.067  -4.715
   58   HG23  ILE   6          HG23      ILE   6 -16.601   1.285  -2.970
   59   HD11  ILE   6          HD11      ILE   6 -12.829  -0.770  -3.546
   60   HD12  ILE   6          HD12      ILE   6 -12.806  -1.168  -5.265
   61   HD13  ILE   6          HD13      ILE   6 -12.351   0.449  -4.728
   62    H    THR   7           HN       THR   7 -15.271   3.445  -6.843
   63    HA   THR   7           HA       THR   7 -16.422   5.705  -5.353
   64    HB   THR   7           HB       THR   7 -16.010   6.496  -8.058
   65    HG1  THR   7           HG1      THR   7 -14.296   4.794  -7.793
   66   HG21  THR   7          HG21      THR   7 -14.315   8.049  -6.746
   67   HG22  THR   7          HG22      THR   7 -15.119   7.347  -5.342
   68   HG23  THR   7          HG23      THR   7 -16.059   8.225  -6.549
   69    H    GLY   8           HN       GLY   8 -18.485   6.287  -5.883
   70    HA2  GLY   8           HA1      GLY   8 -20.495   6.266  -7.084
   71    HA3  GLY   8           HA2      GLY   8 -19.802   5.085  -8.185
   72    H    MET   9           HN       MET   9 -18.921   3.305  -6.086
   73    HA   MET   9           HA       MET   9 -21.432   1.938  -5.658
   74    HB2  MET   9           HB2      MET   9 -18.832   0.887  -4.633
   75    HB3  MET   9           HB3      MET   9 -20.214   0.026  -5.274
   76    HG2  MET   9           HG2      MET   9 -19.695   0.758  -7.495
   77    HG3  MET   9           HG3      MET   9 -18.344   1.718  -6.898
   78    HE1  MET   9           HE1      MET   9 -15.556  -0.522  -7.581
   79    HE2  MET   9           HE2      MET   9 -16.600   0.387  -8.674
   80    HE3  MET   9           HE3      MET   9 -16.156   1.069  -7.111
   81    H    THR  10           HN       THR  10 -22.108   1.154  -3.571
   82    HA   THR  10           HA       THR  10 -21.875   3.138  -1.547
   83    HB   THR  10           HB       THR  10 -23.042   0.754  -0.533
   84    HG1  THR  10           HG1      THR  10 -24.407   0.141  -2.139
   85   HG21  THR  10          HG21      THR  10 -24.048   3.437  -1.425
   86   HG22  THR  10          HG22      THR  10 -23.891   2.802   0.214
   87   HG23  THR  10          HG23      THR  10 -25.160   2.194  -0.851
   88    H    CYS  11           HN       CYS  11 -21.097  -0.348  -1.574
   89    HA   CYS  11           HA       CYS  11 -18.761  -0.106  -0.002
   90    HB2  CYS  11           HB2      CYS  11 -19.767  -1.217   2.047
   91    HB3  CYS  11           HB3      CYS  11 -20.099   0.494   1.825
   92    HG   CYS  11           HG       CYS  11 -22.612   0.237   2.147
   93    H    ASP  12           HN       ASP  12 -19.674  -2.648   1.479
   94    HA   ASP  12           HA       ASP  12 -18.339  -4.496  -0.079
   95    HB2  ASP  12           HB2      ASP  12 -18.900  -6.094   1.517
   96    HB3  ASP  12           HB3      ASP  12 -19.028  -4.586   2.415
   97    H    SER  13           HN       SER  13 -21.785  -3.751  -0.081
   98    HA   SER  13           HA       SER  13 -22.728  -5.957  -1.499
   99    HB2  SER  13           HB2      SER  13 -23.955  -3.344  -2.138
  100    HB3  SER  13           HB3      SER  13 -24.698  -4.822  -1.521
  101    HG   SER  13           HG       SER  13 -23.892  -4.319   0.537
  102    H    CYS  14           HN       CYS  14 -20.830  -3.305  -2.520
  103    HA   CYS  14           HA       CYS  14 -21.255  -3.953  -5.353
  104    HB2  CYS  14           HB2      CYS  14 -20.731  -1.474  -3.839
  105    HB3  CYS  14           HB3      CYS  14 -19.901  -1.600  -5.386
  106    HG   CYS  14           HG       CYS  14 -23.289  -2.018  -5.066
  107    H    ALA  15           HN       ALA  15 -18.853  -3.399  -2.846
  108    HA   ALA  15           HA       ALA  15 -16.558  -3.605  -4.487
  109    HB1  ALA  15           HB1      ALA  15 -17.059  -3.714  -1.544
  110    HB2  ALA  15           HB2      ALA  15 -15.463  -4.103  -2.184
  111    HB3  ALA  15           HB3      ALA  15 -16.172  -2.518  -2.488
  112    H    ALA  16           HN       ALA  16 -18.645  -5.993  -3.115
  113    HA   ALA  16           HA       ALA  16 -16.857  -8.135  -2.817
  114    HB1  ALA  16           HB1      ALA  16 -18.733  -9.531  -2.651
  115    HB2  ALA  16           HB2      ALA  16 -19.283  -7.969  -2.044
  116    HB3  ALA  16           HB3      ALA  16 -19.712  -8.482  -3.676
  117    H    HIS  17           HN       HIS  17 -18.908  -7.258  -5.594
  118    HA   HIS  17           HA       HIS  17 -17.945  -9.381  -7.227
  119    HB2  HIS  17           HB2      HIS  17 -19.878  -7.254  -7.465
  120    HB3  HIS  17           HB3      HIS  17 -18.898  -7.352  -8.924
  121    HD1  HIS  17           HD1      HIS  17 -21.792  -8.801  -7.356
  122    HD2  HIS  17           HD2      HIS  17 -18.879 -10.122 -10.015
  123    HE1  HIS  17           HE1      HIS  17 -22.750 -10.862  -8.444
  124    HE2  HIS  17           HE2      HIS  17 -21.049 -11.522 -10.183
  125    H    VAL  18           HN       VAL  18 -16.993  -6.059  -6.705
  126    HA   VAL  18           HA       VAL  18 -15.148  -5.838  -8.827
  127    HB   VAL  18           HB       VAL  18 -15.169  -4.490  -6.117
  128   HG11  VAL  18          HG11      VAL  18 -13.299  -4.282  -8.403
  129   HG12  VAL  18          HG12      VAL  18 -13.798  -2.773  -7.638
  130   HG13  VAL  18          HG13      VAL  18 -13.019  -4.031  -6.679
  131   HG21  VAL  18          HG21      VAL  18 -17.009  -3.589  -7.077
  132   HG22  VAL  18          HG22      VAL  18 -15.812  -2.569  -7.876
  133   HG23  VAL  18          HG23      VAL  18 -16.477  -3.973  -8.712
  134    H    LYS  19           HN       LYS  19 -14.766  -6.849  -5.443
  135    HA   LYS  19           HA       LYS  19 -12.030  -7.475  -5.554
  136    HB2  LYS  19           HB2      LYS  19 -13.080  -7.306  -3.414
  137    HB3  LYS  19           HB3      LYS  19 -14.287  -8.511  -3.837
  138    HG2  LYS  19           HG2      LYS  19 -12.005  -9.947  -4.118
  139    HG3  LYS  19           HG3      LYS  19 -11.560  -8.843  -2.817
  140    HD2  LYS  19           HD2      LYS  19 -12.479 -10.662  -1.688
  141    HD3  LYS  19           HD3      LYS  19 -13.814  -9.513  -1.766
  142    HE2  LYS  19           HE2      LYS  19 -15.056 -11.048  -2.779
  143    HE3  LYS  19           HE3      LYS  19 -13.913 -11.070  -4.119
  144    HZ1  LYS  19           HZ1      LYS  19 -12.690 -12.810  -3.099
  145    HZ2  LYS  19           HZ2      LYS  19 -14.324 -13.266  -3.066
  146    HZ3  LYS  19           HZ3      LYS  19 -13.579 -12.689  -1.656
  147    H    GLU  20           HN       GLU  20 -14.912  -9.368  -6.266
  148    HA   GLU  20           HA       GLU  20 -13.655 -11.828  -6.736
  149    HB2  GLU  20           HB2      GLU  20 -16.154 -11.299  -6.504
  150    HB3  GLU  20           HB3      GLU  20 -16.098 -10.857  -8.204
  151    HG2  GLU  20           HG2      GLU  20 -14.911 -13.329  -8.176
  152    HG3  GLU  20           HG3      GLU  20 -16.174 -13.475  -6.953
  153    H    ALA  21           HN       ALA  21 -14.440  -9.173  -8.934
  154    HA   ALA  21           HA       ALA  21 -13.456 -10.404 -11.280
  155    HB1  ALA  21           HB1      ALA  21 -14.337  -8.595 -12.218
  156    HB2  ALA  21           HB2      ALA  21 -14.679  -7.961 -10.609
  157    HB3  ALA  21           HB3      ALA  21 -13.161  -7.559 -11.412
  158    H    LEU  22           HN       LEU  22 -11.974  -8.493  -8.756
  159    HA   LEU  22           HA       LEU  22  -9.458  -8.129 -10.023
  160    HB2  LEU  22           HB2      LEU  22 -10.461  -7.934  -7.212
  161    HB3  LEU  22           HB3      LEU  22  -8.731  -7.934  -7.504
  162    HG   LEU  22           HG       LEU  22 -10.448  -6.020  -9.020
  163   HD11  LEU  22          HD11      LEU  22  -9.604  -5.729  -6.145
  164   HD12  LEU  22          HD12      LEU  22 -10.081  -4.376  -7.173
  165   HD13  LEU  22          HD13      LEU  22 -11.238  -5.655  -6.806
  166   HD21  LEU  22          HD21      LEU  22  -7.806  -6.543  -9.078
  167   HD22  LEU  22          HD22      LEU  22  -8.504  -4.970  -9.465
  168   HD23  LEU  22          HD23      LEU  22  -7.848  -5.272  -7.856
  169    H    GLU  23           HN       GLU  23 -10.769 -10.569  -7.842
  170    HA   GLU  23           HA       GLU  23  -8.344 -12.041  -7.592
  171    HB2  GLU  23           HB2      GLU  23 -11.215 -12.564  -6.930
  172    HB3  GLU  23           HB3      GLU  23 -10.039 -13.872  -6.841
  173    HG2  GLU  23           HG2      GLU  23  -8.673 -12.352  -5.354
  174    HG3  GLU  23           HG3      GLU  23 -10.098 -11.316  -5.276
  175    H    LYS  24           HN       LYS  24 -10.845 -11.900  -9.944
  176    HA   LYS  24           HA       LYS  24 -10.315 -14.428 -11.180
  177    HB2  LYS  24           HB2      LYS  24 -12.066 -12.160 -11.639
  178    HB3  LYS  24           HB3      LYS  24 -11.346 -12.717 -13.141
  179    HG2  LYS  24           HG2      LYS  24 -12.424 -14.803 -11.369
  180    HG3  LYS  24           HG3      LYS  24 -13.601 -13.720 -12.112
  181    HD2  LYS  24           HD2      LYS  24 -12.856 -14.292 -14.307
  182    HD3  LYS  24           HD3      LYS  24 -11.464 -15.170 -13.668
  183    HE2  LYS  24           HE2      LYS  24 -13.315 -16.572 -12.443
  184    HE3  LYS  24           HE3      LYS  24 -14.341 -15.955 -13.735
  185    HZ1  LYS  24           HZ1      LYS  24 -11.766 -17.110 -14.493
  186    HZ2  LYS  24           HZ2      LYS  24 -13.256 -17.166 -15.300
  187    HZ3  LYS  24           HZ3      LYS  24 -12.974 -18.181 -13.973
  188    H    VAL  25           HN       VAL  25  -8.766 -11.423 -11.091
  189    HA   VAL  25           HA       VAL  25  -7.274 -11.772 -13.550
  190    HB   VAL  25           HB       VAL  25  -7.106  -9.741 -11.315
  191   HG11  VAL  25          HG11      VAL  25  -5.282  -8.741 -12.224
  192   HG12  VAL  25          HG12      VAL  25  -4.938 -10.390 -12.745
  193   HG13  VAL  25          HG13      VAL  25  -5.682  -9.248 -13.865
  194   HG21  VAL  25          HG21      VAL  25  -7.660  -8.370 -13.583
  195   HG22  VAL  25          HG22      VAL  25  -8.494  -9.892 -13.894
  196   HG23  VAL  25          HG23      VAL  25  -8.875  -8.959 -12.447
  197    HA   PRO  26           HA       PRO  26  -4.351 -14.475 -11.542
  198    HB2  PRO  26           HB2      PRO  26  -2.642 -13.876 -13.869
  199    HB3  PRO  26           HB3      PRO  26  -3.280 -15.426 -13.314
  200    HG2  PRO  26           HG2      PRO  26  -4.228 -14.235 -15.518
  201    HG3  PRO  26           HG3      PRO  26  -5.285 -15.150 -14.426
  202    HD2  PRO  26           HD2      PRO  26  -4.920 -12.185 -14.670
  203    HD3  PRO  26           HD3      PRO  26  -6.415 -13.120 -14.449
  204    H    GLY  27           HN       GLY  27  -3.817 -11.203 -12.398
  205    HA2  GLY  27           HA1      GLY  27  -1.121 -11.043 -11.397
  206    HA3  GLY  27           HA2      GLY  27  -2.137  -9.696 -11.883
  207    H    VAL  28           HN       VAL  28  -4.014 -11.414  -9.837
  208    HA   VAL  28           HA       VAL  28  -3.303  -9.675  -7.596
  209    HB   VAL  28           HB       VAL  28  -5.743 -10.287  -8.687
  210   HG11  VAL  28          HG11      VAL  28  -5.982 -11.601  -6.039
  211   HG12  VAL  28          HG12      VAL  28  -6.947 -11.803  -7.501
  212   HG13  VAL  28          HG13      VAL  28  -5.359 -12.561  -7.382
  213   HG21  VAL  28          HG21      VAL  28  -6.484  -9.429  -6.246
  214   HG22  VAL  28          HG22      VAL  28  -4.771  -9.010  -6.220
  215   HG23  VAL  28          HG23      VAL  28  -5.814  -8.380  -7.495
  216    H    GLN  29           HN       GLN  29  -2.783 -10.404  -5.584
  217    HA   GLN  29           HA       GLN  29  -2.299 -13.293  -5.311
  218    HB2  GLN  29           HB2      GLN  29  -1.129 -10.985  -3.740
  219    HB3  GLN  29           HB3      GLN  29  -0.752 -12.682  -3.489
  220    HG2  GLN  29           HG2      GLN  29   0.065 -12.725  -5.874
  221    HG3  GLN  29           HG3      GLN  29  -0.078 -10.968  -5.855
  222   HE21  GLN  29          HE21      GLN  29   1.462 -13.693  -4.236
  223   HE22  GLN  29          HE22      GLN  29   2.868 -12.823  -3.719
  224    H    SER  30           HN       SER  30  -3.506 -10.432  -3.602
  225    HA   SER  30           HA       SER  30  -5.551 -12.015  -2.305
  226    HB2  SER  30           HB2      SER  30  -4.480 -10.533  -0.160
  227    HB3  SER  30           HB3      SER  30  -4.462 -12.285  -0.354
  228    HG   SER  30           HG       SER  30  -2.370 -12.027  -0.396
  229    H    ALA  31           HN       ALA  31  -7.366 -10.803  -1.971
  230    HA   ALA  31           HA       ALA  31  -7.100  -7.894  -2.408
  231    HB1  ALA  31           HB1      ALA  31  -8.378  -9.735  -4.076
  232    HB2  ALA  31           HB2      ALA  31  -9.674  -8.891  -3.226
  233    HB3  ALA  31           HB3      ALA  31  -8.481  -7.976  -4.149
  234    H    LEU  32           HN       LEU  32  -7.535  -6.910  -0.539
  235    HA   LEU  32           HA       LEU  32  -9.897  -7.829   0.960
  236    HB2  LEU  32           HB2      LEU  32  -8.514  -6.508   2.863
  237    HB3  LEU  32           HB3      LEU  32  -8.435  -8.241   2.618
  238    HG   LEU  32           HG       LEU  32  -6.496  -6.622   1.075
  239   HD11  LEU  32          HD11      LEU  32  -6.345  -6.934   4.066
  240   HD12  LEU  32          HD12      LEU  32  -4.987  -6.475   3.038
  241   HD13  LEU  32          HD13      LEU  32  -6.401  -5.427   3.152
  242   HD21  LEU  32          HD21      LEU  32  -5.018  -8.501   1.952
  243   HD22  LEU  32          HD22      LEU  32  -6.501  -9.228   2.568
  244   HD23  LEU  32          HD23      LEU  32  -6.309  -8.950   0.837
  245    H    VAL  33           HN       VAL  33 -11.397  -6.450   0.227
  246    HA   VAL  33           HA       VAL  33 -10.765  -3.632  -0.120
  247    HB   VAL  33           HB       VAL  33 -13.500  -4.844  -0.444
  248   HG11  VAL  33          HG11      VAL  33 -13.612  -2.524  -0.644
  249   HG12  VAL  33          HG12      VAL  33 -12.076  -2.430  -1.505
  250   HG13  VAL  33          HG13      VAL  33 -13.502  -3.082  -2.313
  251   HG21  VAL  33          HG21      VAL  33 -13.045  -5.746  -2.494
  252   HG22  VAL  33          HG22      VAL  33 -11.683  -4.669  -2.791
  253   HG23  VAL  33          HG23      VAL  33 -11.500  -6.040  -1.695
  254    H    SER  34           HN       SER  34 -11.497  -1.989   1.143
  255    HA   SER  34           HA       SER  34 -12.641  -2.737   3.723
  256    HB2  SER  34           HB2      SER  34 -11.864   0.073   3.117
  257    HB3  SER  34           HB3      SER  34 -11.635  -0.867   4.592
  258    HG   SER  34           HG       SER  34 -10.146  -2.111   2.967
  259    H    TYR  35           HN       TYR  35 -14.772  -3.055   3.301
  260    HA   TYR  35           HA       TYR  35 -16.359  -1.611   1.548
  261    HB2  TYR  35           HB2      TYR  35 -17.898  -3.136   2.048
  262    HB3  TYR  35           HB3      TYR  35 -16.635  -3.886   2.996
  263    HD1  TYR  35           HD1      TYR  35 -19.512  -1.549   3.253
  264    HD2  TYR  35           HD2      TYR  35 -16.958  -4.266   5.294
  265    HE1  TYR  35           HE1      TYR  35 -20.935  -1.380   5.248
  266    HE2  TYR  35           HE2      TYR  35 -18.382  -4.115   7.289
  267    HH   TYR  35           HH       TYR  35 -19.982  -2.546   8.289
  268    HA   PRO  36           HA       PRO  36 -17.982   1.131   5.066
  269    HB2  PRO  36           HB2      PRO  36 -16.220   1.224   7.315
  270    HB3  PRO  36           HB3      PRO  36 -17.855   0.570   7.244
  271    HG2  PRO  36           HG2      PRO  36 -15.563  -0.926   7.636
  272    HG3  PRO  36           HG3      PRO  36 -17.109  -1.566   7.055
  273    HD2  PRO  36           HD2      PRO  36 -14.653  -0.845   5.515
  274    HD3  PRO  36           HD3      PRO  36 -15.799  -2.179   5.258
  275    H    LYS  37           HN       LYS  37 -14.788   1.006   4.026
  276    HA   LYS  37           HA       LYS  37 -14.269   3.813   4.703
  277    HB2  LYS  37           HB2      LYS  37 -12.569   1.423   4.268
  278    HB3  LYS  37           HB3      LYS  37 -11.926   2.957   3.706
  279    HG2  LYS  37           HG2      LYS  37 -11.661   3.777   5.810
  280    HG3  LYS  37           HG3      LYS  37 -13.026   2.861   6.456
  281    HD2  LYS  37           HD2      LYS  37 -11.772   0.962   6.785
  282    HD3  LYS  37           HD3      LYS  37 -10.618   1.379   5.516
  283    HE2  LYS  37           HE2      LYS  37  -9.258   2.000   7.173
  284    HE3  LYS  37           HE3      LYS  37 -10.300   3.415   7.331
  285    HZ1  LYS  37           HZ1      LYS  37 -11.478   2.427   9.079
  286    HZ2  LYS  37           HZ2      LYS  37  -9.849   2.098   9.417
  287    HZ3  LYS  37           HZ3      LYS  37 -10.842   0.883   8.770
  288    H    GLY  38           HN       GLY  38 -15.018   1.706   2.111
  289    HA2  GLY  38           HA1      GLY  38 -15.364   2.124  -0.132
  290    HA3  GLY  38           HA2      GLY  38 -15.074   3.827   0.197
  291    H    THR  39           HN       THR  39 -12.738   1.455   1.131
  292    HA   THR  39           HA       THR  39 -10.984   2.326  -1.072
  293    HB   THR  39           HB       THR  39  -9.518   1.544   1.302
  294    HG1  THR  39           HG1      THR  39 -11.484   3.581   1.538
  295   HG21  THR  39          HG21      THR  39  -8.171   2.838   0.050
  296   HG22  THR  39          HG22      THR  39  -8.979   4.186   0.850
  297   HG23  THR  39          HG23      THR  39  -9.527   3.647  -0.737
  298    H    ALA  40           HN       ALA  40  -9.183   0.759  -1.491
  299    HA   ALA  40           HA       ALA  40  -9.937  -1.994  -0.778
  300    HB1  ALA  40           HB1      ALA  40 -10.632  -2.246  -2.888
  301    HB2  ALA  40           HB2      ALA  40  -9.818  -0.781  -3.435
  302    HB3  ALA  40           HB3      ALA  40  -8.916  -2.291  -3.294
  303    H    GLN  41           HN       GLN  41  -8.312  -3.214  -0.080
  304    HA   GLN  41           HA       GLN  41  -5.565  -2.246  -0.499
  305    HB2  GLN  41           HB2      GLN  41  -6.888  -2.940   1.851
  306    HB3  GLN  41           HB3      GLN  41  -5.906  -4.352   1.489
  307    HG2  GLN  41           HG2      GLN  41  -4.768  -1.577   1.532
  308    HG3  GLN  41           HG3      GLN  41  -4.884  -2.580   2.978
  309   HE21  GLN  41          HE21      GLN  41  -4.287  -5.058   1.920
  310   HE22  GLN  41          HE22      GLN  41  -2.643  -5.068   1.389
  311    H    LEU  42           HN       LEU  42  -4.793  -3.260  -2.265
  312    HA   LEU  42           HA       LEU  42  -5.412  -6.126  -2.560
  313    HB2  LEU  42           HB2      LEU  42  -4.721  -4.338  -4.866
  314    HB3  LEU  42           HB3      LEU  42  -5.526  -5.895  -4.888
  315    HG   LEU  42           HG       LEU  42  -6.798  -3.445  -3.686
  316   HD11  LEU  42          HD11      LEU  42  -6.586  -4.300  -6.523
  317   HD12  LEU  42          HD12      LEU  42  -8.120  -3.636  -5.958
  318   HD13  LEU  42          HD13      LEU  42  -6.643  -2.681  -5.828
  319   HD21  LEU  42          HD21      LEU  42  -8.819  -4.667  -3.813
  320   HD22  LEU  42          HD22      LEU  42  -8.083  -5.921  -4.813
  321   HD23  LEU  42          HD23      LEU  42  -7.624  -5.764  -3.118
  322    H    ALA  43           HN       ALA  43  -3.765  -7.470  -2.540
  323    HA   ALA  43           HA       ALA  43  -1.056  -6.440  -2.959
  324    HB1  ALA  43           HB1      ALA  43  -2.140  -8.421  -1.258
  325    HB2  ALA  43           HB2      ALA  43  -1.114  -9.253  -2.427
  326    HB3  ALA  43           HB3      ALA  43  -0.448  -7.953  -1.437
  327    H    ILE  44           HN       ILE  44  -0.432  -6.416  -5.018
  328    HA   ILE  44           HA       ILE  44  -1.482  -8.495  -6.818
  329    HB   ILE  44           HB       ILE  44  -0.929  -6.834  -8.658
  330   HG12  ILE  44          HG12      ILE  44  -1.274  -4.529  -6.921
  331   HG13  ILE  44          HG13      ILE  44   0.204  -5.408  -6.539
  332   HG21  ILE  44          HG21      ILE  44  -2.989  -5.354  -7.386
  333   HG22  ILE  44          HG22      ILE  44  -3.131  -6.585  -8.642
  334   HG23  ILE  44          HG23      ILE  44  -3.179  -7.050  -6.941
  335   HD11  ILE  44          HD11      ILE  44  -0.066  -3.504  -8.473
  336   HD12  ILE  44          HD12      ILE  44   1.221  -4.707  -8.392
  337   HD13  ILE  44          HD13      ILE  44  -0.200  -5.002  -9.394
  338    H    VAL  45           HN       VAL  45  -0.101  -9.232  -8.502
  339    HA   VAL  45           HA       VAL  45   2.505  -9.893  -7.616
  340    HB   VAL  45           HB       VAL  45   1.265 -10.157 -10.368
  341   HG11  VAL  45          HG11      VAL  45   3.193 -10.941 -11.136
  342   HG12  VAL  45          HG12      VAL  45   3.954 -10.463  -9.617
  343   HG13  VAL  45          HG13      VAL  45   3.304 -12.091  -9.802
  344   HG21  VAL  45          HG21      VAL  45   0.616 -12.327  -9.783
  345   HG22  VAL  45          HG22      VAL  45   1.664 -12.356  -8.365
  346   HG23  VAL  45          HG23      VAL  45   0.210 -11.359  -8.366
  347    HA   PRO  46           HA       PRO  46   4.662  -6.137  -8.776
  348    HB2  PRO  46           HB2      PRO  46   6.920  -8.084  -8.801
  349    HB3  PRO  46           HB3      PRO  46   6.797  -6.513  -8.000
  350    HG2  PRO  46           HG2      PRO  46   6.589  -8.766  -6.599
  351    HG3  PRO  46           HG3      PRO  46   5.563  -7.367  -6.227
  352    HD2  PRO  46           HD2      PRO  46   4.876  -9.898  -7.652
  353    HD3  PRO  46           HD3      PRO  46   3.890  -8.923  -6.544
  354    H    GLY  47           HN       GLY  47   4.027  -5.722 -10.827
  355    HA2  GLY  47           HA1      GLY  47   5.439  -5.916 -13.064
  356    HA3  GLY  47           HA2      GLY  47   4.741  -7.532 -12.991
  357    H    THR  48           HN       THR  48   2.296  -6.699 -11.741
  358    HA   THR  48           HA       THR  48   0.818  -5.808 -14.021
  359    HB   THR  48           HB       THR  48  -0.321  -5.831 -11.250
  360    HG1  THR  48           HG1      THR  48   0.591  -7.804 -11.174
  361   HG21  THR  48          HG21      THR  48  -2.293  -5.844 -12.304
  362   HG22  THR  48          HG22      THR  48  -1.793  -7.150 -13.379
  363   HG23  THR  48          HG23      THR  48  -1.397  -5.478 -13.779
  364    H    SER  49           HN       SER  49   0.363  -3.813 -14.606
  365    HA   SER  49           HA       SER  49   1.235  -1.613 -12.998
  366    HB2  SER  49           HB2      SER  49  -0.141  -1.789 -15.681
  367    HB3  SER  49           HB3      SER  49   0.219  -0.247 -14.905
  368    HG   SER  49           HG       SER  49   1.978  -2.189 -15.945
  369    HA   PRO  50           HA       PRO  50  -2.562  -1.320 -10.716
  370    HB2  PRO  50           HB2      PRO  50  -1.658   1.425 -10.095
  371    HB3  PRO  50           HB3      PRO  50  -2.012   0.086  -8.999
  372    HG2  PRO  50           HG2      PRO  50   0.501   0.871  -9.453
  373    HG3  PRO  50           HG3      PRO  50   0.091  -0.841  -9.231
  374    HD2  PRO  50           HD2      PRO  50   0.646   0.662 -11.765
  375    HD3  PRO  50           HD3      PRO  50   1.168  -0.966 -11.283
  376    H    ASP  51           HN       ASP  51  -1.688   0.689 -13.322
  377    HA   ASP  51           HA       ASP  51  -4.019   2.331 -13.372
  378    HB2  ASP  51           HB2      ASP  51  -2.189   3.140 -14.643
  379    HB3  ASP  51           HB3      ASP  51  -1.917   1.581 -15.407
  380    H    ALA  52           HN       ALA  52  -3.187  -0.876 -14.261
  381    HA   ALA  52           HA       ALA  52  -5.347  -1.274 -16.092
  382    HB1  ALA  52           HB1      ALA  52  -4.673  -3.784 -15.460
  383    HB2  ALA  52           HB2      ALA  52  -3.742  -2.805 -16.594
  384    HB3  ALA  52           HB3      ALA  52  -3.215  -2.955 -14.917
  385    H    LEU  53           HN       LEU  53  -4.794  -1.652 -12.689
  386    HA   LEU  53           HA       LEU  53  -7.125  -3.185 -12.128
  387    HB2  LEU  53           HB2      LEU  53  -5.753  -1.352 -10.172
  388    HB3  LEU  53           HB3      LEU  53  -6.647  -2.822  -9.837
  389    HG   LEU  53           HG       LEU  53  -4.021  -2.791 -11.318
  390   HD11  LEU  53          HD11      LEU  53  -4.515  -2.323  -8.554
  391   HD12  LEU  53          HD12      LEU  53  -3.745  -3.898  -8.739
  392   HD13  LEU  53          HD13      LEU  53  -2.971  -2.457  -9.398
  393   HD21  LEU  53          HD21      LEU  53  -5.600  -4.742 -11.589
  394   HD22  LEU  53          HD22      LEU  53  -3.995  -5.132 -10.966
  395   HD23  LEU  53          HD23      LEU  53  -5.371  -5.053  -9.868
  396    H    THR  54           HN       THR  54  -6.300   0.252 -11.917
  397    HA   THR  54           HA       THR  54  -8.766   1.178 -10.975
  398    HB   THR  54           HB       THR  54  -7.008   2.744 -12.860
  399    HG1  THR  54           HG1      THR  54  -5.548   1.963 -11.377
  400   HG21  THR  54          HG21      THR  54  -7.883   4.135 -10.520
  401   HG22  THR  54          HG22      THR  54  -9.269   3.354 -11.281
  402   HG23  THR  54          HG23      THR  54  -8.264   4.466 -12.209
  403    H    ALA  55           HN       ALA  55  -7.541   0.837 -14.294
  404    HA   ALA  55           HA       ALA  55  -9.916   1.736 -15.550
  405    HB1  ALA  55           HB1      ALA  55  -7.979  -0.162 -16.836
  406    HB2  ALA  55           HB2      ALA  55  -8.938   1.119 -17.579
  407    HB3  ALA  55           HB3      ALA  55  -7.564   1.528 -16.551
  408    H    ALA  56           HN       ALA  56  -8.852  -1.425 -14.443
  409    HA   ALA  56           HA       ALA  56 -10.855  -2.950 -15.715
  410    HB1  ALA  56           HB1      ALA  56  -9.580  -4.550 -14.847
  411    HB2  ALA  56           HB2      ALA  56  -8.806  -3.404 -13.751
  412    HB3  ALA  56           HB3      ALA  56 -10.302  -4.204 -13.275
  413    H    VAL  57           HN       VAL  57 -10.735  -1.400 -12.513
  414    HA   VAL  57           HA       VAL  57 -13.333  -2.294 -11.771
  415    HB   VAL  57           HB       VAL  57 -11.779   0.007 -10.618
  416   HG11  VAL  57          HG11      VAL  57 -14.399  -1.058 -10.066
  417   HG12  VAL  57          HG12      VAL  57 -13.350  -1.188  -8.653
  418   HG13  VAL  57          HG13      VAL  57 -13.612   0.381  -9.416
  419   HG21  VAL  57          HG21      VAL  57 -11.708  -2.938 -10.107
  420   HG22  VAL  57          HG22      VAL  57 -10.369  -1.801 -10.281
  421   HG23  VAL  57          HG23      VAL  57 -11.341  -1.802  -8.809
  422    H    ALA  58           HN       ALA  58 -12.104   0.772 -13.137
  423    HA   ALA  58           HA       ALA  58 -14.613   2.062 -13.213
  424    HB1  ALA  58           HB1      ALA  58 -12.242   3.022 -13.623
  425    HB2  ALA  58           HB2      ALA  58 -12.516   2.536 -15.296
  426    HB3  ALA  58           HB3      ALA  58 -13.602   3.692 -14.525
  427    H    GLY  59           HN       GLY  59 -13.097  -0.271 -15.296
  428    HA2  GLY  59           HA1      GLY  59 -15.175  -0.056 -17.311
  429    HA3  GLY  59           HA2      GLY  59 -13.808  -1.161 -17.333
  430    H    LEU  60           HN       LEU  60 -15.365  -1.182 -14.350
  431    HA   LEU  60           HA       LEU  60 -16.740  -3.672 -15.001
  432    HB2  LEU  60           HB2      LEU  60 -15.452  -2.571 -12.652
  433    HB3  LEU  60           HB3      LEU  60 -17.047  -3.193 -12.281
  434    HG   LEU  60           HG       LEU  60 -15.256  -4.946 -13.865
  435   HD11  LEU  60          HD11      LEU  60 -14.256  -5.765 -11.694
  436   HD12  LEU  60          HD12      LEU  60 -13.648  -4.223 -12.295
  437   HD13  LEU  60          HD13      LEU  60 -14.815  -4.255 -10.973
  438   HD21  LEU  60          HD21      LEU  60 -16.467  -6.649 -12.891
  439   HD22  LEU  60          HD22      LEU  60 -16.854  -5.699 -11.457
  440   HD23  LEU  60          HD23      LEU  60 -17.671  -5.364 -12.982
  441    H    GLY  61           HN       GLY  61 -17.485  -0.654 -15.315
  442    HA2  GLY  61           HA1      GLY  61 -19.615   0.245 -15.698
  443    HA3  GLY  61           HA2      GLY  61 -20.316  -1.088 -14.788
  444    H    TYR  62           HN       TYR  62 -17.659   0.467 -13.353
  445    HA   TYR  62           HA       TYR  62 -19.349   2.239 -11.758
  446    HB2  TYR  62           HB2      TYR  62 -17.527   0.060 -10.757
  447    HB3  TYR  62           HB3      TYR  62 -17.904   1.463  -9.768
  448    HD1  TYR  62           HD2      TYR  62 -20.614   1.993  -9.884
  449    HD2  TYR  62           HD1      TYR  62 -18.748  -1.815 -10.226
  450    HE1  TYR  62           HE2      TYR  62 -22.696   0.912  -9.146
  451    HE2  TYR  62           HE1      TYR  62 -20.826  -2.905  -9.493
  452    HH   TYR  62           HH       TYR  62 -23.804  -1.121  -9.097
  453    H    LYS  63           HN       LYS  63 -17.234   3.038 -10.007
  454    HA   LYS  63           HA       LYS  63 -15.312   4.158 -11.929
  455    HB2  LYS  63           HB2      LYS  63 -16.945   5.874 -11.314
  456    HB3  LYS  63           HB3      LYS  63 -16.633   5.582  -9.611
  457    HG2  LYS  63           HG2      LYS  63 -15.388   7.468  -9.996
  458    HG3  LYS  63           HG3      LYS  63 -14.184   6.199 -10.227
  459    HD2  LYS  63           HD2      LYS  63 -15.503   6.650 -12.707
  460    HD3  LYS  63           HD3      LYS  63 -15.003   8.209 -12.052
  461    HE2  LYS  63           HE2      LYS  63 -12.973   6.121 -11.805
  462    HE3  LYS  63           HE3      LYS  63 -13.411   6.493 -13.473
  463    HZ1  LYS  63           HZ1      LYS  63 -12.853   8.761 -13.147
  464    HZ2  LYS  63           HZ2      LYS  63 -11.551   7.848 -12.558
  465    HZ3  LYS  63           HZ3      LYS  63 -12.652   8.557 -11.475
  466    H    ALA  64           HN       ALA  64 -13.235   3.838 -11.405
  467    HA   ALA  64           HA       ALA  64 -12.625   3.197  -8.599
  468    HB1  ALA  64           HB1      ALA  64 -10.423   2.437 -10.089
  469    HB2  ALA  64           HB2      ALA  64 -11.676   1.372  -9.448
  470    HB3  ALA  64           HB3      ALA  64 -11.798   1.985 -11.097
  471    H    THR  65           HN       THR  65 -11.036   4.269  -7.558
  472    HA   THR  65           HA       THR  65  -9.292   6.057  -9.098
  473    HB   THR  65           HB       THR  65  -9.630   7.162  -6.486
  474    HG1  THR  65           HG1      THR  65 -11.979   6.284  -7.678
  475   HG21  THR  65          HG21      THR  65  -9.339   8.998  -7.707
  476   HG22  THR  65          HG22      THR  65 -10.873   8.738  -8.536
  477   HG23  THR  65          HG23      THR  65  -9.397   8.003  -9.162
  478    H    LEU  66           HN       LEU  66  -7.983   6.886  -6.580
  479    HA   LEU  66           HA       LEU  66  -7.045   4.413  -5.407
  480    HB2  LEU  66           HB2      LEU  66  -4.651   4.978  -5.899
  481    HB3  LEU  66           HB3      LEU  66  -5.585   4.430  -7.274
  482    HG   LEU  66           HG       LEU  66  -5.655   7.312  -7.097
  483   HD11  LEU  66          HD11      LEU  66  -3.426   7.905  -7.230
  484   HD12  LEU  66          HD12      LEU  66  -3.404   6.668  -5.971
  485   HD13  LEU  66          HD13      LEU  66  -2.904   6.264  -7.612
  486   HD21  LEU  66          HD21      LEU  66  -4.190   6.014  -9.281
  487   HD22  LEU  66          HD22      LEU  66  -5.824   5.400  -9.026
  488   HD23  LEU  66          HD23      LEU  66  -5.564   7.117  -9.333
  489    H    ALA  67           HN       ALA  67  -6.502   4.708  -3.353
  490    HA   ALA  67           HA       ALA  67  -5.929   7.410  -2.404
  491    HB1  ALA  67           HB1      ALA  67  -8.409   5.972  -1.973
  492    HB2  ALA  67           HB2      ALA  67  -7.623   6.408  -0.456
  493    HB3  ALA  67           HB3      ALA  67  -8.008   7.657  -1.640
  494    H    ASP  68           HN       ASP  68  -3.813   6.414  -2.238
  495    HA   ASP  68           HA       ASP  68  -3.337   4.392  -0.318
  496    HB2  ASP  68           HB2      ASP  68  -1.215   4.489  -1.055
  497    HB3  ASP  68           HB3      ASP  68  -1.810   5.628  -2.251
  498    H    ALA  69           HN       ALA  69  -3.886   7.766  -0.239
  499    HA   ALA  69           HA       ALA  69  -4.352   9.217   1.421
  500    HB1  ALA  69           HB1      ALA  69  -4.550   7.974   3.796
  501    HB2  ALA  69           HB2      ALA  69  -5.837   7.997   2.591
  502    HB3  ALA  69           HB3      ALA  69  -4.767   6.602   2.708
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1   2.224  -0.078   0.207
    2    H2   MET   1           H2       MET   1   2.857  -0.927  -1.119
    3    H3   MET   1           H3       MET   1   2.884  -1.628   0.427
    4    HA   MET   1           HA       MET   1   1.122  -2.403  -1.215
    5    HB2  MET   1           HB2      MET   1   1.244  -2.392   1.506
    6    HB3  MET   1           HB3      MET   1  -0.268  -1.534   1.241
    7    HG2  MET   1           HG2      MET   1  -1.265  -3.494   1.023
    8    HG3  MET   1           HG3      MET   1  -0.366  -3.730  -0.472
    9    HE1  MET   1           HE1      MET   1   1.678  -5.109  -0.774
   10    HE2  MET   1           HE2      MET   1   1.855  -6.594   0.161
   11    HE3  MET   1           HE3      MET   1   0.329  -6.240  -0.652
   12    H    THR   2           HN       THR   2   0.392  -1.206  -2.881
   13    HA   THR   2           HA       THR   2  -0.738   1.371  -2.671
   14    HB   THR   2           HB       THR   2  -1.654  -0.198  -4.955
   15    HG1  THR   2           HG1      THR   2   1.097   0.107  -5.089
   16   HG21  THR   2          HG21      THR   2  -0.644   2.420  -4.337
   17   HG22  THR   2          HG22      THR   2  -1.497   1.874  -5.780
   18   HG23  THR   2          HG23      THR   2   0.259   1.744  -5.692
   19    H    HIS   3           HN       HIS   3  -2.825   2.037  -2.409
   20    HA   HIS   3           HA       HIS   3  -4.851  -0.066  -2.033
   21    HB2  HIS   3           HB2      HIS   3  -4.711   2.731  -0.913
   22    HB3  HIS   3           HB3      HIS   3  -6.138   1.721  -0.802
   23    HD1  HIS   3           HD1      HIS   3  -5.871   1.934   1.821
   24    HD2  HIS   3           HD2      HIS   3  -2.811  -0.116  -0.105
   25    HE1  HIS   3           HE1      HIS   3  -4.643   0.701   3.628
   26    HE2  HIS   3           HE2      HIS   3  -2.671  -0.354   2.470
   27    H    LEU   4           HN       LEU   4  -6.711   0.025  -3.157
   28    HA   LEU   4           HA       LEU   4  -6.815   1.968  -5.351
   29    HB2  LEU   4           HB2      LEU   4  -6.957  -0.619  -5.638
   30    HB3  LEU   4           HB3      LEU   4  -8.613  -0.423  -5.103
   31    HG   LEU   4           HG       LEU   4  -8.550   1.432  -7.058
   32   HD11  LEU   4          HD11      LEU   4  -6.744  -0.766  -8.051
   33   HD12  LEU   4          HD12      LEU   4  -7.312   0.641  -8.950
   34   HD13  LEU   4          HD13      LEU   4  -6.196   0.848  -7.599
   35   HD21  LEU   4          HD21      LEU   4  -9.775  -0.111  -8.386
   36   HD22  LEU   4          HD22      LEU   4  -8.988  -1.493  -7.624
   37   HD23  LEU   4          HD23      LEU   4 -10.118  -0.500  -6.701
   38    H    LYS   5           HN       LYS   5  -8.686   3.195  -5.693
   39    HA   LYS   5           HA       LYS   5 -10.296   3.434  -3.240
   40    HB2  LYS   5           HB2      LYS   5  -8.706   5.336  -4.434
   41    HB3  LYS   5           HB3      LYS   5 -10.311   5.752  -5.015
   42    HG2  LYS   5           HG2      LYS   5 -10.469   5.205  -2.231
   43    HG3  LYS   5           HG3      LYS   5  -9.140   6.331  -2.521
   44    HD2  LYS   5           HD2      LYS   5 -10.579   7.991  -2.844
   45    HD3  LYS   5           HD3      LYS   5 -11.357   7.087  -4.147
   46    HE2  LYS   5           HE2      LYS   5 -13.040   6.354  -2.814
   47    HE3  LYS   5           HE3      LYS   5 -12.011   6.266  -1.380
   48    HZ1  LYS   5           HZ1      LYS   5 -12.277   8.511  -0.956
   49    HZ2  LYS   5           HZ2      LYS   5 -13.824   8.051  -1.475
   50    HZ3  LYS   5           HZ3      LYS   5 -12.780   8.874  -2.532
   51    H    ILE   6           HN       ILE   6 -12.428   3.386  -3.343
   52    HA   ILE   6           HA       ILE   6 -13.585   2.732  -5.959
   53    HB   ILE   6           HB       ILE   6 -14.093   1.803  -3.188
   54   HG12  ILE   6          HG12      ILE   6 -14.827  -0.210  -4.804
   55   HG13  ILE   6          HG13      ILE   6 -13.808   0.689  -5.923
   56   HG21  ILE   6          HG21      ILE   6 -16.396   1.035  -4.605
   57   HG22  ILE   6          HG22      ILE   6 -16.295   2.060  -3.174
   58   HG23  ILE   6          HG23      ILE   6 -16.262   2.786  -4.780
   59   HD11  ILE   6          HD11      ILE   6 -12.917  -0.197  -3.194
   60   HD12  ILE   6          HD12      ILE   6 -12.649  -1.122  -4.670
   61   HD13  ILE   6          HD13      ILE   6 -11.923   0.473  -4.486
   62    H    THR   7           HN       THR   7 -15.145   3.936  -6.836
   63    HA   THR   7           HA       THR   7 -16.598   5.829  -5.134
   64    HB   THR   7           HB       THR   7 -16.281   6.969  -7.745
   65    HG1  THR   7           HG1      THR   7 -14.257   5.677  -7.563
   66   HG21  THR   7          HG21      THR   7 -14.844   8.434  -5.794
   67   HG22  THR   7          HG22      THR   7 -16.256   7.734  -4.998
   68   HG23  THR   7          HG23      THR   7 -16.458   8.748  -6.427
   69    H    GLY   8           HN       GLY   8 -18.733   6.185  -5.738
   70    HA2  GLY   8           HA1      GLY   8 -20.587   6.059  -7.205
   71    HA3  GLY   8           HA2      GLY   8 -19.693   4.926  -8.208
   72    H    MET   9           HN       MET   9 -18.915   3.228  -5.962
   73    HA   MET   9           HA       MET   9 -21.381   1.715  -5.832
   74    HB2  MET   9           HB2      MET   9 -18.875   0.801  -4.487
   75    HB3  MET   9           HB3      MET   9 -20.144  -0.135  -5.236
   76    HG2  MET   9           HG2      MET   9 -19.367   0.895  -7.431
   77    HG3  MET   9           HG3      MET   9 -17.917   1.365  -6.543
   78    HE1  MET   9           HE1      MET   9 -16.861  -0.239  -4.910
   79    HE2  MET   9           HE2      MET   9 -17.718  -1.749  -4.598
   80    HE3  MET   9           HE3      MET   9 -16.217  -1.764  -5.522
   81    H    THR  10           HN       THR  10 -22.205   0.818  -3.870
   82    HA   THR  10           HA       THR  10 -22.396   2.765  -1.790
   83    HB   THR  10           HB       THR  10 -23.470   0.140  -1.140
   84    HG1  THR  10           HG1      THR  10 -24.434   1.356  -3.542
   85   HG21  THR  10          HG21      THR  10 -25.191   2.451  -1.858
   86   HG22  THR  10          HG22      THR  10 -24.094   2.652  -0.491
   87   HG23  THR  10          HG23      THR  10 -25.287   1.353  -0.481
   88    H    CYS  11           HN       CYS  11 -21.501  -0.709  -1.652
   89    HA   CYS  11           HA       CYS  11 -19.361  -0.271   0.195
   90    HB2  CYS  11           HB2      CYS  11 -20.554  -1.461   2.093
   91    HB3  CYS  11           HB3      CYS  11 -20.984   0.218   1.811
   92    HG   CYS  11           HG       CYS  11 -23.081  -1.986   2.355
   93    H    ASP  12           HN       ASP  12 -20.013  -2.794   1.609
   94    HA   ASP  12           HA       ASP  12 -18.419  -4.566   0.347
   95    HB2  ASP  12           HB2      ASP  12 -19.375  -6.323   1.733
   96    HB3  ASP  12           HB3      ASP  12 -19.190  -4.835   2.648
   97    H    SER  13           HN       SER  13 -21.933  -4.350  -0.213
   98    HA   SER  13           HA       SER  13 -22.207  -6.681  -1.735
   99    HB2  SER  13           HB2      SER  13 -23.925  -4.683  -2.817
  100    HB3  SER  13           HB3      SER  13 -24.332  -5.976  -1.688
  101    HG   SER  13           HG       SER  13 -23.990  -4.634   0.006
  102    H    CYS  14           HN       CYS  14 -21.630  -3.356  -2.821
  103    HA   CYS  14           HA       CYS  14 -21.213  -4.038  -5.544
  104    HB2  CYS  14           HB2      CYS  14 -20.896  -1.645  -3.816
  105    HB3  CYS  14           HB3      CYS  14 -19.988  -1.642  -5.324
  106    HG   CYS  14           HG       CYS  14 -21.961  -0.718  -6.688
  107    H    ALA  15           HN       ALA  15 -19.135  -3.657  -2.750
  108    HA   ALA  15           HA       ALA  15 -16.649  -3.673  -4.069
  109    HB1  ALA  15           HB1      ALA  15 -17.453  -4.417  -1.269
  110    HB2  ALA  15           HB2      ALA  15 -15.777  -4.420  -1.819
  111    HB3  ALA  15           HB3      ALA  15 -16.706  -2.921  -1.832
  112    H    ALA  16           HN       ALA  16 -18.823  -6.246  -3.177
  113    HA   ALA  16           HA       ALA  16 -17.026  -8.408  -3.245
  114    HB1  ALA  16           HB1      ALA  16 -19.031  -9.022  -2.328
  115    HB2  ALA  16           HB2      ALA  16 -19.975  -8.119  -3.513
  116    HB3  ALA  16           HB3      ALA  16 -19.234  -9.653  -3.963
  117    H    HIS  17           HN       HIS  17 -19.122  -7.062  -5.771
  118    HA   HIS  17           HA       HIS  17 -18.446  -8.717  -7.893
  119    HB2  HIS  17           HB2      HIS  17 -19.920  -6.368  -7.550
  120    HB3  HIS  17           HB3      HIS  17 -18.680  -5.932  -8.715
  121    HD1  HIS  17           HD1      HIS  17 -21.864  -6.373  -9.152
  122    HD2  HIS  17           HD2      HIS  17 -18.753  -8.863 -10.348
  123    HE1  HIS  17           HE1      HIS  17 -22.770  -7.716 -11.075
  124    HE2  HIS  17           HE2      HIS  17 -20.825  -9.093 -11.887
  125    H    VAL  18           HN       VAL  18 -16.933  -5.707  -6.838
  126    HA   VAL  18           HA       VAL  18 -14.897  -5.625  -8.770
  127    HB   VAL  18           HB       VAL  18 -15.072  -4.424  -6.005
  128   HG11  VAL  18          HG11      VAL  18 -12.990  -3.650  -6.114
  129   HG12  VAL  18          HG12      VAL  18 -12.722  -4.768  -7.452
  130   HG13  VAL  18          HG13      VAL  18 -13.211  -3.103  -7.776
  131   HG21  VAL  18          HG21      VAL  18 -16.568  -3.781  -8.066
  132   HG22  VAL  18          HG22      VAL  18 -15.913  -2.545  -6.993
  133   HG23  VAL  18          HG23      VAL  18 -15.132  -2.871  -8.540
  134    H    LYS  19           HN       LYS  19 -15.009  -7.001  -5.504
  135    HA   LYS  19           HA       LYS  19 -12.329  -7.754  -5.310
  136    HB2  LYS  19           HB2      LYS  19 -14.222  -7.785  -3.530
  137    HB3  LYS  19           HB3      LYS  19 -14.529  -9.413  -4.119
  138    HG2  LYS  19           HG2      LYS  19 -12.006  -9.784  -3.716
  139    HG3  LYS  19           HG3      LYS  19 -12.124  -8.340  -2.710
  140    HD2  LYS  19           HD2      LYS  19 -13.466  -9.367  -1.153
  141    HD3  LYS  19           HD3      LYS  19 -14.111 -10.526  -2.318
  142    HE2  LYS  19           HE2      LYS  19 -11.214 -10.685  -1.746
  143    HE3  LYS  19           HE3      LYS  19 -12.300 -11.170  -0.446
  144    HZ1  LYS  19           HZ1      LYS  19 -12.772 -13.056  -1.485
  145    HZ2  LYS  19           HZ2      LYS  19 -11.495 -12.722  -2.554
  146    HZ3  LYS  19           HZ3      LYS  19 -13.086 -12.276  -2.957
  147    H    GLU  20           HN       GLU  20 -15.117  -9.550  -6.607
  148    HA   GLU  20           HA       GLU  20 -13.659 -11.885  -7.232
  149    HB2  GLU  20           HB2      GLU  20 -16.010 -10.908  -8.840
  150    HB3  GLU  20           HB3      GLU  20 -15.495 -12.565  -8.577
  151    HG2  GLU  20           HG2      GLU  20 -16.379 -12.639  -6.441
  152    HG3  GLU  20           HG3      GLU  20 -16.410 -10.882  -6.287
  153    H    ALA  21           HN       ALA  21 -14.405  -8.983  -9.076
  154    HA   ALA  21           HA       ALA  21 -13.277  -9.788 -11.520
  155    HB1  ALA  21           HB1      ALA  21 -12.939  -7.175 -11.716
  156    HB2  ALA  21           HB2      ALA  21 -14.544  -7.902 -11.783
  157    HB3  ALA  21           HB3      ALA  21 -13.971  -7.170 -10.285
  158    H    LEU  22           HN       LEU  22 -11.914  -8.258  -8.672
  159    HA   LEU  22           HA       LEU  22  -9.324  -7.796  -9.740
  160    HB2  LEU  22           HB2      LEU  22 -10.315  -8.068  -6.906
  161    HB3  LEU  22           HB3      LEU  22  -8.672  -7.629  -7.320
  162    HG   LEU  22           HG       LEU  22 -11.071  -6.025  -8.185
  163   HD11  LEU  22          HD11      LEU  22  -9.909  -4.490  -6.324
  164   HD12  LEU  22          HD12      LEU  22 -11.245  -5.588  -5.975
  165   HD13  LEU  22          HD13      LEU  22  -9.586  -6.081  -5.636
  166   HD21  LEU  22          HD21      LEU  22  -8.203  -5.168  -7.967
  167   HD22  LEU  22          HD22      LEU  22  -8.881  -5.860  -9.440
  168   HD23  LEU  22          HD23      LEU  22  -9.534  -4.356  -8.793
  169    H    GLU  23           HN       GLU  23 -10.743 -10.388  -7.798
  170    HA   GLU  23           HA       GLU  23  -8.293 -11.808  -7.491
  171    HB2  GLU  23           HB2      GLU  23 -11.115 -12.211  -6.757
  172    HB3  GLU  23           HB3      GLU  23 -10.186 -13.686  -6.995
  173    HG2  GLU  23           HG2      GLU  23  -8.443 -12.431  -5.475
  174    HG3  GLU  23           HG3      GLU  23  -9.879 -11.558  -4.946
  175    H    LYS  24           HN       LYS  24 -10.545 -11.591 -10.050
  176    HA   LYS  24           HA       LYS  24  -9.885 -14.145 -11.213
  177    HB2  LYS  24           HB2      LYS  24 -11.634 -13.755 -12.562
  178    HB3  LYS  24           HB3      LYS  24 -11.975 -12.397 -11.507
  179    HG2  LYS  24           HG2      LYS  24 -11.214 -10.850 -13.018
  180    HG3  LYS  24           HG3      LYS  24 -10.137 -11.999 -13.817
  181    HD2  LYS  24           HD2      LYS  24 -12.395 -13.189 -14.446
  182    HD3  LYS  24           HD3      LYS  24 -13.068 -11.581 -14.168
  183    HE2  LYS  24           HE2      LYS  24 -12.475 -11.084 -16.253
  184    HE3  LYS  24           HE3      LYS  24 -10.800 -11.121 -15.701
  185    HZ1  LYS  24           HZ1      LYS  24 -11.016 -12.536 -17.584
  186    HZ2  LYS  24           HZ2      LYS  24 -12.337 -13.356 -16.909
  187    HZ3  LYS  24           HZ3      LYS  24 -10.793 -13.528 -16.224
  188    H    VAL  25           HN       VAL  25  -8.422 -11.113 -11.033
  189    HA   VAL  25           HA       VAL  25  -7.076 -11.181 -13.589
  190    HB   VAL  25           HB       VAL  25  -6.686  -9.414 -11.175
  191   HG11  VAL  25          HG11      VAL  25  -4.801  -9.802 -13.050
  192   HG12  VAL  25          HG12      VAL  25  -5.740  -8.532 -13.835
  193   HG13  VAL  25          HG13      VAL  25  -5.049  -8.258 -12.236
  194   HG21  VAL  25          HG21      VAL  25  -8.607  -8.508 -11.878
  195   HG22  VAL  25          HG22      VAL  25  -7.663  -7.855 -13.216
  196   HG23  VAL  25          HG23      VAL  25  -8.548  -9.366 -13.418
  197    HA   PRO  26           HA       PRO  26  -3.694 -13.636 -11.921
  198    HB2  PRO  26           HB2      PRO  26  -2.415 -13.158 -14.509
  199    HB3  PRO  26           HB3      PRO  26  -2.951 -14.685 -13.800
  200    HG2  PRO  26           HG2      PRO  26  -4.185 -13.547 -15.931
  201    HG3  PRO  26           HG3      PRO  26  -5.044 -14.538 -14.737
  202    HD2  PRO  26           HD2      PRO  26  -4.935 -11.556 -15.001
  203    HD3  PRO  26           HD3      PRO  26  -6.311 -12.603 -14.589
  204    H    GLY  27           HN       GLY  27  -3.034 -12.051 -10.474
  205    HA2  GLY  27           HA1      GLY  27  -0.511 -11.076 -10.593
  206    HA3  GLY  27           HA2      GLY  27  -1.460  -9.785 -11.325
  207    H    VAL  28           HN       VAL  28  -3.725 -10.789  -9.539
  208    HA   VAL  28           HA       VAL  28  -3.077  -9.119  -7.249
  209    HB   VAL  28           HB       VAL  28  -5.637 -10.422  -8.187
  210   HG11  VAL  28          HG11      VAL  28  -6.781  -9.717  -6.327
  211   HG12  VAL  28          HG12      VAL  28  -5.223 -10.109  -5.601
  212   HG13  VAL  28          HG13      VAL  28  -5.625  -8.433  -5.968
  213   HG21  VAL  28          HG21      VAL  28  -5.919  -8.560  -9.363
  214   HG22  VAL  28          HG22      VAL  28  -5.795  -7.595  -7.892
  215   HG23  VAL  28          HG23      VAL  28  -4.345  -7.981  -8.820
  216    H    GLN  29           HN       GLN  29  -2.031 -10.106  -5.620
  217    HA   GLN  29           HA       GLN  29  -2.365 -12.941  -5.136
  218    HB2  GLN  29           HB2      GLN  29  -0.158 -11.729  -4.935
  219    HB3  GLN  29           HB3      GLN  29  -0.792 -10.958  -3.488
  220    HG2  GLN  29           HG2      GLN  29   0.475 -12.738  -2.692
  221    HG3  GLN  29           HG3      GLN  29  -1.186 -13.318  -2.609
  222   HE21  GLN  29          HE21      GLN  29   1.365 -14.774  -2.778
  223   HE22  GLN  29          HE22      GLN  29   1.214 -15.809  -4.165
  224    H    SER  30           HN       SER  30  -3.437  -9.911  -3.772
  225    HA   SER  30           HA       SER  30  -5.452 -11.336  -2.259
  226    HB2  SER  30           HB2      SER  30  -3.837  -9.300  -0.739
  227    HB3  SER  30           HB3      SER  30  -4.912 -10.550  -0.114
  228    HG   SER  30           HG       SER  30  -3.158 -11.941  -1.295
  229    H    ALA  31           HN       ALA  31  -7.306 -10.150  -2.019
  230    HA   ALA  31           HA       ALA  31  -7.216  -7.329  -2.849
  231    HB1  ALA  31           HB1      ALA  31  -8.217  -8.083  -4.735
  232    HB2  ALA  31           HB2      ALA  31  -8.809  -9.554  -3.965
  233    HB3  ALA  31           HB3      ALA  31  -9.659  -8.028  -3.723
  234    H    LEU  32           HN       LEU  32  -7.223  -6.833  -0.598
  235    HA   LEU  32           HA       LEU  32  -9.516  -7.669   0.984
  236    HB2  LEU  32           HB2      LEU  32  -7.023  -6.101   1.586
  237    HB3  LEU  32           HB3      LEU  32  -8.356  -6.170   2.723
  238    HG   LEU  32           HG       LEU  32  -6.797  -8.546   1.704
  239   HD11  LEU  32          HD11      LEU  32  -6.829  -7.372   4.473
  240   HD12  LEU  32          HD12      LEU  32  -5.779  -8.641   3.843
  241   HD13  LEU  32          HD13      LEU  32  -5.601  -6.982   3.268
  242   HD21  LEU  32          HD21      LEU  32  -8.131  -9.920   2.982
  243   HD22  LEU  32          HD22      LEU  32  -8.686  -8.603   4.014
  244   HD23  LEU  32          HD23      LEU  32  -9.309  -8.759   2.372
  245    H    VAL  33           HN       VAL  33 -10.950  -6.542  -0.580
  246    HA   VAL  33           HA       VAL  33 -11.002  -3.685  -0.609
  247    HB   VAL  33           HB       VAL  33 -13.409  -5.371  -1.203
  248   HG11  VAL  33          HG11      VAL  33 -12.568  -3.131  -2.925
  249   HG12  VAL  33          HG12      VAL  33 -14.172  -3.569  -2.335
  250   HG13  VAL  33          HG13      VAL  33 -13.049  -2.707  -1.283
  251   HG21  VAL  33          HG21      VAL  33 -10.848  -5.264  -2.706
  252   HG22  VAL  33          HG22      VAL  33 -11.993  -6.594  -2.520
  253   HG23  VAL  33          HG23      VAL  33 -12.352  -5.268  -3.627
  254    H    SER  34           HN       SER  34 -11.597  -2.444   0.999
  255    HA   SER  34           HA       SER  34 -13.034  -3.615   3.248
  256    HB2  SER  34           HB2      SER  34 -12.060  -0.831   3.422
  257    HB3  SER  34           HB3      SER  34 -11.878  -2.167   4.560
  258    HG   SER  34           HG       SER  34 -10.438  -2.931   2.605
  259    H    TYR  35           HN       TYR  35 -15.133  -3.375   3.380
  260    HA   TYR  35           HA       TYR  35 -16.668  -1.649   1.767
  261    HB2  TYR  35           HB2      TYR  35 -18.275  -3.037   2.380
  262    HB3  TYR  35           HB3      TYR  35 -17.141  -3.836   3.447
  263    HD1  TYR  35           HD1      TYR  35 -19.609  -1.054   3.341
  264    HD2  TYR  35           HD2      TYR  35 -17.558  -3.890   5.758
  265    HE1  TYR  35           HE1      TYR  35 -21.001  -0.415   5.264
  266    HE2  TYR  35           HE2      TYR  35 -18.946  -3.262   7.687
  267    HH   TYR  35           HH       TYR  35 -20.427  -1.779   8.484
  268    HA   PRO  36           HA       PRO  36 -17.288   1.084   5.684
  269    HB2  PRO  36           HB2      PRO  36 -14.940   0.766   7.372
  270    HB3  PRO  36           HB3      PRO  36 -16.644   0.585   7.792
  271    HG2  PRO  36           HG2      PRO  36 -14.924  -1.509   7.691
  272    HG3  PRO  36           HG3      PRO  36 -16.655  -1.662   7.334
  273    HD2  PRO  36           HD2      PRO  36 -14.338  -1.461   5.446
  274    HD3  PRO  36           HD3      PRO  36 -15.773  -2.506   5.363
  275    H    LYS  37           HN       LYS  37 -14.182   0.586   4.224
  276    HA   LYS  37           HA       LYS  37 -13.452   3.390   4.685
  277    HB2  LYS  37           HB2      LYS  37 -11.957   1.105   4.939
  278    HB3  LYS  37           HB3      LYS  37 -11.496   1.668   3.337
  279    HG2  LYS  37           HG2      LYS  37 -10.716   3.737   4.190
  280    HG3  LYS  37           HG3      LYS  37 -11.434   3.428   5.773
  281    HD2  LYS  37           HD2      LYS  37  -9.711   1.257   5.132
  282    HD3  LYS  37           HD3      LYS  37  -8.834   2.762   4.848
  283    HE2  LYS  37           HE2      LYS  37  -8.412   2.700   7.049
  284    HE3  LYS  37           HE3      LYS  37 -10.070   3.278   7.223
  285    HZ1  LYS  37           HZ1      LYS  37 -10.396   0.605   7.024
  286    HZ2  LYS  37           HZ2      LYS  37 -10.335   1.469   8.479
  287    HZ3  LYS  37           HZ3      LYS  37  -8.938   0.713   7.882
  288    H    GLY  38           HN       GLY  38 -14.766   1.352   2.348
  289    HA2  GLY  38           HA1      GLY  38 -15.283   1.635   0.131
  290    HA3  GLY  38           HA2      GLY  38 -14.964   3.348   0.379
  291    H    THR  39           HN       THR  39 -12.597   0.818   0.910
  292    HA   THR  39           HA       THR  39 -11.168   1.678  -1.511
  293    HB   THR  39           HB       THR  39  -9.140   1.286   0.346
  294    HG1  THR  39           HG1      THR  39 -11.203   2.896   1.495
  295   HG21  THR  39          HG21      THR  39 -10.043   3.287  -1.412
  296   HG22  THR  39          HG22      THR  39  -8.475   3.186  -0.613
  297   HG23  THR  39          HG23      THR  39  -9.793   4.079   0.145
  298    H    ALA  40           HN       ALA  40  -9.537   0.177  -2.232
  299    HA   ALA  40           HA       ALA  40 -10.023  -2.555  -1.228
  300    HB1  ALA  40           HB1      ALA  40  -9.985  -1.451  -3.912
  301    HB2  ALA  40           HB2      ALA  40  -8.887  -2.821  -3.740
  302    HB3  ALA  40           HB3      ALA  40 -10.594  -3.002  -3.337
  303    H    GLN  41           HN       GLN  41  -8.383  -3.310  -0.067
  304    HA   GLN  41           HA       GLN  41  -5.696  -2.284  -0.460
  305    HB2  GLN  41           HB2      GLN  41  -6.820  -2.940   1.786
  306    HB3  GLN  41           HB3      GLN  41  -6.411  -4.587   1.328
  307    HG2  GLN  41           HG2      GLN  41  -4.130  -4.192   1.451
  308    HG3  GLN  41           HG3      GLN  41  -4.332  -2.444   1.330
  309   HE21  GLN  41          HE21      GLN  41  -5.219  -5.156   3.424
  310   HE22  GLN  41          HE22      GLN  41  -4.987  -4.305   4.917
  311    H    LEU  42           HN       LEU  42  -4.879  -2.995  -2.365
  312    HA   LEU  42           HA       LEU  42  -5.292  -5.810  -3.049
  313    HB2  LEU  42           HB2      LEU  42  -4.786  -3.344  -4.654
  314    HB3  LEU  42           HB3      LEU  42  -4.374  -4.913  -5.320
  315    HG   LEU  42           HG       LEU  42  -7.105  -4.599  -4.210
  316   HD11  LEU  42          HD11      LEU  42  -6.909  -3.775  -7.002
  317   HD12  LEU  42          HD12      LEU  42  -7.884  -3.120  -5.687
  318   HD13  LEU  42          HD13      LEU  42  -6.202  -2.623  -5.870
  319   HD21  LEU  42          HD21      LEU  42  -7.056  -5.766  -6.761
  320   HD22  LEU  42          HD22      LEU  42  -5.638  -6.379  -5.909
  321   HD23  LEU  42          HD23      LEU  42  -7.244  -6.575  -5.204
  322    H    ALA  43           HN       ALA  43  -3.713  -7.087  -2.465
  323    HA   ALA  43           HA       ALA  43  -0.949  -6.191  -2.497
  324    HB1  ALA  43           HB1      ALA  43  -0.448  -8.048  -1.267
  325    HB2  ALA  43           HB2      ALA  43  -2.157  -7.902  -0.855
  326    HB3  ALA  43           HB3      ALA  43  -1.642  -9.052  -2.089
  327    H    ILE  44           HN       ILE  44  -0.916  -5.712  -4.754
  328    HA   ILE  44           HA       ILE  44  -1.231  -7.887  -6.639
  329    HB   ILE  44           HB       ILE  44  -0.034  -5.842  -8.046
  330   HG12  ILE  44          HG12      ILE  44  -1.800  -3.976  -7.169
  331   HG13  ILE  44          HG13      ILE  44  -1.367  -4.741  -5.643
  332   HG21  ILE  44          HG21      ILE  44  -2.913  -5.546  -7.936
  333   HG22  ILE  44          HG22      ILE  44  -1.880  -6.086  -9.259
  334   HG23  ILE  44          HG23      ILE  44  -2.418  -7.237  -8.035
  335   HD11  ILE  44          HD11      ILE  44   0.051  -2.848  -6.014
  336   HD12  ILE  44          HD12      ILE  44   1.013  -4.319  -6.165
  337   HD13  ILE  44          HD13      ILE  44   0.505  -3.447  -7.610
  338    H    VAL  45           HN       VAL  45   0.423  -8.694  -7.975
  339    HA   VAL  45           HA       VAL  45   2.983  -8.933  -6.702
  340    HB   VAL  45           HB       VAL  45   2.053  -9.865  -9.429
  341   HG11  VAL  45          HG11      VAL  45   4.361 -11.099  -8.024
  342   HG12  VAL  45          HG12      VAL  45   4.035 -10.951  -9.750
  343   HG13  VAL  45          HG13      VAL  45   4.614  -9.556  -8.840
  344   HG21  VAL  45          HG21      VAL  45   1.436 -11.864  -8.492
  345   HG22  VAL  45          HG22      VAL  45   2.534 -11.689  -7.123
  346   HG23  VAL  45          HG23      VAL  45   1.036 -10.760  -7.175
  347    HA   PRO  46           HA       PRO  46   4.758  -5.176  -8.327
  348    HB2  PRO  46           HB2      PRO  46   7.237  -6.797  -7.964
  349    HB3  PRO  46           HB3      PRO  46   6.879  -5.151  -7.426
  350    HG2  PRO  46           HG2      PRO  46   6.851  -7.167  -5.697
  351    HG3  PRO  46           HG3      PRO  46   5.637  -5.877  -5.605
  352    HD2  PRO  46           HD2      PRO  46   5.367  -8.666  -6.631
  353    HD3  PRO  46           HD3      PRO  46   4.192  -7.668  -5.752
  354    H    GLY  47           HN       GLY  47   4.602  -4.799 -10.425
  355    HA2  GLY  47           HA1      GLY  47   5.962  -5.114 -12.553
  356    HA3  GLY  47           HA2      GLY  47   5.629  -6.827 -12.315
  357    H    THR  48           HN       THR  48   3.017  -6.705 -11.432
  358    HA   THR  48           HA       THR  48   1.535  -6.137 -13.815
  359    HB   THR  48           HB       THR  48  -0.046  -6.502 -11.380
  360    HG1  THR  48           HG1      THR  48   1.699  -7.709 -10.648
  361   HG21  THR  48          HG21      THR  48  -0.007  -7.345 -14.152
  362   HG22  THR  48          HG22      THR  48  -1.360  -7.249 -13.024
  363   HG23  THR  48          HG23      THR  48  -0.352  -8.696 -13.071
  364    H    SER  49           HN       SER  49   0.653  -4.251 -14.365
  365    HA   SER  49           HA       SER  49   0.979  -2.020 -12.632
  366    HB2  SER  49           HB2      SER  49  -0.769  -1.528 -14.898
  367    HB3  SER  49           HB3      SER  49   0.816  -0.841 -14.534
  368    HG   SER  49           HG       SER  49   0.139  -2.878 -16.236
  369    HA   PRO  50           HA       PRO  50  -2.883  -2.654 -10.511
  370    HB2  PRO  50           HB2      PRO  50  -2.364  -0.027  -9.308
  371    HB3  PRO  50           HB3      PRO  50  -2.465  -1.611  -8.533
  372    HG2  PRO  50           HG2      PRO  50  -0.131  -0.280  -8.792
  373    HG3  PRO  50           HG3      PRO  50  -0.228  -2.051  -8.837
  374    HD2  PRO  50           HD2      PRO  50   0.036  -0.103 -11.099
  375    HD3  PRO  50           HD3      PRO  50   0.830  -1.677 -10.867
  376    H    ASP  51           HN       ASP  51  -2.081  -0.220 -12.685
  377    HA   ASP  51           HA       ASP  51  -4.399   1.415 -12.551
  378    HB2  ASP  51           HB2      ASP  51  -2.477   2.342 -13.595
  379    HB3  ASP  51           HB3      ASP  51  -2.274   0.945 -14.641
  380    H    ALA  52           HN       ALA  52  -3.613  -1.645 -13.846
  381    HA   ALA  52           HA       ALA  52  -5.661  -1.791 -15.808
  382    HB1  ALA  52           HB1      ALA  52  -5.233  -4.286 -15.637
  383    HB2  ALA  52           HB2      ALA  52  -3.856  -3.284 -16.094
  384    HB3  ALA  52           HB3      ALA  52  -3.997  -3.888 -14.444
  385    H    LEU  53           HN       LEU  53  -5.455  -2.357 -12.407
  386    HA   LEU  53           HA       LEU  53  -7.962  -3.728 -12.154
  387    HB2  LEU  53           HB2      LEU  53  -6.566  -2.201  -9.974
  388    HB3  LEU  53           HB3      LEU  53  -7.622  -3.592  -9.821
  389    HG   LEU  53           HG       LEU  53  -4.919  -3.732 -11.145
  390   HD11  LEU  53          HD11      LEU  53  -4.355  -3.122  -8.973
  391   HD12  LEU  53          HD12      LEU  53  -5.694  -4.027  -8.268
  392   HD13  LEU  53          HD13      LEU  53  -4.304  -4.885  -8.936
  393   HD21  LEU  53          HD21      LEU  53  -5.666  -5.746 -11.735
  394   HD22  LEU  53          HD22      LEU  53  -5.613  -6.177 -10.025
  395   HD23  LEU  53          HD23      LEU  53  -7.111  -5.577 -10.737
  396    H    THR  54           HN       THR  54  -6.784  -0.435 -11.682
  397    HA   THR  54           HA       THR  54  -9.132   0.833 -10.936
  398    HB   THR  54           HB       THR  54  -7.460   2.290 -12.881
  399    HG1  THR  54           HG1      THR  54  -5.854   2.290 -10.910
  400   HG21  THR  54          HG21      THR  54  -9.124   3.249 -11.220
  401   HG22  THR  54          HG22      THR  54  -7.533   4.007 -11.266
  402   HG23  THR  54          HG23      THR  54  -7.936   2.880  -9.972
  403    H    ALA  55           HN       ALA  55  -7.837   0.306 -14.205
  404    HA   ALA  55           HA       ALA  55 -10.081   1.368 -15.563
  405    HB1  ALA  55           HB1      ALA  55  -8.977  -0.450 -17.315
  406    HB2  ALA  55           HB2      ALA  55  -8.494   1.237 -17.134
  407    HB3  ALA  55           HB3      ALA  55  -7.624  -0.027 -16.265
  408    H    ALA  56           HN       ALA  56  -9.293  -1.839 -14.371
  409    HA   ALA  56           HA       ALA  56 -11.362  -3.276 -15.601
  410    HB1  ALA  56           HB1      ALA  56 -10.649  -4.024 -12.828
  411    HB2  ALA  56           HB2      ALA  56 -10.754  -5.016 -14.282
  412    HB3  ALA  56           HB3      ALA  56  -9.341  -3.995 -14.011
  413    H    VAL  57           HN       VAL  57 -11.306  -1.633 -12.433
  414    HA   VAL  57           HA       VAL  57 -14.019  -2.249 -11.842
  415    HB   VAL  57           HB       VAL  57 -12.385  -0.002 -10.699
  416   HG11  VAL  57          HG11      VAL  57 -15.002  -1.220 -10.020
  417   HG12  VAL  57          HG12      VAL  57 -13.960  -0.708  -8.691
  418   HG13  VAL  57          HG13      VAL  57 -14.471   0.459  -9.912
  419   HG21  VAL  57          HG21      VAL  57 -12.711  -2.601  -9.294
  420   HG22  VAL  57          HG22      VAL  57 -11.525  -2.492 -10.596
  421   HG23  VAL  57          HG23      VAL  57 -11.404  -1.421  -9.200
  422    H    ALA  58           HN       ALA  58 -12.416   0.628 -13.212
  423    HA   ALA  58           HA       ALA  58 -14.704   2.214 -13.486
  424    HB1  ALA  58           HB1      ALA  58 -12.001   2.180 -14.606
  425    HB2  ALA  58           HB2      ALA  58 -13.210   2.924 -15.654
  426    HB3  ALA  58           HB3      ALA  58 -12.971   3.529 -14.016
  427    H    GLY  59           HN       GLY  59 -13.536  -0.465 -15.380
  428    HA2  GLY  59           HA1      GLY  59 -15.310  -0.010 -17.603
  429    HA3  GLY  59           HA2      GLY  59 -14.319  -1.435 -17.328
  430    H    LEU  60           HN       LEU  60 -15.687  -1.349 -14.510
  431    HA   LEU  60           HA       LEU  60 -17.828  -3.144 -15.262
  432    HB2  LEU  60           HB2      LEU  60 -16.201  -2.651 -12.914
  433    HB3  LEU  60           HB3      LEU  60 -17.888  -2.891 -12.515
  434    HG   LEU  60           HG       LEU  60 -17.004  -4.904 -14.378
  435   HD11  LEU  60          HD11      LEU  60 -15.544  -4.979 -11.762
  436   HD12  LEU  60          HD12      LEU  60 -15.302  -5.977 -13.196
  437   HD13  LEU  60          HD13      LEU  60 -14.819  -4.281 -13.212
  438   HD21  LEU  60          HD21      LEU  60 -18.922  -5.341 -13.125
  439   HD22  LEU  60          HD22      LEU  60 -17.688  -6.336 -12.352
  440   HD23  LEU  60          HD23      LEU  60 -18.177  -4.808 -11.618
  441    H    GLY  61           HN       GLY  61 -17.807  -0.079 -15.469
  442    HA2  GLY  61           HA1      GLY  61 -19.639   1.361 -15.640
  443    HA3  GLY  61           HA2      GLY  61 -20.579   0.244 -14.662
  444    H    TYR  62           HN       TYR  62 -17.907   0.438 -12.946
  445    HA   TYR  62           HA       TYR  62 -18.995   2.514 -11.212
  446    HB2  TYR  62           HB2      TYR  62 -16.672   0.679 -10.619
  447    HB3  TYR  62           HB3      TYR  62 -17.650   1.582  -9.473
  448    HD1  TYR  62           HD2      TYR  62 -20.351   0.946  -9.955
  449    HD2  TYR  62           HD1      TYR  62 -16.962  -1.583 -10.420
  450    HE1  TYR  62           HE2      TYR  62 -21.781  -1.026  -9.614
  451    HE2  TYR  62           HE1      TYR  62 -18.383  -3.561 -10.080
  452    HH   TYR  62           HH       TYR  62 -21.397  -3.747 -10.472
  453    H    LYS  63           HN       LYS  63 -17.113   3.688  -9.953
  454    HA   LYS  63           HA       LYS  63 -15.187   4.653 -11.956
  455    HB2  LYS  63           HB2      LYS  63 -16.811   6.385 -11.390
  456    HB3  LYS  63           HB3      LYS  63 -16.492   6.157  -9.678
  457    HG2  LYS  63           HG2      LYS  63 -15.315   8.088 -10.243
  458    HG3  LYS  63           HG3      LYS  63 -14.087   6.820 -10.204
  459    HD2  LYS  63           HD2      LYS  63 -13.724   6.926 -12.441
  460    HD3  LYS  63           HD3      LYS  63 -15.414   7.282 -12.804
  461    HE2  LYS  63           HE2      LYS  63 -14.974   9.577 -11.797
  462    HE3  LYS  63           HE3      LYS  63 -13.263   9.168 -11.887
  463    HZ1  LYS  63           HZ1      LYS  63 -13.263   9.247 -14.154
  464    HZ2  LYS  63           HZ2      LYS  63 -14.462  10.407 -13.834
  465    HZ3  LYS  63           HZ3      LYS  63 -14.902   8.836 -14.292
  466    H    ALA  64           HN       ALA  64 -13.249   3.776 -11.488
  467    HA   ALA  64           HA       ALA  64 -12.557   3.506  -8.644
  468    HB1  ALA  64           HB1      ALA  64 -10.983   2.133 -10.758
  469    HB2  ALA  64           HB2      ALA  64 -11.344   1.628  -9.106
  470    HB3  ALA  64           HB3      ALA  64 -12.584   1.513 -10.354
  471    H    THR  65           HN       THR  65 -10.687   4.277  -7.854
  472    HA   THR  65           HA       THR  65  -8.682   5.357  -9.670
  473    HB   THR  65           HB       THR  65  -9.954   7.342  -9.068
  474    HG1  THR  65           HG1      THR  65  -7.939   8.028  -9.151
  475   HG21  THR  65          HG21      THR  65 -11.022   6.608  -7.030
  476   HG22  THR  65          HG22      THR  65 -10.126   8.098  -6.725
  477   HG23  THR  65          HG23      THR  65  -9.462   6.550  -6.207
  478    H    LEU  66           HN       LEU  66  -7.147   6.372  -7.333
  479    HA   LEU  66           HA       LEU  66  -6.808   4.015  -5.676
  480    HB2  LEU  66           HB2      LEU  66  -4.327   3.899  -6.286
  481    HB3  LEU  66           HB3      LEU  66  -5.478   3.184  -7.398
  482    HG   LEU  66           HG       LEU  66  -5.109   5.845  -8.252
  483   HD11  LEU  66          HD11      LEU  66  -2.854   6.252  -8.339
  484   HD12  LEU  66          HD12      LEU  66  -2.989   5.492  -6.754
  485   HD13  LEU  66          HD13      LEU  66  -2.426   4.553  -8.136
  486   HD21  LEU  66          HD21      LEU  66  -5.595   4.216  -9.837
  487   HD22  LEU  66          HD22      LEU  66  -3.895   4.578 -10.139
  488   HD23  LEU  66          HD23      LEU  66  -4.342   3.126  -9.245
  489    H    ALA  67           HN       ALA  67  -5.771   4.384  -3.799
  490    HA   ALA  67           HA       ALA  67  -4.857   7.146  -3.317
  491    HB1  ALA  67           HB1      ALA  67  -6.090   5.255  -1.311
  492    HB2  ALA  67           HB2      ALA  67  -5.632   6.935  -1.039
  493    HB3  ALA  67           HB3      ALA  67  -6.958   6.550  -2.135
  494    H    ASP  68           HN       ASP  68  -2.757   6.521  -3.952
  495    HA   ASP  68           HA       ASP  68  -1.399   4.432  -2.550
  496    HB2  ASP  68           HB2      ASP  68   0.286   4.648  -4.091
  497    HB3  ASP  68           HB3      ASP  68  -1.049   5.321  -5.018
  498    H    ALA  69           HN       ALA  69   0.457   4.730  -1.238
  499    HA   ALA  69           HA       ALA  69   0.828   7.403  -0.110
  500    HB1  ALA  69           HB1      ALA  69  -0.090   6.859   1.842
  501    HB2  ALA  69           HB2      ALA  69  -0.481   5.252   1.225
  502    HB3  ALA  69           HB3      ALA  69   1.068   5.541   2.017